# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-19T07:26:54+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'CrystEngComm') AND volume = 16 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
"1516282","47.182","0.005","9.857","0.005","32.787","0.005","90","0.005","101.008","0.005","90","0.005","14968","8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C60 H60 Cd2 N10 O21 -","- C54 H40 Cd2 N8 O16 -","- C432 H320 Cd16 N64 O128 -","8","1","","Song, Bai-Qiao; Wang, Xin-Long; Yang, Guang-Sheng; Wang, Hai-Ning; Liang, Jun; Shao, Kui-Zhan; Su, Zhong-Min","A polyrotaxane-like metal‒organic framework exhibiting luminescent sensing of Eu3+cations and proton conductivity","CrystEngComm","2014","16","30","6882","","10.1039/C4CE00546E","","","0.71069","MoKα","","0.0706","0.0459","","","0.1196","0.1283","","","","","","0.963","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"7213546","18.6421","0.0019","18.6421","0.0019","18.6421","0.0019","90","","90","","90","","6478.6","1.1","293","2","293","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","catena-(tetra(μ~8~-(5,5',5'',5'''-(adamantane-1,3,5,7-tetrayl)- -tetrakistetrazolato))- -bis(μ~4~-chloro)-octa(N,N-dimethylformamide)-nona-copper(II), dimethylformamide solvate","","- C83 H111 Cl2 Cu9 N73 O9 -","- C83.2 H48 Cl2 Cu9 N73.44 O10 -","- C166.4 H96 Cl4 Cu18 N146.88 O20 -","2","0.0104167","","Boldog, Ishtvan; Domasevitch, Konstantin; Maclaren, Jana K.; Heering, Christian; Makhloufi, Gamall; Janiak, Christoph","A fluorite isoreticular series of porous framework complexes with tetrahedral ligands: new opportunities for azolate PCPs","CrystEngComm","2014","16","2","148","","10.1039/c3ce42162g","","","1.5418","CuKα","","0.0637","0.0629","","","0.1674","0.1682","","","","","","1.109","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213547","18.9532","0.0003","18.9532","0.0003","31.3238","0.0012","90","","90","","90","","11252.3","0.5","100","2","100","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","catena-(bis(μ~8~-(5,5',5'',5'''-((adamantane-1,3,5,7-tetrayl)- -tetra-(phen-4-yl))-tetrakistetrazolato))- -(μ~4~-chloro)-trichloro-tetra-(N,N-dimethylacetamide)- hexa-copper(ii), dimethylacetamide, methanol and water solvate","","- C76 H56 Cl4 Cu6 N32 -","- C76 H56 Cl4 Cu6 N32 O4 -","- C152 H112 Cl8 Cu12 N64 O8 -","2","0.0625","","Boldog, Ishtvan; Domasevitch, Konstantin; Maclaren, Jana K.; Heering, Christian; Makhloufi, Gamall; Janiak, Christoph","A fluorite isoreticular series of porous framework complexes with tetrahedral ligands: new opportunities for azolate PCPs","CrystEngComm","2014","16","2","148","","10.1039/c3ce42162g","","","0.71073","MoKα","","0.0732","0.055","","","0.1568","0.1673","","","","","","1.088","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213548","19.7788","0.0005","19.7788","0.0005","31.6321","0.0007","90","","90","","90","","12374.5","0.5","220","2","220","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","catena-(bis(μ~8~-(5,5',5'',5'''-((adamantane-1,3,5,7-tetrayl)- -tetra-(phen-4-yl))-tetrakistetrazolato))- -(μ~4~-chloro)-tri-(chloro)-hexa-(N,N-dimethylformamide)- hexa-cadmium(ii), dimethylformamide and water solvate","","- C76 H56 Cd6 Cl4 N32 -","- C76 H56 Cd6 Cl4 N32 O6 -","- C152 H112 Cd12 Cl8 N64 O12 -","2","0.0625","","Boldog, Ishtvan; Domasevitch, Konstantin; Maclaren, Jana K.; Heering, Christian; Makhloufi, Gamall; Janiak, Christoph","A fluorite isoreticular series of porous framework complexes with tetrahedral ligands: new opportunities for azolate PCPs","CrystEngComm","2014","16","2","148","","10.1039/c3ce42162g","","","0.71073","MoKα","","0.0536","0.0414","","","0.1185","0.1228","","","","","","0.972","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213549","6.0892","0.0007","6.5384","0.0007","16.9014","0.0018","80.756","0.002","84.572","0.002","62.398","0.002","588.42","0.11","115","2","115","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H15 O2 -","- C15 H15 O2 -","- C30 H30 O4 -","2","1","","Iwase, Noriaki; Shigeno, Yuta; Wakabayashi, Takashi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Molecular recognition of a large bisphenol A derivative, α,α′-bis(4-hydroxyphenyl)-1,4-diisopropylbenzene, using p-benzoquinone derivatives","CrystEngComm","2014","16","2","159","","10.1039/c3ce41432a","","","0.71073","MoKα","","0.0602","0.0485","","","0.1204","0.1279","","","","","","1.037","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213550","6.5163","0.0004","29.4058","0.0019","11.3547","0.0007","90","","90.999","0.001","90","","2175.4","0.2","115","2","115","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H30 O3 -","- C28 H30 O3 -","- C112 H120 O12 -","4","1","","Iwase, Noriaki; Shigeno, Yuta; Wakabayashi, Takashi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Molecular recognition of a large bisphenol A derivative, α,α′-bis(4-hydroxyphenyl)-1,4-diisopropylbenzene, using p-benzoquinone derivatives","CrystEngComm","2014","16","2","159","","10.1039/c3ce41432a","","","0.71073","MoKα","","0.0804","0.0559","","","0.1194","0.1298","","","","","","1.034","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213551","6.5284","0.0005","29.274","0.002","11.3182","0.0008","90","","91.019","0.001","90","","2162.7","0.3","115","2","115","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27.5 H28.5 Cl0.5 O3 -","- C27.5 H28.5 Cl0.5 O3 -","- C110 H114 Cl2 O12 -","4","1","","Iwase, Noriaki; Shigeno, Yuta; Wakabayashi, Takashi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Molecular recognition of a large bisphenol A derivative, α,α′-bis(4-hydroxyphenyl)-1,4-diisopropylbenzene, using p-benzoquinone derivatives","CrystEngComm","2014","16","2","159","","10.1039/c3ce41432a","","","0.71073","MoKα","","0.0857","0.0639","","","0.1277","0.1368","","","","","","1.089","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213552","17.278","0.002","17.861","0.002","18.092","0.002","82.207","0.005","71.356","0.005","66.625","0.004","4855.8","1","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H234 Cd2 Ce4 Cl14 N66 O107 -","- C96 H96 Cd2 Ce4 Cl14 N66 O62 -","- C96 H96 Cd2 Ce4 Cl14 N66 O62 -","1","0.5","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.0979","0.0679","","","0.1885","0.2087","","","","","","0.969","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213553","17.1436","0.0006","18.0998","0.0006","18.3169","0.0006","84.896","0.001","65.733","0.001","71.546","0.001","4909.4","0.3","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H240 Cd2 Cl14 N66 Nd4 O110 -","- C96 H96 Cd2 Cl14 N66 Nd4 O62 -","- C96 H96 Cd2 Cl14 N66 Nd4 O62 -","1","0.5","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.0777","0.0594","","","0.176","0.1934","","","","","","1.031","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213554","17.0632","0.001","18.0202","0.001","18.284","0.001","84.728","0.002","65.772","0.002","71.667","0.002","4862.1","0.5","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H250 Cd2 Cl14 N66 O115 Sm4 -","- C96 H96 Cd2 Cl14 N66 O62 Sm4 -","- C96 H96 Cd2 Cl14 N66 O62 Sm4 -","1","0.5","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.0878","0.0687","","","0.2066","0.2254","","","","","","1.126","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213555","17.0389","0.0017","17.9558","0.0017","18.3397","0.0019","84.823","0.004","65.727","0.004","71.616","0.004","4848.9","0.9","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H284 Cd2 Cl14 Eu4 N66 O132 -","- C96 H96 Cd2 Cl14 Eu4 N66 O62 -","- C96 H96 Cd2 Cl14 Eu4 N66 O62 -","1","0.5","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1313","0.1102","","","0.3205","0.3432","","","","","","1.251","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213556","28.3249","0.0019","28.3249","0.0019","21.949","0.003","90","","90","","90","","17610","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H229 Cl4 Gd N64 O98 -","- C96 H96 Cl4 Gd N64 O36 -","- C384 H384 Cl16 Gd4 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.125","0.0894","","","0.2683","0.2925","","","","","","1.055","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213557","28.3123","0.0019","28.3123","0.0019","21.934","0.003","90","","90","","90","","17582","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H235 Cl4 N64 O101 Tb -","- C96 H96 Cl4 N64 O36 Tb -","- C384 H384 Cl16 N256 O144 Tb4 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1109","0.0791","","","0.2312","0.2506","","","","","","1.038","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213558","28.464","0.004","28.464","0.004","21.992","0.003","90","","90","","90","","17818","4","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H239 Cl4 Ho N64 O103 -","- C96 H96 Cl4 Ho N64 O36 -","- C384 H384 Cl16 Ho4 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1202","0.0832","","","0.2333","0.2562","","","","","","0.992","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213559","28.44","0.003","28.44","0.003","22.01","0.005","90","","90","","90","","17802","5","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H241 Cl4 Er N64 O104 -","- C96 H96 Cl4 Er0.9998 N64 O36 -","- C384 H384 Cl16 Er3.9992 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1363","0.0752","","","0.2098","0.2323","","","","","","0.944","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213560","28.4011","0.0018","28.4011","0.0018","21.939","0.003","90","","90","","90","","17696","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H247 Cl4 N64 O107 Tm -","- C96 H96 Cl4 N64 O36 Tm -","- C384 H384 Cl16 N256 O144 Tm4 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.148","0.088","","","0.2448","0.2711","","","","","","0.967","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213561","28.388","0.003","28.388","0.003","22.036","0.005","90","","90","","90","","17758","5","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H237 Cl4 N64 O102 Yb -","- C96 H96 Cl4 N64 O36 Yb -","- C384 H384 Cl16 N256 O144 Yb4 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1579","0.0893","","","0.2612","0.2945","","","","","","0.948","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213562","28.3363","0.0019","28.3363","0.0019","21.928","0.003","90","","90","","90","","17607","3","223","2","223","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C96 H241 Cl3.5 Lu N64 O104 -","- C96 H96 Cl4 Lu N64 O36 -","- C384 H384 Cl16 Lu4 N256 O144 -","4","0.25","","Cheng, Xiao-Jie; Ji, Ning-Ning; Zhao, Yi; Liang, Li-Li; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Zhu, Qian-Jiang; Tao, Zhu","[CdCl4]2− anion-induced coordination of Ln3+ to cucurbit[8]uril and the formation of supramolecular self-assemblies: potential application in isolation of light lanthanides","CrystEngComm","2014","16","2","144","","10.1039/c3ce41769g","","","0.71073","MoKα","","0.1176","0.0775","","","0.2289","0.2475","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213563","22.228","0.008","8.878","0.003","17.393","0.005","86.265","0.014","82.354","0.014","79.121","0.011","3337.9","1.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[di(2-pyridylmethyl)aminecopper(II)]-(μ~2~-1,2-bis(4-pyridyl)ethane) Tetraperchlorate Dihydrate","","- C36 H42 Cl4 Cu2 N8 O18 -","- C36 H38 Cl4 Cu2 N8 O18 -","- C108 H114 Cl12 Cu6 N24 O54 -","3","1.5","","Massoud, Salah S.; Taylor, Eric; Liu, Yuemin; Grebowicz, Janusz; Vicente, Ramon; Lalancette, Roger; Mukhopadhyay, Udai; Bernal, Ivan; Watkins, Steven F.","Synthesis, structure, thermal, magnetic properties and quantum mechanical calculations of bridged [bis(di(2-methylpyridyl)amine)-(μ2-1,2-bis(4-pyridyl)ethane)-tetraperchlorato-dicopper(ii)] dihydrate complex","CrystEngComm","2014","16","2","175","","10.1039/c3ce41821a","","x-ray","0.7107","MoKα","","","0.0771","","","","0.2206","","","","","","1.047","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213564","8.529","0.004","8.617","0.004","17.434","0.011","86.31","0.04","81.71","0.03","62.9","0.02","1128.7","1.1","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","Bis[di(2-pyridylmethyl)aminecopper(II)]-(μ~2~-1,2-bis(4-pyridyl)ethane) Tetraperchlorate Dihydrate","","- C36 H42 Cl4 Cu2 N8 O18 -","- C36 H38 Cl4 Cu2 N8 O18 -","- C36 H38 Cl4 Cu2 N8 O18 -","1","0.5","","Massoud, Salah S.; Taylor, Eric; Liu, Yuemin; Grebowicz, Janusz; Vicente, Ramon; Lalancette, Roger; Mukhopadhyay, Udai; Bernal, Ivan; Watkins, Steven F.","Synthesis, structure, thermal, magnetic properties and quantum mechanical calculations of bridged [bis(di(2-methylpyridyl)amine)-(μ2-1,2-bis(4-pyridyl)ethane)-tetraperchlorato-dicopper(ii)] dihydrate complex","CrystEngComm","2014","16","2","175","","10.1039/c3ce41821a","","x-ray","0.7107","MoKα","","","0.0904","","","","0.2443","","","","","","1.071","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213565","8.569","0.003","8.666","0.003","17.564","0.007","87.05","0.02","82","0.02","62.917","0.013","1149.9","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis[di(2-pyridylmethyl)aminecopper(II)]-(μ~2~-1,2-bis(4-pyridyl)ethane) Tetraperchlorate Dihydrate","","- C36 H42 Cl4 Cu2 N8 O18 -","- C36 H38 Cl4 Cu2 N8 O18 -","- C36 H38 Cl4 Cu2 N8 O18 -","1","0.5","","Massoud, Salah S.; Taylor, Eric; Liu, Yuemin; Grebowicz, Janusz; Vicente, Ramon; Lalancette, Roger; Mukhopadhyay, Udai; Bernal, Ivan; Watkins, Steven F.","Synthesis, structure, thermal, magnetic properties and quantum mechanical calculations of bridged [bis(di(2-methylpyridyl)amine)-(μ2-1,2-bis(4-pyridyl)ethane)-tetraperchlorato-dicopper(ii)] dihydrate complex","CrystEngComm","2014","16","2","175","","10.1039/c3ce41821a","","x-ray","0.7107","MoKα","","","0.0484","","","","0.1261","","","","","","1.065","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213566","4.26162","0.00009","12.71748","0.00028","13.95174","0.00031","90","","98.2979","0.0009","90","","748.23","0.03","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 Br D5 I N -","- C5 Br D5 I N -","- C20 Br4 D20 I4 N4 -","4","1","","Jones, Richard H.; Knight, Kevin S.; Marshall, William G.; Clews, John; Darton, Richard J.; Pyatt, Daniel; Coles, Simon J.; Horton, Peter N.","Colossal thermal expansion and negative thermal expansion in simple halogen bonded complexes","CrystEngComm","2014","16","2","237","","10.1039/c3ce41909f","powder diffraction","neutron","","neutron","","","","","","","","0.09156","","2.88","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213567","4.2564","0.0001","12.7251","0.0004","13.9443","0.0003","90","","98.358","0.002","90","","747.25","0.03","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 Br I N -","- C5 H5 Br I N -","- C20 H20 Br4 I4 N4 -","4","1","","Jones, Richard H.; Knight, Kevin S.; Marshall, William G.; Clews, John; Darton, Richard J.; Pyatt, Daniel; Coles, Simon J.; Horton, Peter N.","Colossal thermal expansion and negative thermal expansion in simple halogen bonded complexes","CrystEngComm","2014","16","2","237","","10.1039/c3ce41909f","","","0.71073","MoKα","","0.0267","0.0251","","0.0647","0.0642","0.0647","","","","","","0.9808","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213568","4.3813","0.0002","12.6339","0.0005","14.1942","0.0004","90","","97.706","0.002","90","","778.59","0.05","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 Br I N -","- C5 H5 Br I N -","- C20 H20 Br4 I4 N4 -","4","1","","Jones, Richard H.; Knight, Kevin S.; Marshall, William G.; Clews, John; Darton, Richard J.; Pyatt, Daniel; Coles, Simon J.; Horton, Peter N.","Colossal thermal expansion and negative thermal expansion in simple halogen bonded complexes","CrystEngComm","2014","16","2","237","","10.1039/c3ce41909f","","","0.71073","MoKα","","0.0455","0.0363","","0.1079","0.1009","0.1079","","","","","","1.0417","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213569","4.1628","0.0002","12.3376","0.0007","13.9514","0.0007","90","","95.073","0.004","90","","713.72","0.06","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 Cl I N -","- C5 H5 Cl I N -","- C20 H20 Cl4 I4 N4 -","4","1","","Jones, Richard H.; Knight, Kevin S.; Marshall, William G.; Clews, John; Darton, Richard J.; Pyatt, Daniel; Coles, Simon J.; Horton, Peter N.","Colossal thermal expansion and negative thermal expansion in simple halogen bonded complexes","CrystEngComm","2014","16","2","237","","10.1039/c3ce41909f","","","0.71073","MoKα","","0.027","0.0243","","0.0486","0.046","0.0486","","","","","","1.0147","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213570","4.2746","0.0002","12.3214","0.0008","14.1019","0.0008","90","","94.883","0.004","90","","740.04","0.07","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 Cl I N -","- C5 H5 Cl I N -","- C20 H20 Cl4 I4 N4 -","4","1","","Jones, Richard H.; Knight, Kevin S.; Marshall, William G.; Clews, John; Darton, Richard J.; Pyatt, Daniel; Coles, Simon J.; Horton, Peter N.","Colossal thermal expansion and negative thermal expansion in simple halogen bonded complexes","CrystEngComm","2014","16","2","237","","10.1039/c3ce41909f","","","0.71073","MoKα","","0.0399","0.032","","0.0537","0.0482","0.0537","","","","","","1.0139","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213571","11.642","0.0009","4.6349","0.0004","18.8292","0.0018","90","","95.453","0.005","90","","1011.42","0.15","91","2","91","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(2-methoxybenzyl)-1,3,4-thiadiazole-2(3H)-thione","","- C10 H10 N2 O2 S -","- C10 H10 N2 O2 S -","- C40 H40 N8 O8 S4 -","4","1","","Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim","Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones","CrystEngComm","2014","16","2","164","","10.1039/c3ce42000k","","","0.71073","MoKα","","0.0457","0.0335","","","0.0736","0.0795","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213572","8.6916","0.0007","13.2144","0.0011","8.9458","0.0007","90","","93.96","0.004","90","","1025.01","0.14","91","2","91","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(3-methoxybenzyl)-1,3,4-thiadiazole-2(3H)-thione","","- C10 H10 N2 O2 S -","- C10 H10 N2 O2 S -","- C40 H40 N8 O8 S4 -","4","1","","Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim","Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones","CrystEngComm","2014","16","2","164","","10.1039/c3ce42000k","","","0.71073","MoKα","","0.0479","0.0398","","","0.0938","0.0993","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213573","7.5365","0.0003","5.5019","0.0003","24.9737","0.0012","90","","92.956","0.002","90","","1034.16","0.09","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(4-methoxybenzyl)-1,3,4-thiadiazole-2(3H)-thione","","- C10 H10 N2 O2 S -","- C10 H10 N2 O2 S -","- C40 H40 N8 O8 S4 -","4","1","","Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim","Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones","CrystEngComm","2014","16","2","164","","10.1039/c3ce42000k","","","0.71073","MoKα","","0.0423","0.0364","","","0.0889","0.0933","","","","","","1.046","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213574","9.8668","0.0008","6.9888","0.0006","16.1978","0.0013","90","","98.855","0.004","90","","1103.64","0.16","92","2","92","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(2-methoxyphenethyl)-1,3,4-thiadiazole-2(3H)-thione","","- C11 H12 N2 O2 S -","- C11 H12 N2 O2 S -","- C44 H48 N8 O8 S4 -","4","1","","Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim","Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones","CrystEngComm","2014","16","2","164","","10.1039/c3ce42000k","","","0.71073","MoKα","","0.0407","0.0335","","","0.0876","0.0924","","","","","","1.072","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213575","7.8075","0.0008","11.2905","0.0013","13.2898","0.0018","88.359","0.007","80.741","0.006","73.514","0.006","1108.5","0.2","92","2","92","2","","","","","","","","5","P -1","-P 1","2","","5-(4-methoxyphenethyl)-1,3,4-thiadiazole-2(3H)-thione","","- C11 H12 N2 O2 S -","- C11 H12 N2 O2 S -","- C44 H48 N8 O8 S4 -","4","2","","Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim","Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones","CrystEngComm","2014","16","2","164","","10.1039/c3ce42000k","","","0.71073","MoKα","","0.0788","0.0566","","","0.1502","0.1733","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213576","11.4959","0.0007","19.4686","0.0012","18.3104","0.0011","90","","105.464","0.001","90","","3949.7","0.4","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 Mo5 N6 O22 P2 -","- C28 H32 Mo5 N6 O22 P2 -","- C112 H128 Mo20 N24 O88 P8 -","4","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0165","0.0154","","","0.0394","0.0401","","","","","","0.93","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213577","11.1778","0.0007","11.1778","0.0007","27.641","0.0017","90","","90","","120","","2990.9","0.3","90","2","90","2","","","","","","","","6","P 32","P 32","145","","","","- C28 H30 Mo5 N6 O21 P2 -","- C28 H30 Mo5 N6 O21 P2 -","- C84 H90 Mo15 N18 O63 P6 -","3","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.035","0.0338","","","0.0902","0.0908","","","","","","1.049","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213578","23.327","0.003","21.115","0.003","9.7462","0.0014","90","","90","","90","","4800.5","1.1","90","2","90","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C38 H35 Co Mo5 N6 O23 P2 -","- C38 H32 Co Mo5 N6 O23 P2 -","- C152 H128 Co4 Mo20 N24 O92 P8 -","4","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0494","0.0395","","","0.0864","0.0903","","","","","","1.03","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213579","14.574","0.003","17.358","0.003","20.413","0.004","90","","90","","90","","5164","1.7","90","2","90","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C38 H47 Co Mo5 N6 O28 P2 -","- C38 H44 Co Mo5 N6 O28 P2 -","- C152 H176 Co4 Mo20 N24 O112 P8 -","4","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0478","0.0377","","","0.0735","0.0766","","","","","","0.973","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213580","13.0366","0.0013","13.0703","0.0013","20.989","0.002","76.271","0.003","85.514","0.003","60.541","0.003","3021.9","0.5","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H52 Cu2 Mo5 N8 O27 P2 -","- C48 H46 Cu2 Mo5 N8 O24 P2 -","- C96 H92 Cu4 Mo10 N16 O48 P4 -","2","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0678","0.0457","","","0.1376","0.1533","","","","","","1.041","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213581","13.4404","0.0014","21.237","0.002","18.1894","0.0014","90","","118.357","0.006","90","","4568.9","0.8","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H40 Cu2 Mo5 N4 O29 P2 -","- C32 H40 Cu2 Mo5 N4 O29 P2 -","- C128 H160 Cu8 Mo20 N16 O116 P8 -","4","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0505","0.035","","","0.0743","0.0822","","","","","","1.108","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213582","53.884","0.003","9.5839","0.0005","18.7832","0.0009","90","","91.589","0.001","90","","9696.3","0.9","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H34 Cu2 Mo5 N4 O26 P3 -","- C36 H34 Cu2 Mo5 N4 O26 P3 -","- C288 H272 Cu16 Mo40 N32 O208 P24 -","8","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0476","0.0317","","","0.062","0.0661","","","","","","1.033","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213583","15.6642","0.0011","17.0366","0.0013","18.1045","0.0013","90","","110.366","0.001","90","","4529.4","0.6","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H42 Mo5 N4 Ni O29 P2 -","- C28 H42 Mo5 N4 Ni O29 P2 -","- C112 H168 Mo20 N16 Ni4 O116 P8 -","4","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0229","0.0183","","","0.0428","0.0448","","","","","","1.031","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213584","14.3824","0.0013","23.955","0.002","20.6777","0.0019","90","","100.325","0.002","90","","7008.7","1.1","90","2","90","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H58 Mo6 N12 Ni2 O33 P2 -","- C56 H56 Mo6 N12 Ni2 O33 P2 -","- C224 H224 Mo24 N48 Ni8 O132 P8 -","4","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0909","0.0487","","","0.0981","0.1154","","","","","","0.943","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213585","24.135","0.004","11.8418","0.0018","20.308","0.003","90","","112.14","0.004","90","","5376.1","1.5","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 Mo2 N3 Ni O15 P2 -","- C20 H22 Mo2 N3 Ni O15 P2 -","- C160 H176 Mo16 N24 Ni8 O120 P16 -","8","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0508","0.0428","","","0.1143","0.1189","","","","","","1.023","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213586","17.3753","0.0012","11.3661","0.0008","22.3579","0.0015","90","","103.118","0.001","90","","4300.2","0.5","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Mo5 N6 Ni2 O25 P2 -","- C28 H30 Mo5 N6 Ni2 O25 P2 -","- C112 H120 Mo20 N24 Ni8 O100 P8 -","4","0.5","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0442","0.0317","","","0.0636","0.0672","","","","","","1.033","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213587","10.9305","0.0012","12.2497","0.0014","16.2618","0.0018","85.669","0.002","76.269","0.002","66.823","0.002","1944.1","0.4","90","2","90","2","","","","","","","","8","P -1","-P 1","2","","","","- C32 H35 Cu2 F3 Mo2 N4 O16 P2 -","- C32 H34 Cu2 F3 Mo2 N4 O16 P2 -","- C64 H68 Cu4 F6 Mo4 N8 O32 P4 -","2","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0582","0.0411","","","0.1162","0.1279","","","","","","1.047","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213588","8.9981","0.0006","20.6917","0.0016","21.1555","0.0016","113.586","0.002","96.089","0.002","95.629","0.002","3546.5","0.5","90","2","90","2","","","","","","","","8","P -1","-P 1","2","","","","- C61 H56 Cu3 F7 Mo4 N9 O23 P4 -","- C61 H56 Cu3 F7 Mo4 N9 O23 P4 -","- C122 H112 Cu6 F14 Mo8 N18 O46 P8 -","2","1","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0605","0.0351","","","0.0633","0.0705","","","","","","1.007","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213589","8.562","0.002","19.809","0.005","13.219","0.003","90","","103.447","0.003","90","","2180.5","0.9","90","2","90","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H36 Cu3 F2 Mo2 N4 O18 P4 -","- C36 H36 Cu3 F2 Mo2 N4 O18 P4 -","- C72 H72 Cu6 F4 Mo4 N8 O36 P8 -","2","0.5","","Smith, Tiffany M.; Perkins, Kathryn; Symester, Diona; Freund, Steve R.; Vargas, Jose; Spinu, Leonard; Zubieta, Jon","Solid state coordination chemistry of oxomolybdenum‒organodiphosphonate materials: consequences of introducing xylyldiphosphonate components","CrystEngComm","2014","16","2","191","","10.1039/c3ce41728j","","","0.71073","MoKα","","0.0573","0.0485","","","0.1262","0.1302","","","","","","1.062","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213590","6.309","0.0006","10.7274","0.0009","6.3907","0.0006","90","","90","","90","","432.52","0.07","100","2","100","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C3 H3 Br O2 -","- C3 H3 Br O2 -","- C12 H12 Br4 O8 -","4","0.5","","Deringer, Volker L.; Pan, Fangfang; George, Janine; Müller, Paul; Dronskowski, Richard; Englert, Ulli","Intermolecular contacts in bromomalonic aldehyde—intuition, experiment, and theory","CrystEngComm","2014","16","2","135","","10.1039/c3ce41779d","","","0.71073","MoKα","","0.0526","0.0384","","","0.0792","0.083","","","","","","0.999","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213591","6.503","0.013","10.85","0.02","6.429","0.013","90","","90","","90","","453.6","1.5","291","2","291","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C3 H3 Br O2 -","- C3 H3 Br O2 -","- C12 H12 Br4 O8 -","4","0.5","","Deringer, Volker L.; Pan, Fangfang; George, Janine; Müller, Paul; Dronskowski, Richard; Englert, Ulli","Intermolecular contacts in bromomalonic aldehyde—intuition, experiment, and theory","CrystEngComm","2014","16","2","135","","10.1039/c3ce41779d","","","0.71073","MoKα","","0.0212","0.019","","","0.0398","0.0406","","","","","","1.033","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213592","20.8479","0.0005","35.6759","0.0009","38.2974","0.0008","90","","92.107","0.002","90","","28465.1","1.2","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C26 H239 Fe6 Ge6 K9 N26 O282 Sm6 W60 -","- C12 H60 Fe6 Ge6 K9 N12 O282 Sm6 W60 -","- C48 H240 Fe24 Ge24 K36 N48 O1128 Sm24 W240 -","4","0.5","","Wang, Jun; Zhao, Jun-Wei; Zhao, Hai-Yan; Yang, Bai-Feng; He, Huan; Yang, Guo-Yu","Syntheses, structures and properties of two multi-iron‒samarium/multi-iron substituted germanotungstates","CrystEngComm","2014","16","2","252","","10.1039/c3ce42023j","","","0.71073","MoKα","","0.0795","0.0491","","","0.1024","0.1127","","","","","","1.069","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213593","20.7644","0.0004","25.0049","0.0006","22.6513","0.0005","90","","100.729","0.002","90","","11555.2","0.4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H87 Fe6 Ge3 K N12 O107 W24 -","- C2 H10 Fe6 Ge3 K N2 O104 W24 -","- C8 H40 Fe24 Ge12 K4 N8 O416 W96 -","4","1","","Wang, Jun; Zhao, Jun-Wei; Zhao, Hai-Yan; Yang, Bai-Feng; He, Huan; Yang, Guo-Yu","Syntheses, structures and properties of two multi-iron‒samarium/multi-iron substituted germanotungstates","CrystEngComm","2014","16","2","252","","10.1039/c3ce42023j","","","0.71073","MoKα","","0.1123","0.0667","","","0.166","0.1867","","","","","","1.071","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213594","14.0054","0.0003","15.1789","0.0003","18.5649","0.0003","90","","94.108","0.002","90","","3936.51","0.13","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 Ag2 Cd I2 N4 O11 -","- C36 H28 Ag2 Cd I2 N4 O11 -","- C144 H112 Ag8 Cd4 I8 N16 O44 -","4","1","","Wei, Yong-Li; Li, Xiao-Yuan; Kang, Ting-Ting; Wang, Su-Na; Zang, Shuang-Quan","A series of Ag(i)‒Cd(ii) hetero- and Ag(i) homo-nuclear coordination polymers based on 5-iodo-isophthalic acid and N-donor ancillary ligands","CrystEngComm","2014","16","2","223","","10.1039/c3ce41714j","","","0.71073","MoKα","","0.0566","0.0398","","","0.0758","0.0806","","","","","","1.082","","","","has coordinates,has disorder","180466","2020-10-21","18:00:00",""
"7213595","15.794","0.0005","13.4071","0.0006","17.8147","0.0008","90","","93.021","0.003","90","","3767.1","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H24 Ag2 Cd I2 N4 O9 -","- C40 H24 Ag2 Cd I2 N4 O9 -","- C160 H96 Ag8 Cd4 I8 N16 O36 -","4","1","","Wei, Yong-Li; Li, Xiao-Yuan; Kang, Ting-Ting; Wang, Su-Na; Zang, Shuang-Quan","A series of Ag(i)‒Cd(ii) hetero- and Ag(i) homo-nuclear coordination polymers based on 5-iodo-isophthalic acid and N-donor ancillary ligands","CrystEngComm","2014","16","2","223","","10.1039/c3ce41714j","","","0.71073","MoKα","","0.0831","0.0675","","","0.1563","0.1624","","","","","","1.061","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213596","26.099","0.0017","8.7015","0.0003","15.0839","0.0009","90","","116.468","0.008","90","","3066.5","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Ag2 I N O4 -","- C14 H10 Ag2 I N O4 -","- C112 H80 Ag16 I8 N8 O32 -","8","1","","Wei, Yong-Li; Li, Xiao-Yuan; Kang, Ting-Ting; Wang, Su-Na; Zang, Shuang-Quan","A series of Ag(i)‒Cd(ii) hetero- and Ag(i) homo-nuclear coordination polymers based on 5-iodo-isophthalic acid and N-donor ancillary ligands","CrystEngComm","2014","16","2","223","","10.1039/c3ce41714j","","","0.71073","MoKα","","0.0475","0.0387","","","0.0882","0.0928","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213597","9.2367","0.0009","9.3456","0.0008","13.4445","0.0011","88.897","0.007","71.282","0.008","67.893","0.008","1011.53","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H15 Ag2 I N2 O4 -","- C20 H15 Ag2 I N2 O4 -","- C40 H30 Ag4 I2 N4 O8 -","2","1","","Wei, Yong-Li; Li, Xiao-Yuan; Kang, Ting-Ting; Wang, Su-Na; Zang, Shuang-Quan","A series of Ag(i)‒Cd(ii) hetero- and Ag(i) homo-nuclear coordination polymers based on 5-iodo-isophthalic acid and N-donor ancillary ligands","CrystEngComm","2014","16","2","223","","10.1039/c3ce41714j","","","0.71073","MoKα","","0.0466","0.0332","","","0.0665","0.0717","","","","","","1.001","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213598","11.2576","0.0004","12.6293","0.0004","16.9504","0.0005","102.542","0.003","93.087","0.003","106.942","0.003","2232.56","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H34 Ag4 I2 N8 O8 -","- C44 H34 Ag4 I2 N8 O8 -","- C88 H68 Ag8 I4 N16 O16 -","2","1","","Wei, Yong-Li; Li, Xiao-Yuan; Kang, Ting-Ting; Wang, Su-Na; Zang, Shuang-Quan","A series of Ag(i)‒Cd(ii) hetero- and Ag(i) homo-nuclear coordination polymers based on 5-iodo-isophthalic acid and N-donor ancillary ligands","CrystEngComm","2014","16","2","223","","10.1039/c3ce41714j","","","0.71073","MoKα","","0.0629","0.0453","","","0.1092","0.1176","","","","","","1.004","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213599","24.461","0.006","12.134","0.003","14.921","0.004","90","","114.525","0.004","90","","4029.1","1.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H48 Dy N19 O17 -","- C24 H48 Dy N19 O17 -","- C96 H192 Dy4 N76 O68 -","4","0.5","","Liu, Qing-Yan; Li, Yi-Lei; Xiong, Wei-Lu; Wang, Yu-Ling; Luo, Feng; Liu, Cai-Ming; Chen, Li-Li","Urothermal synthesis of mononuclear lanthanide compounds: slow magnetization relaxation observed in Dy analogue","CrystEngComm","2014","16","4","585","","10.1039/c3ce41762j","","","0.71073","MoKα","","0.0333","0.0312","","","0.0832","0.0864","","","","","","1.003","","","","has coordinates","180466","2020-10-21","18:00:00",""
"7213600","24.3791","0.0012","12.1598","0.0006","14.82","0.0007","90","","114.394","0.001","90","","4001.1","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H48 N19 O17 Tb -","- C24 H48 N19 O17 Tb -","- C96 H192 N76 O68 Tb4 -","4","0.5","","Liu, Qing-Yan; Li, Yi-Lei; Xiong, Wei-Lu; Wang, Yu-Ling; Luo, Feng; Liu, Cai-Ming; Chen, Li-Li","Urothermal synthesis of mononuclear lanthanide compounds: slow magnetization relaxation observed in Dy analogue","CrystEngComm","2014","16","4","585","","10.1039/c3ce41762j","","","0.71073","MoKα","","0.0381","0.034","","","0.0908","0.0965","","","","","","1","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213601","7.392","0.0002","10.792","0.0003","11.641","0.0004","80.286","0.001","88.272","0.001","77.08","0.001","892.14","0.05","113","2","113","2","","","","","","","","6","P -1","-P 1","2","1","","","- C10 H14 Ag2 Cl2 N2 O12 -","- C10 H14 Ag2 Cl2 N2 O12 -","- C20 H28 Ag4 Cl4 N4 O24 -","2","1","","Puttreddy, Rakesh; Steel, Peter J.","Pyridine N-oxide: a hyperdentate argentophile","CrystEngComm","2014","16","4","556","","10.1039/c3ce42030b","","","0.71073","MoKα","","0.022","0.0211","","","0.0547","0.0553","","","","","","1.023","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213602","21.9957","0.0002","21.9957","0.0002","14.0739","0.0001","90","","90","","120","","5896.86","0.09","120","2","120","2","","","","","","","","6","R 3 :H","R 3","146","2","","","- C20 H20 Ag2 Cl2 N4 O12 -","- C20 H20 Ag2 Cl2 N4 O12 -","- C180 H180 Ag18 Cl18 N36 O108 -","9","1","","Puttreddy, Rakesh; Steel, Peter J.","Pyridine N-oxide: a hyperdentate argentophile","CrystEngComm","2014","16","4","556","","10.1039/c3ce42030b","","","0.71073","MoKα","","0.0215","0.0203","","","0.0504","0.0512","","","","","","1.158","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213603","13.3014","0.0003","13.3014","0.0003","5.9918","0.0002","90","","90","","120","","918.08","0.04","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","3","","","- C15 H15 Ag Cl N3 O8 -","- C15 H15 Ag Cl N3 O8 -","- C30 H30 Ag2 Cl2 N6 O16 -","2","0.166667","","Puttreddy, Rakesh; Steel, Peter J.","Pyridine N-oxide: a hyperdentate argentophile","CrystEngComm","2014","16","4","556","","10.1039/c3ce42030b","","","0.71073","MoKα","","0.0454","0.0412","","","0.1019","0.1051","","","","","","1.169","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213604","8.26718","0.00008","10.26639","0.00013","11.74637","0.00013","86.5046","0.001","81.1991","0.0009","88.269","0.0009","983.171","0.019","120","2","120","2","","","","","","","","7","P -1","-P 1","2","4","","","- C12 H10 Ag2 F6 N2 O8 S2 -","- C12 H10 Ag2 F6 N2 O8 S2 -","- C24 H20 Ag4 F12 N4 O16 S4 -","2","1","","Puttreddy, Rakesh; Steel, Peter J.","Pyridine N-oxide: a hyperdentate argentophile","CrystEngComm","2014","16","4","556","","10.1039/c3ce42030b","","","0.71073","MoKα","","0.0239","0.0206","","","0.0476","0.05","","","","","","1.095","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213605","7.5719","0.0004","7.8718","0.0004","9.8803","0.0006","104.448","0.005","108.242","0.005","96.225","0.004","530.37","0.06","100.01","0.1","100.01","0.1","","","","","","","","5","P 1","P 1","1","","","","- C20 H23 N3 O6 S2 -","- C20 H23 N3 O6 S2 -","- C20 H23 N3 O6 S2 -","1","1","","Dai, Yiqiang; Tan, Jifeng; Ye, Ning; Yang, Zhou","Synthesis and crystal growth of thienyl-substituted pyridinium derivatives for second-order nonlinear optics","CrystEngComm","2014","16","4","636","","10.1039/c3ce41938j","","","0.7107","MoKα","","0.0285","0.0274","","","0.0678","0.0687","","","","","","1.032","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213606","8.765","0.003","10.24","0.004","12.354","0.005","103.59","0.005","104.227","0.006","91.636","0.004","1040.3","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H26 N2 O3 S2 -","- C22 H26 N2 O3 S2 -","- C44 H52 N4 O6 S4 -","2","1","","Dai, Yiqiang; Tan, Jifeng; Ye, Ning; Yang, Zhou","Synthesis and crystal growth of thienyl-substituted pyridinium derivatives for second-order nonlinear optics","CrystEngComm","2014","16","4","636","","10.1039/c3ce41938j","","","0.71073","MoKα","","0.0606","0.0558","","","0.135","0.1383","","","","","","1.152","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213607","12.0822","0.0008","23.676","0.0016","29.4806","0.0019","90","","90","","90","","8433.2","1","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H28 N4 O4 Zn -","- C37 H28 N4 O4 Zn -","- C296 H224 N32 O32 Zn8 -","8","1","","Meng, Fandian; Qin, Ling; Zhang, Mingdao; Zheng, Hegen","Two pairs of isomorphism and two 3D metal‒organic frameworks based on a star-like ligand tri(4-pyridylphenyl)amine","CrystEngComm","2014","16","4","698","","10.1039/c3ce41694a","","","0.71073","MoKα","","0.0961","0.0707","","","0.1843","0.1966","","","","","","1.152","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213608","13.749","0.0012","17.0006","0.0015","13.165","0.0011","90","","93.109","0.001","90","","3072.7","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H26 Cd N4 O4 -","- C37 H26 Cd N4 O4 -","- C148 H104 Cd4 N16 O16 -","4","0.5","","Meng, Fandian; Qin, Ling; Zhang, Mingdao; Zheng, Hegen","Two pairs of isomorphism and two 3D metal‒organic frameworks based on a star-like ligand tri(4-pyridylphenyl)amine","CrystEngComm","2014","16","4","698","","10.1039/c3ce41694a","","","0.71073","MoKα","","0.0539","0.0446","","","0.1","0.1034","","","","","","0.954","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213609","11.9824","0.0013","32.547","0.004","10.7535","0.0012","90","","98.598","0.002","90","","4146.6","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C47 H32 Cd N4 O5 -","- C47 H32 Cd N4 O5 -","- C188 H128 Cd4 N16 O20 -","4","1","","Meng, Fandian; Qin, Ling; Zhang, Mingdao; Zheng, Hegen","Two pairs of isomorphism and two 3D metal‒organic frameworks based on a star-like ligand tri(4-pyridylphenyl)amine","CrystEngComm","2014","16","4","698","","10.1039/c3ce41694a","","","0.71073","MoKα","","0.0736","0.0653","","","0.1736","0.1797","","","","","","1.074","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213610","11.6417","0.0011","32.11","0.003","10.837","0.0011","90","","98.525","0.002","90","","4006.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C47 H32 Co N4 O5 -","- C47 H32 Co N4 O5 -","- C188 H128 Co4 N16 O20 -","4","1","","Meng, Fandian; Qin, Ling; Zhang, Mingdao; Zheng, Hegen","Two pairs of isomorphism and two 3D metal‒organic frameworks based on a star-like ligand tri(4-pyridylphenyl)amine","CrystEngComm","2014","16","4","698","","10.1039/c3ce41694a","","","0.71073","MoKα","","0.0655","0.0523","","","0.1324","0.1401","","","","","","0.953","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213611","19.407","0.007","13.628","0.005","16.307","0.006","90","","90","","90","","4313","3","293","2","293","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C50 H32 F6 N4 O4 Zn -","- C50 H32 F6 N4 O4 Zn -","- C200 H128 F24 N16 O16 Zn4 -","4","0.5","","Meng, Fandian; Qin, Ling; Zhang, Mingdao; Zheng, Hegen","Two pairs of isomorphism and two 3D metal‒organic frameworks based on a star-like ligand tri(4-pyridylphenyl)amine","CrystEngComm","2014","16","4","698","","10.1039/c3ce41694a","","","0.71073","MoKα","","0.0825","0.0637","","","0.1809","0.2015","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213612","19.414","0.004","13.605","0.002","16.216","0.003","90","","90","","90","","4283.1","1.3","296","2","296","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C50 H32 Co F6 N4 O4 -","- C50 H32 Co F6 N4 O4 -","- C200 H128 Co4 F24 N16 O16 -","4","0.5","","Meng, Fandian; Qin, Ling; Zhang, Mingdao; Zheng, Hegen","Two pairs of isomorphism and two 3D metal‒organic frameworks based on a star-like ligand tri(4-pyridylphenyl)amine","CrystEngComm","2014","16","4","698","","10.1039/c3ce41694a","","","0.71073","MoKα","","0.079","0.0454","","","0.1107","0.1246","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213613","17.6223","0.0008","6.783","0.0005","11.4011","0.0005","90","","90","","90","","1362.8","0.13","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C10 H15 N O8 S -","- C10 H15 N O8 S -","- C40 H60 N4 O32 S4 -","4","0.5","","Nowak, Anna M.; Kurc, Teresa; Janczak, Jan; Videnova-Adrabinska, Veneta","Synthesis and structural analysis of alkylammonium sulfoisophthalates: cation size and geometry effects on the hydrogen bonded network","CrystEngComm","2014","16","4","591","","10.1039/c3ce41526k","","","0.71073","MoKα","","0.1686","0.0621","","","0.0933","0.1153","","","","","","1.006","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213614","12.235","0.002","8.073","0.001","15.736","0.003","90","","105.62","0.01","90","","1496.9","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 N O7 S -","- C12 H17 N O7 S -","- C48 H68 N4 O28 S4 -","4","1","","Nowak, Anna M.; Kurc, Teresa; Janczak, Jan; Videnova-Adrabinska, Veneta","Synthesis and structural analysis of alkylammonium sulfoisophthalates: cation size and geometry effects on the hydrogen bonded network","CrystEngComm","2014","16","4","591","","10.1039/c3ce41526k","","","0.71073","MoKα","","0.0521","0.0347","","","0.0968","0.1202","","","","","","1.013","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213615","13.1122","0.0003","9.5655","0.0002","14.8057","0.0005","90","","105.892","0.003","90","","1786.03","0.09","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H23 N O8 S -","- C14 H23 N O8 S -","- C56 H92 N4 O32 S4 -","4","1","","Nowak, Anna M.; Kurc, Teresa; Janczak, Jan; Videnova-Adrabinska, Veneta","Synthesis and structural analysis of alkylammonium sulfoisophthalates: cation size and geometry effects on the hydrogen bonded network","CrystEngComm","2014","16","4","591","","10.1039/c3ce41526k","","","0.71073","MoKα","","0.0825","0.0377","","","0.0722","0.098","","","","","","1.001","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213616","11.9085","0.0014","17.017","0.002","17.936","0.002","74.992","0.002","90.255","0.002","88.732","0.002","3509.6","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H42 Cu7 N14 Nd3 O22 -","- C58 H42 Cu7 N14 Nd3 O22 -","- C116 H84 Cu14 N28 Nd6 O44 -","2","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.071","0.0454","","","0.0783","0.0867","","","","","","1.082","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213617","11.8797","0.0008","17.3366","0.0012","17.9107","0.0013","74.332","0.001","88.418","0.001","86.236","0.001","3543.9","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H44 Cu7 Eu3 N14 O23 -","- C58 H44 Cu7 Eu3 N14 O23 -","- C116 H88 Cu14 Eu6 N28 O46 -","2","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0433","0.0343","","","0.0792","0.084","","","","","","1.019","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213618","11.8653","0.0011","17.36","0.0016","17.9132","0.0016","74.368","0.001","88.417","0.001","86.158","0.001","3545.2","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H44 Cu7 Gd3 N14 O23 -","- C58 H44 Cu7 Gd3 N14 O23 -","- C116 H88 Cu14 Gd6 N28 O46 -","2","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0457","0.036","","","0.0843","0.0896","","","","","","1.05","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213619","11.8612","0.0004","17.3255","0.0005","17.9096","0.0005","74.402","0.002","88.414","0.002","86.095","0.002","3536.5","0.19","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H44 Cu7 N14 O23 Tb3 -","- C58 H44 Cu7 N14 O23 Tb3 -","- C116 H88 Cu14 N28 O46 Tb6 -","2","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0377","0.0277","","","0.056","0.0601","","","","","","0.993","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213620","11.83","0.0008","17.3115","0.0011","17.8851","0.0012","74.425","0.001","88.424","0.001","86.063","0.001","3519.8","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H44 Cu7 Dy3 N14 O23 -","- C58 H44 Cu7 Dy3 N14 O23 -","- C116 H88 Cu14 Dy6 N28 O46 -","2","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0533","0.0389","","","0.0796","0.0867","","","","","","1.078","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213621","9.896","0.002","16.21","0.004","18.443","0.004","92.002","0.003","103.58","0.003","92.51","0.003","2869.9","1.1","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C89 H88 Cl6 Cu13 N19 O44 Tb4 -","- C89 H88 Cl6 Cu13.001 N19 O44 Tb4 -","- C89 H88 Cl6 Cu13.001 N19 O44 Tb4 -","1","0.5","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0647","0.0462","","","0.0844","0.0911","","","","","","1.09","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213622","9.914","0.002","16.143","0.003","18.407","0.004","92.009","0.002","103.583","0.002","91.941","0.002","2859","1","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C89 H88 Cl6 Cu13 Dy4 N19 O44 -","- C89 H88 Cl6 Cu13 Dy4 N19 O44 -","- C89 H88 Cl6 Cu13 Dy4 N19 O44 -","1","0.5","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0638","0.0463","","","0.1039","0.1133","","","","","","1.082","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213623","37.632","0.004","7.7785","0.0007","17.7721","0.0017","90","","97.212","0.001","90","","5161.1","0.9","296","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C40 H26 Cu5 F5 N10 O17 S Tb4 -","- C40 H26 Cu5 F5 N10 O17 S Tb4 -","- C160 H104 Cu20 F20 N40 O68 S4 Tb16 -","4","0.5","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0353","0.0293","","","0.0686","0.0718","","","","","","1.041","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213624","37.632","0.004","7.7785","0.0007","17.7721","0.0017","90","","97.212","0.001","90","","5161.1","0.9","296","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C40 H26 Cu5 Dy4 F5 N10 O17 S -","- C40 H26 Cu5 Dy4 F5 N10 O17 S -","- C160 H104 Cu20 Dy16 F20 N40 O68 S4 -","4","0.5","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0417","0.036","","","0.0901","0.0948","","","","","","1.033","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213625","11.7096","0.0009","12.7197","0.001","18.5102","0.0015","108.956","0.001","95.649","0.001","97.916","0.001","2552.3","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C87 H68 Cu9 N19 O38 Tb6 -","- C87 H68 Cu9 N19 O38 Tb6 -","- C87 H68 Cu9 N19 O38 Tb6 -","1","0.5","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0414","0.032","","","0.072","0.0767","","","","","","1.05","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213626","11.7096","0.0009","12.7197","0.001","18.5102","0.0015","108.956","0.001","95.649","0.001","97.916","0.001","2552.3","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C87 H68 Cu9 Dy6 N19 O38 -","- C87 H68 Cu9 Dy6 N19 O38 -","- C87 H68 Cu9 Dy6 N19 O38 -","1","0.5","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0469","0.0354","","","0.0786","0.0848","","","","","","1.03","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213627","17.8782","0.001","30.743","0.0018","9.0004","0.0005","90","","104.069","0.001","90","","4798.5","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H31 Cu5 N10 O16 Tb2 -","- C42 H31 Cu5 N10 O16 Tb2 -","- C168 H124 Cu20 N40 O64 Tb8 -","4","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0385","0.0274","","","0.0539","0.0579","","","","","","1.034","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213628","17.857","0.004","30.693","0.007","8.995","0.002","90","","104.064","0.003","90","","4782.2","1.9","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H31 Cu5 Dy2 N10 O16 -","- C42 H31 Cu5 Dy2 N10 O16 -","- C168 H124 Cu20 Dy8 N40 O64 -","4","1","","Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong","A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties","CrystEngComm","2014","16","4","667","","10.1039/c3ce42025f","","","0.71073","MoKα","","0.0551","0.0413","","","0.0819","0.0873","","","","","","1.077","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213629","10.5187","0.0003","9.635","0.0003","15.331","0.0004","90","","102.261","0.002","90","","1518.32","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 N14 Ni O4 S2 -","- C28 H20 N14 Ni O4 S2 -","- C56 H40 N28 Ni2 O8 S4 -","2","0.5","","Saha, Sandeepta; Sasmal, Ashok; Pilet, Guillaume; Bauzá, Antonio; Frontera, Antonio; Mitra, Samiran","An unusual nitroso⋯nitroso interaction in the coordination polymer structures of Ni(ii) and Co(ii) complexes with the α,ω-bis(benzotriazoloxy)alkane system","CrystEngComm","2014","16","4","654","","10.1039/c3ce41765d","","","0.71073","MoKα","","0.063","0.0393","","","0.0797","0.0861","","","","","","1.062","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213630","9.6417","0.0006","10.264","0.0006","11.8286","0.0006","66.695","0.006","67.466","0.005","64.424","0.006","937.31","0.11","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 N14 Ni O4 S2 -","- C32 H28 N14 Ni O4 S2 -","- C32 H28 N14 Ni O4 S2 -","1","0.5","","Saha, Sandeepta; Sasmal, Ashok; Pilet, Guillaume; Bauzá, Antonio; Frontera, Antonio; Mitra, Samiran","An unusual nitroso⋯nitroso interaction in the coordination polymer structures of Ni(ii) and Co(ii) complexes with the α,ω-bis(benzotriazoloxy)alkane system","CrystEngComm","2014","16","4","654","","10.1039/c3ce41765d","","","0.71073","MoKα","","0.0542","0.0398","","0.0619","0.0486","0.046","","","","","","1.0813","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213631","10.9405","0.0003","25.4462","0.0006","13.6306","0.0004","90","","95.718","0.002","90","","3775.8","0.18","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H32 Co N14 O4 S2 -","- C34 H32 Co N14 O4 S2 -","- C136 H128 Co4 N56 O16 S8 -","4","0.5","","Saha, Sandeepta; Sasmal, Ashok; Pilet, Guillaume; Bauzá, Antonio; Frontera, Antonio; Mitra, Samiran","An unusual nitroso⋯nitroso interaction in the coordination polymer structures of Ni(ii) and Co(ii) complexes with the α,ω-bis(benzotriazoloxy)alkane system","CrystEngComm","2014","16","4","654","","10.1039/c3ce41765d","","","0.71073","MoKα","","0.061","0.0485","","0.0526","0.0505","0.0503","","","","","","1.0977","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213632","8.9041","0.0008","11.5928","0.0007","14.2517","0.001","71.388","0.006","81.39","0.007","88.826","0.006","1377.88","0.19","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H6 Ag5 F12 N3 O9 -","- C17 H6 Ag5 F12 N3 O9 -","- C34 H12 Ag10 F24 N6 O18 -","2","1","","Li, Bo; Huang, Ren-Wu; Yao, Hong-Chang; Zang, Shuang-Quan; Mak, Thomas C. W.","Silver(i)‒organic frameworks assembled with flexible supramolecular synthons with a pendant ethynide arm attached to the heteroaryl skeleton","CrystEngComm","2014","16","4","723","","10.1039/c3ce41752b","","","0.71073","MoKα","","0.062","0.0511","","","0.1309","0.138","","","","","","1.065","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213633","16.0991","0.0016","8.8039","0.001","23.399","0.003","90","","120.917","0.007","90","","2845.2","0.6","296","","296","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H8 Ag5 F12 N3 O10 -","- C17 H8 Ag5 F12 N3 O10 -","- C68 H32 Ag20 F48 N12 O40 -","4","1","","Li, Bo; Huang, Ren-Wu; Yao, Hong-Chang; Zang, Shuang-Quan; Mak, Thomas C. W.","Silver(i)‒organic frameworks assembled with flexible supramolecular synthons with a pendant ethynide arm attached to the heteroaryl skeleton","CrystEngComm","2014","16","4","723","","10.1039/c3ce41752b","","","0.71073","MoKα","","0.151","0.0884","","","0.1675","0.1955","","","","","","1.006","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213634","8.0193","0.0016","24.904","0.005","26.491","0.005","90","","93.01","0.03","90","","5283.3","1.8","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C83 H46 Ag14 F30 N4 O27 S4 -","- C83 H46 Ag14 F30 N4 O27 S4 -","- C166 H92 Ag28 F60 N8 O54 S8 -","2","0.5","","Li, Bo; Huang, Ren-Wu; Yao, Hong-Chang; Zang, Shuang-Quan; Mak, Thomas C. W.","Silver(i)‒organic frameworks assembled with flexible supramolecular synthons with a pendant ethynide arm attached to the heteroaryl skeleton","CrystEngComm","2014","16","4","723","","10.1039/c3ce41752b","","","0.71073","MoKα","","0.117","0.0988","","","0.2915","0.3087","","","","","","1.116","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213635","15.346","0.003","24.558","0.005","22.739","0.005","90","","109.46","0.03","90","","8080","3","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C70 H58 Ag9 N9 O22 S7 -","- C70 H58 Ag9 N9 O22 S7 -","- C280 H232 Ag36 N36 O88 S28 -","4","1","","Li, Bo; Huang, Ren-Wu; Yao, Hong-Chang; Zang, Shuang-Quan; Mak, Thomas C. W.","Silver(i)‒organic frameworks assembled with flexible supramolecular synthons with a pendant ethynide arm attached to the heteroaryl skeleton","CrystEngComm","2014","16","4","723","","10.1039/c3ce41752b","","","0.71073","MoKα","","0.0827","0.0763","","","0.2095","0.2161","","","","","","1.081","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213636","7.5491","0.0005","8.7078","0.0005","10.824","0.0007","106.654","0.001","102.66","0.001","94.38","0.001","657.69","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H12 Eu N O10 -","- C9 H12 Eu N O10 -","- C18 H24 Eu2 N2 O20 -","2","1","","Feng, Xun; Chen, Jun-Ling; Wang, Li-Ya; Xie, Shi-Yu; Yang, Song; Huo, Su-Zhen; Ng, Seik-Weng","A series of homonuclear lanthanide complexes incorporating isonicotinic based carboxylate tectonic and oxalate coligand: structures, luminescent and magnetic properties","CrystEngComm","2014","16","7","1334","","10.1039/c3ce41674g","","","0.71073","MoKα","","0.015","0.0143","","","0.0361","0.0365","","","","","","1.046","","","","has coordinates,has disorder","194002","2020-10-21","18:00:00",""
"7213637","7.569","","8.766","","10.893","","106.6","","102.73","","94.14","","668.503","","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H12 Gd N O10 -","- C9 H10 Gd N O10 -","- C18 H20 Gd2 N2 O20 -","2","1","","Feng, Xun; Chen, Jun-Ling; Wang, Li-Ya; Xie, Shi-Yu; Yang, Song; Huo, Su-Zhen; Ng, Seik-Weng","A series of homonuclear lanthanide complexes incorporating isonicotinic based carboxylate tectonic and oxalate coligand: structures, luminescent and magnetic properties","CrystEngComm","2014","16","7","1334","","10.1039/c3ce41674g","","","0.71073","MoKα","","0.032","0.0316","","","0.09","0.0903","","","","","","1.106","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213638","7.481","0.003","8.648","0.004","10.771","0.004","106.586","0.004","102.53","0.004","94.388","0.004","644.8","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H10 N O9 Tb -","- C9 H10 N O9 Tb -","- C18 H20 N2 O18 Tb2 -","2","1","","Feng, Xun; Chen, Jun-Ling; Wang, Li-Ya; Xie, Shi-Yu; Yang, Song; Huo, Su-Zhen; Ng, Seik-Weng","A series of homonuclear lanthanide complexes incorporating isonicotinic based carboxylate tectonic and oxalate coligand: structures, luminescent and magnetic properties","CrystEngComm","2014","16","7","1334","","10.1039/c3ce41674g","","","0.71073","MoKα","","0.0398","0.0383","","","0.1014","0.1027","","","","","","1.041","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213639","7.4292","0.0009","8.6094","0.0011","10.7126","0.0013","106.552","0.001","102.334","0.001","94.421","0.001","634.64","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 Ho2 N2 O18 -","- C18 H20 Ho2 N2 O18 -","- C18 H20 Ho2 N2 O18 -","1","0.5","","Feng, Xun; Chen, Jun-Ling; Wang, Li-Ya; Xie, Shi-Yu; Yang, Song; Huo, Su-Zhen; Ng, Seik-Weng","A series of homonuclear lanthanide complexes incorporating isonicotinic based carboxylate tectonic and oxalate coligand: structures, luminescent and magnetic properties","CrystEngComm","2014","16","7","1334","","10.1039/c3ce41674g","","","0.71073","MoKα","","0.0685","0.0602","","","0.1573","0.1652","","","","","","1.055","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213640","7.5714","0.001","8.7324","0.0012","10.8446","0.0015","106.671","0.001","102.674","0.001","94.37","0.001","662.67","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H10 N O9 Sm -","- C9 H10 N O9 Sm -","- C18 H20 N2 O18 Sm2 -","2","1","","Feng, Xun; Chen, Jun-Ling; Wang, Li-Ya; Xie, Shi-Yu; Yang, Song; Huo, Su-Zhen; Ng, Seik-Weng","A series of homonuclear lanthanide complexes incorporating isonicotinic based carboxylate tectonic and oxalate coligand: structures, luminescent and magnetic properties","CrystEngComm","2014","16","7","1334","","10.1039/c3ce41674g","","","0.71073","MoKα","","0.0152","0.015","","","0.0388","0.0389","","","","","","1.071","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213641","7.2339","0.0004","22.332","0.0014","23.4396","0.0013","90","","90","","90","","3786.6","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 Ba Cd N O14 -","- C32 H30 Ba Cd N O14 -","- C128 H120 Ba4 Cd4 N4 O56 -","4","1","","Zhang, Huabin; Lin, Ping; Shan, Xiaochen; Han, Liwei; Du, Shaowu","Absolute helicity induction: chiral information transfer from metal centre to the framework","CrystEngComm","2014","16","7","1245","","10.1039/c3ce42157k","","","0.71073","MoKα","","0.0381","0.0367","","","0.112","0.1142","","","","","","1.108","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7213642","7.2243","0.0006","22.315","0.002","23.376","0.002","90","","90","","90","","3768.5","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 Ba Cd N O14 -","- C32 H30 Ba Cd N O14 -","- C128 H120 Ba4 Cd4 N4 O56 -","4","1","","Zhang, Huabin; Lin, Ping; Shan, Xiaochen; Han, Liwei; Du, Shaowu","Absolute helicity induction: chiral information transfer from metal centre to the framework","CrystEngComm","2014","16","7","1245","","10.1039/c3ce42157k","","","0.71073","MoKα","","0.0693","0.0585","","","0.1708","0.1822","","","","","","0.927","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213643","12.1624","0.0009","13.1051","0.0013","17.8595","0.0016","106.905","0.005","94.129","0.002","97.344","0.004","2683.3","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H52 Co2 N6 O15 S2 -","- C52 H52 Co2 N6 O15 S2 -","- C104 H104 Co4 N12 O30 S4 -","2","1","","Bu, Yang; Jiang, Feilong; Zhou, Kang; Gai, Yanli; Hong, Maochun","From 3D interpenetrated polythreading to 3D non-interpenetrated polythreading: SBU modulation in a dual-ligand system","CrystEngComm","2014","16","7","1249","","10.1039/c3ce42050g","","","0.71073","MoKα","","0.0635","0.0434","","","0.1164","0.1831","","","","","","1","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213644","11.6947","0.0002","12.879","0.0003","17.9851","0.0003","82.552","0.002","71.924","0.002","72.78","0.002","2457.59","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H46 Cd2 N6 O12 S2 -","- C52 H46 Cd2 N6 O12 S2 -","- C104 H92 Cd4 N12 O24 S4 -","2","1","","Bu, Yang; Jiang, Feilong; Zhou, Kang; Gai, Yanli; Hong, Maochun","From 3D interpenetrated polythreading to 3D non-interpenetrated polythreading: SBU modulation in a dual-ligand system","CrystEngComm","2014","16","7","1249","","10.1039/c3ce42050g","","","0.71073","MoKα","","0.0294","0.024","","","0.0543","0.058","","","","","","1","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213645","11.439","0.005","14.807","0.005","19.751","0.005","82.658","0.005","86.874","0.005","76.935","0.005","3231","2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H85 Dy Mn3 N6 Na O23 -","- C56 H85 Dy Mn3 N6 Na O23 -","- C112 H170 Dy2 Mn6 N12 Na2 O46 -","2","1","","Chandrasekhar, Vadapalli; Dey, Atanu; Das, Sourav; Kundu, Subrata","Syntheses and structures of a family of heterometallic pentanuclear [MnIII3LnNa] (Ln = Dy, Tb, Gd and Nd) complexes: H-bonding reduces the nuclearity from nine to five","CrystEngComm","2014","16","7","1304","","10.1039/c3ce41863d","","","0.71069","MoKα","","0.0926","0.0713","","","0.1915","0.2127","","","","","","1.052","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213646","11.455","0.005","14.841","0.005","19.776","0.005","82.715","0.005","87.032","0.005","76.958","0.005","3248","2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H85 Mn3 N6 Na O23 Tb -","- C56 H85 Mn3 N6 Na O23 Tb -","- C112 H170 Mn6 N12 Na2 O46 Tb2 -","2","1","","Chandrasekhar, Vadapalli; Dey, Atanu; Das, Sourav; Kundu, Subrata","Syntheses and structures of a family of heterometallic pentanuclear [MnIII3LnNa] (Ln = Dy, Tb, Gd and Nd) complexes: H-bonding reduces the nuclearity from nine to five","CrystEngComm","2014","16","7","1304","","10.1039/c3ce41863d","","","0.71069","MoKα","","0.0716","0.0587","","","0.1536","0.1676","","","","","","1.041","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213647","11.405","0.005","14.776","0.005","19.775","0.005","82.63","0.005","86.886","0.005","76.901","0.005","3218","2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H85 Gd Mn3 N6 Na O23 -","- C56 H85 Gd Mn3 N6 Na O23 -","- C112 H170 Gd2 Mn6 N12 Na2 O46 -","2","1","","Chandrasekhar, Vadapalli; Dey, Atanu; Das, Sourav; Kundu, Subrata","Syntheses and structures of a family of heterometallic pentanuclear [MnIII3LnNa] (Ln = Dy, Tb, Gd and Nd) complexes: H-bonding reduces the nuclearity from nine to five","CrystEngComm","2014","16","7","1304","","10.1039/c3ce41863d","","","0.71069","MoKα","","0.1473","0.0966","","","0.242","0.2829","","","","","","1.039","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213648","11.45","0.005","14.85","0.005","19.884","0.005","82.488","0.005","86.821","0.005","76.78","0.005","3262","2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H85 Mn3 N6 Na Nd O23 -","- C56 H85 Mn3 N6 Na Nd O23 -","- C112 H170 Mn6 N12 Na2 Nd2 O46 -","2","1","","Chandrasekhar, Vadapalli; Dey, Atanu; Das, Sourav; Kundu, Subrata","Syntheses and structures of a family of heterometallic pentanuclear [MnIII3LnNa] (Ln = Dy, Tb, Gd and Nd) complexes: H-bonding reduces the nuclearity from nine to five","CrystEngComm","2014","16","7","1304","","10.1039/c3ce41863d","","","0.71069","MoKα","","0.1275","0.0818","","","0.2346","0.2757","","","","","","1.102","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213649","36.831","0.003","6.1181","0.0004","12.2456","0.0012","90","","99.224","0.007","90","","2723.7","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C34 H32 N2 -","- C34 H32 N2 -","- C136 H128 N8 -","4","0.5","","Bastien, Guillaume; Lemouchi, Cyprien; Allain, Magali; Wzietek, Pawel; Rodríguez-Fortea, Antonio; Canadell, Enric; Iliopoulos, Konstantinos; Gindre, Denis; Chrysos, Michael; Batail, Patrick","Changing gears to neutral in a polymorph of one-dimensional arrays of cogwheel-like pairs of molecular rotors","CrystEngComm","2014","16","7","1241","","10.1039/c3ce42054j","","x-ray","0.71073","MoKα","","0.1565","0.059","","","0.1181","0.1512","","","","","","1.029","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213650","11.8637","0.0016","13.8353","0.0018","14.0619","0.0018","111.781","0.001","113.229","0.001","92.745","0.002","1917.9","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H36 N6 Ni O14 -","- C40 H36 N6 Ni O14 -","- C80 H72 N12 Ni2 O28 -","2","1","","Eshtiagh-Hosseini, Hossein; Mirzaei, Masoud; Zarghami, Sara; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T.; Habibi, Morteza; Shamsipur, Mojtaba","Crystal engineering with coordination compounds of 2,6-dicarboxy-4-hydroxypyridine and 9-aminoacridine fragments driven by different nature of the face-to-face π⋯π stacking","CrystEngComm","2014","16","7","1359","","10.1039/c3ce41730a","","","0.71073","MoKα","","0.0487","0.0416","","","0.104","0.1105","","","","","","1.031","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213651","10.574","0.003","23.672","0.006","14.903","0.004","90","","104.379","0.003","90","","3613.5","1.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H34 Co N6 O13 -","- C40 H34 Co N6 O13 -","- C160 H136 Co4 N24 O52 -","4","1","","Eshtiagh-Hosseini, Hossein; Mirzaei, Masoud; Zarghami, Sara; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T.; Habibi, Morteza; Shamsipur, Mojtaba","Crystal engineering with coordination compounds of 2,6-dicarboxy-4-hydroxypyridine and 9-aminoacridine fragments driven by different nature of the face-to-face π⋯π stacking","CrystEngComm","2014","16","7","1359","","10.1039/c3ce41730a","","","0.71073","MoKα","","0.0485","0.035","","","0.0838","0.0924","","","","","","1.023","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213652","7.8867","0.0012","11.0204","0.0017","16.859","0.003","84.453","0.002","89.358","0.002","75.087","0.002","1409.2","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H21 Cr N4 O14 -","- C27 H20.962 Cr N4 O14 -","- C54 H41.924 Cr2 N8 O28 -","2","1","","Eshtiagh-Hosseini, Hossein; Mirzaei, Masoud; Zarghami, Sara; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T.; Habibi, Morteza; Shamsipur, Mojtaba","Crystal engineering with coordination compounds of 2,6-dicarboxy-4-hydroxypyridine and 9-aminoacridine fragments driven by different nature of the face-to-face π⋯π stacking","CrystEngComm","2014","16","7","1359","","10.1039/c3ce41730a","","","0.71073","MoKα","","0.0666","0.0573","","","0.1532","0.163","","","","","","1.058","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213653","12.058","0.0012","13.9067","0.0014","14.0032","0.0015","111.967","0.001","115.126","0.001","94.003","0.002","1897.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H36 Cd N6 O14 -","- C40 H36 Cd N6 O14 -","- C80 H72 Cd2 N12 O28 -","2","1","","Eshtiagh-Hosseini, Hossein; Mirzaei, Masoud; Zarghami, Sara; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T.; Habibi, Morteza; Shamsipur, Mojtaba","Crystal engineering with coordination compounds of 2,6-dicarboxy-4-hydroxypyridine and 9-aminoacridine fragments driven by different nature of the face-to-face π⋯π stacking","CrystEngComm","2014","16","7","1359","","10.1039/c3ce41730a","","","0.71073","MoKα","","0.0337","0.0318","","","0.086","0.0874","","","","","","1.084","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213654","11.2796","0.0005","16.9872","0.0008","33.1264","0.0017","90","","92.11","0.004","90","","6343","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Co4(N3)4(PTA)3(4-CV)2]n.2nH2O","","","- C60 H44 Co4 N18 O14 -","- C60 H40 Co4 N18 O14 -","- C240 H160 Co16 N72 O56 -","4","0.5","","Wang, Shuai-Hua; Zheng, Fa-Kun; Wu, Mei-Feng; Liu, Zhi-Fa; Chen, Jun; Xiao, Yu; Li, Rong; Guo, Guo-Cong","Assembly of Co(ii)/Cu(ii)‒azido polynuclear polymers: structural diversity and magnetic behavior","CrystEngComm","2014","16","10","2009","","10.1039/c3ce42130a","","","0.71073","MoKα","","0.0566","0.0494","","","0.1519","0.1584","","","","","","1.063","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213655","11.2319","0.0009","17.004","0.0013","33.097","0.003","90","","95.524","0.006","90","","6291.7","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Co4(N3)4(PTA)3(3-CV)2]n.nH2O","","","- C60 H42 Co4 N18 O13 -","- C60 H40 Co4 N18 O13 -","- C240 H160 Co16 N72 O52 -","4","0.5","","Wang, Shuai-Hua; Zheng, Fa-Kun; Wu, Mei-Feng; Liu, Zhi-Fa; Chen, Jun; Xiao, Yu; Li, Rong; Guo, Guo-Cong","Assembly of Co(ii)/Cu(ii)‒azido polynuclear polymers: structural diversity and magnetic behavior","CrystEngComm","2014","16","10","2009","","10.1039/c3ce42130a","","","0.71073","MoKα","","0.0706","0.0566","","","0.1163","0.1234","","","","","","1.1","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213656","8.6131","0.0009","13.4894","0.0013","22.967","0.003","90","","97.547","0.007","90","","2645.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Cu6(N3)14(4-CV)2]n","","","- C36 H28 Cu6 N48 -","- C36 H28 Cu6 N48 -","- C72 H56 Cu12 N96 -","2","0.5","","Wang, Shuai-Hua; Zheng, Fa-Kun; Wu, Mei-Feng; Liu, Zhi-Fa; Chen, Jun; Xiao, Yu; Li, Rong; Guo, Guo-Cong","Assembly of Co(ii)/Cu(ii)‒azido polynuclear polymers: structural diversity and magnetic behavior","CrystEngComm","2014","16","10","2009","","10.1039/c3ce42130a","","","0.71073","MoKα","","0.0774","0.0637","","","0.1589","0.1685","","","","","","1.054","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213657","8.3731","0.0017","8.4927","0.0017","13.562","0.003","90.66","0.03","98.89","0.03","110.09","0.03","892.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 Mn2 N8 O7 -","- C13 H12 Mn2 N8 O7 -","- C26 H24 Mn4 N16 O14 -","2","1","","Wang, Lei; Zhao, Rui; Xu, Long-Yang; Liu, Ting; Zhao, Jiong-Peng; Wang, Shi-Ming; Liu, Fu-Chen","The synthesis, structure, and magnetic properties of two novel manganese(ii) azido/formate coordination polymers with isonicotinic acid N-oxide as a coligand","CrystEngComm","2014","16","10","2070","","10.1039/c3ce42158a","","","0.71073","MoKα","","0.0661","0.0525","","","0.1121","0.1179","","","","","","1.129","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213658","24.124","0.003","24.124","0.003","7.4767","0.0015","90","","90","","120","","3768.2","1","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C7 H5 Mn N O5 -","- C7 H5 Mn N O5 -","- C126 H90 Mn18 N18 O90 -","18","1","","Wang, Lei; Zhao, Rui; Xu, Long-Yang; Liu, Ting; Zhao, Jiong-Peng; Wang, Shi-Ming; Liu, Fu-Chen","The synthesis, structure, and magnetic properties of two novel manganese(ii) azido/formate coordination polymers with isonicotinic acid N-oxide as a coligand","CrystEngComm","2014","16","10","2070","","10.1039/c3ce42158a","","","0.71073","MoKα","","0.0629","0.0469","","","0.0779","0.0823","","","","","","1.155","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213659","8.0959","0.0004","18.776","0.001","7.9719","0.0004","90","","111.19","0.003","90","","1129.86","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 Li O6 -","- C12 H11 Li O6 -","- C48 H44 Li4 O24 -","4","1","","Raja, Duraisamy Senthil; Luo, Jheng-Hong; Yeh, Chun-Ting; Jiang, Yue-Chun; Hsu, Kuei-Fang; Lin, Chia-Her","Novel alkali and alkaline earth metal coordination polymers based on 1,4-naphthalenedicarboxylic acid: synthesis, structural characterization and properties","CrystEngComm","2014","16","10","1985","","10.1039/c3ce42208a","","","0.71073","MoKα","","0.0533","0.0418","","","0.1164","0.1267","","","","","","1.042","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213660","18.2186","0.0006","18.2186","0.0006","8.688","0.0003","90","","90","","120","","2497.36","0.14","295","2","295","2","","","","","","","","5","P 65","P 65","170","","","","- C15 H13 N Na2 O5 -","- C15 H13 N Na2 O5 -","- C90 H78 N6 Na12 O30 -","6","1","","Raja, Duraisamy Senthil; Luo, Jheng-Hong; Yeh, Chun-Ting; Jiang, Yue-Chun; Hsu, Kuei-Fang; Lin, Chia-Her","Novel alkali and alkaline earth metal coordination polymers based on 1,4-naphthalenedicarboxylic acid: synthesis, structural characterization and properties","CrystEngComm","2014","16","10","1985","","10.1039/c3ce42208a","","","0.71073","MoKα","","0.0788","0.0491","","","0.1173","0.132","","","","","","1.06","","","","has coordinates","287753","2023-11-23","09:34:45",""
"7213661","14.7579","0.0002","30.9679","0.0004","11.3786","0.0002","90","","90","","90","","5200.26","0.13","295","2","295","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C24 H17 Mg2 O11 -","- C24 H17 Mg2 O11 -","- C192 H136 Mg16 O88 -","8","1","","Raja, Duraisamy Senthil; Luo, Jheng-Hong; Yeh, Chun-Ting; Jiang, Yue-Chun; Hsu, Kuei-Fang; Lin, Chia-Her","Novel alkali and alkaline earth metal coordination polymers based on 1,4-naphthalenedicarboxylic acid: synthesis, structural characterization and properties","CrystEngComm","2014","16","10","1985","","10.1039/c3ce42208a","","","0.71073","MoKα","","0.0987","0.0647","","","0.1748","0.1906","","","","","","1.052","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213662","6.7017","0.0001","14.3958","0.0003","14.9405","0.0003","90","","90","","90","","1441.4","0.05","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 Ca N O5 -","- C15 H13 Ca N O5 -","- C60 H52 Ca4 N4 O20 -","4","1","","Raja, Duraisamy Senthil; Luo, Jheng-Hong; Yeh, Chun-Ting; Jiang, Yue-Chun; Hsu, Kuei-Fang; Lin, Chia-Her","Novel alkali and alkaline earth metal coordination polymers based on 1,4-naphthalenedicarboxylic acid: synthesis, structural characterization and properties","CrystEngComm","2014","16","10","1985","","10.1039/c3ce42208a","","","0.71073","MoKα","","0.0349","0.0302","","","0.0687","0.0714","","","","","","1.024","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213663","6.8883","0.0001","14.7074","0.0002","14.981","0.0002","90","","90","","90","","1517.71","0.04","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 N O5 Sr -","- C15 H13 N O5 Sr -","- C60 H52 N4 O20 Sr4 -","4","1","","Raja, Duraisamy Senthil; Luo, Jheng-Hong; Yeh, Chun-Ting; Jiang, Yue-Chun; Hsu, Kuei-Fang; Lin, Chia-Her","Novel alkali and alkaline earth metal coordination polymers based on 1,4-naphthalenedicarboxylic acid: synthesis, structural characterization and properties","CrystEngComm","2014","16","10","1985","","10.1039/c3ce42208a","","","0.71073","MoKα","","0.028","0.0257","","","0.0757","0.0772","","","","","","1.05","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213664","7.1269","0.0003","14.6724","0.0006","15.0027","0.0005","90","","90","","90","","1568.81","0.11","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 Ba N O5 -","- C15 H13 Ba N O5 -","- C60 H52 Ba4 N4 O20 -","4","1","","Raja, Duraisamy Senthil; Luo, Jheng-Hong; Yeh, Chun-Ting; Jiang, Yue-Chun; Hsu, Kuei-Fang; Lin, Chia-Her","Novel alkali and alkaline earth metal coordination polymers based on 1,4-naphthalenedicarboxylic acid: synthesis, structural characterization and properties","CrystEngComm","2014","16","10","1985","","10.1039/c3ce42208a","","","0.71073","MoKα","","0.0316","0.0273","","","0.0498","0.0512","","","","","","1.012","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213665","10.944","0.0003","65.6499","0.0013","11.2294","0.0003","90","","110.447","0.003","90","","7559.7","0.4","294","2","294","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C82 H50 Br6 N12 O14 -","- C82 H50 Br6 N12 O14 -","- C328 H200 Br24 N48 O56 -","4","1","","Mocilac, Pavle; Gallagher, John F.","Halogen bonding directed supramolecular assembly in bromo-substituted trezimides and tennimides","CrystEngComm","2014","16","10","1893","","10.1039/c3ce42168f","","","0.71073","MoKα","","0.1237","0.0747","","","0.1398","0.1587","","","","","","1.096","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213666","14.0441","0.0004","19.1432","0.0003","19.1482","0.0004","90","","90","","90","","5148","0.2","294","2","294","1","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C52.8 H28.8 Br4 Cl2.4 N8 O8 -","- C52.8 H28.8 Br4 Cl2.4 N8 O8 -","- C211.2 H115.2 Br16 Cl9.6 N32 O32 -","4","0.5","","Mocilac, Pavle; Gallagher, John F.","Halogen bonding directed supramolecular assembly in bromo-substituted trezimides and tennimides","CrystEngComm","2014","16","10","1893","","10.1039/c3ce42168f","","","1.54184","CuKα","","0.0516","0.044","","","0.1154","0.1224","","","","","","1.042","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213667","12.815","0.0006","13.6159","0.0005","25.7452","0.0011","84.442","0.003","87.666","0.004","80.07","0.004","4402.8","0.3","294","2","294","1","","","","","","","","6","P -1","-P 1","2","11-124_(26BrIO)3_2CHCl3","","","- C38 H20 Br3 Cl6 N9 O6 -","- C38 H20 Br3 Cl6 N9 O6 -","- C152 H80 Br12 Cl24 N36 O24 -","4","2","","Mocilac, Pavle; Gallagher, John F.","Halogen bonding directed supramolecular assembly in bromo-substituted trezimides and tennimides","CrystEngComm","2014","16","10","1893","","10.1039/c3ce42168f","","","0.71073","MoKα","","0.1883","0.0793","","","0.1463","0.1931","","","","","","1.012","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213668","12.239","0.0005","13.6149","0.0005","13.6447","0.0005","100.749","0.003","99.99","0.003","95.463","0.003","2180.69","0.15","294","2","294","1","","","","","","","","6","P -1","-P 1","2","(26BrIO)3_CH2Cl2_[11-125]","","","- C38 H22 Br3 Cl4 N9 O6 -","- C38 H22 Br3 Cl4 N9 O6 -","- C76 H44 Br6 Cl8 N18 O12 -","2","1","","Mocilac, Pavle; Gallagher, John F.","Halogen bonding directed supramolecular assembly in bromo-substituted trezimides and tennimides","CrystEngComm","2014","16","10","1893","","10.1039/c3ce42168f","","","0.71073","MoKα","","0.1119","0.0667","","","0.1607","0.1867","","","","","","1.013","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213669","10.5779","0.0003","13.2805","0.0003","40.7855","0.0013","90","","95.936","0.002","90","","5698.8","0.3","294","2","294","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C99.8 H53.8 Br8 Cl11.4 N24 O17 -","- C99.8 H53.8 Br8 Cl11.4 N24 O17 -","- C199.6 H107.6 Br16 Cl22.8 N48 O34 -","2","0.5","","Mocilac, Pavle; Gallagher, John F.","Halogen bonding directed supramolecular assembly in bromo-substituted trezimides and tennimides","CrystEngComm","2014","16","10","1893","","10.1039/c3ce42168f","","","0.71073","MoKα","","0.1177","0.0763","","","0.182","0.2053","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213670","15.3403","0.001","21.9052","0.001","16.9452","0.0014","90","","113.426","0.001","90","","5224.8","0.6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H26.5 Cl Co0.5 N4 O4.25 -","- C24 H24 Cl Co0.5 N4 O3.25 -","- C192 H192 Cl8 Co4 N32 O26 -","8","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.0785","0.0683","","","0.2349","0.2463","","","","","","1.119","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213671","18.563","0.0009","12.6014","0.0006","19.9775","0.001","90","","90","","90","","4673.1","0.4","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H22 Cl2 Cu N4 O2 -","- C24 H22 Cl2 Cu N4 O2 -","- C192 H176 Cl16 Cu8 N32 O16 -","8","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.044","0.0337","","","0.0828","0.0897","","","","","","1.049","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213672","10.3233","0.0006","10.9891","0.0006","13.3452","0.0008","79.573","0.001","85.122","0.001","75.565","0.001","1440.66","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H29 Cu N7 O9 -","- C27 H29 Cu N7 O9 -","- C54 H58 Cu2 N14 O18 -","2","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.0321","0.0286","","","0.0761","0.0782","","","","","","1.056","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213673","9.8299","0.0004","11.2063","0.0005","11.6827","0.0005","102.816","0.001","103.306","0.001","98.245","0.001","1195.26","0.09","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H22 Cu N4 O6 S -","- C24 H22 Cu N4 O6 S -","- C48 H44 Cu2 N8 O12 S2 -","2","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.0912","0.0853","","","0.2243","0.2304","","","","","","1.049","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213674","12.7947","0.0005","16.9353","0.0007","18.0105","0.0008","90","","104.74","0.001","90","","3774.1","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H40 Co N6 O8 -","- C38 H40 Co N6 O8 -","- C152 H160 Co4 N24 O32 -","4","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.0617","0.0456","","","0.1288","0.1424","","","","","","1.057","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213675","21.6962","0.0017","16.6659","0.0017","17.1799","0.0015","90","","102.019","0.002","90","","6075.8","0.9","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H33.5 Cu N4 O8.25 -","- C28.5 H30 Cu N4 O8.25 -","- C228 H240 Cu8 N32 O66 -","8","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.1108","0.0634","","","0.1724","0.2042","","","","","","1.054","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213676","9.7066","0.0005","10.7611","0.0005","13.1318","0.0006","112.448","0.001","96.662","0.001","103.768","0.001","1198.16","0.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H22 Cl2 Co N4 O2 -","- C24 H22 Cl2 Co N4 O2 -","- C48 H44 Cl4 Co2 N8 O4 -","2","1","","Liu, Qing-Xiang; Bi, Yue; Zhao, Xiao-Jun; Zhao, Zhi-Xiang; Wang, Jian-Hua; Wang, Xiu-Guang","Copper(ii) and cobalt(ii) complexes based on bis-benzimidazolyl ligand with 1,2-bis(2′-ethoxy)phenyl linker: synthesis, crystal structure and conformations","CrystEngComm","2014","16","10","1950","","10.1039/c3ce40957k","","","0.71073","MoKα","","0.032","0.0283","","","0.0725","0.0748","","","","","","1.047","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213677","12.191","0.005","13.18","0.005","13.506","0.005","92.714","0.005","109.859","0.005","110.756","0.005","1873.6","1.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H43 Cu2 N16 O50 P W12 -","- C30 H22 Cu2 N16 O50 P W12 -","- C30 H22 Cu2 N16 O50 P W12 -","1","0.5","","Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Zhuanfang; Yu, Yan; Liu, Heng; Yu, Tingting","Tuning the dimension of POM-based inorganic‒organic hybrids from 3D self-penetrating framework to 1D poly-pendant chain via changing POM clusters and introducing secondary spacers","CrystEngComm","2014","16","10","2045","","10.1039/c3ce42064g","","","0.71069","MoKα","","0.0987","0.0715","","","0.1865","0.2044","","","","","","1.081","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213678","11.0152","0.0005","11.7744","0.0005","12.4173","0.0006","70.921","0.001","86.69","0.001","89.694","0.001","1519.33","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H22 Cu5 Mo8 N36 O28 -","- C30 H18 Cu5 Mo8 N36 O28 -","- C30 H18 Cu5 Mo8 N36 O28 -","1","0.5","","Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Zhuanfang; Yu, Yan; Liu, Heng; Yu, Tingting","Tuning the dimension of POM-based inorganic‒organic hybrids from 3D self-penetrating framework to 1D poly-pendant chain via changing POM clusters and introducing secondary spacers","CrystEngComm","2014","16","10","2045","","10.1039/c3ce42064g","","","0.71073","MoKα","","0.0216","0.0198","","","0.0525","0.0538","","","","","","1.018","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213679","16.437","0.004","21.933","0.006","21.811","0.006","90","","100.372","0.003","90","","7735","4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H31 Cu5 N36 O47 P W12 -","- C30 H18 Cu5 N36 O47 P W12 -","- C120 H72 Cu20 N144 O188 P4 W48 -","4","0.5","","Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Zhuanfang; Yu, Yan; Liu, Heng; Yu, Tingting","Tuning the dimension of POM-based inorganic‒organic hybrids from 3D self-penetrating framework to 1D poly-pendant chain via changing POM clusters and introducing secondary spacers","CrystEngComm","2014","16","10","2045","","10.1039/c3ce42064g","","","0.71073","MoKα","","0.1326","0.0857","","","0.2171","0.2419","","","","","","1.087","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213680","10.7704","0.0005","11.2485","0.0005","12.3945","0.0005","63.892","0.005","66.121","0.004","73.689","0.007","1223.29","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H28 Cu4 Mo8 N14 O34 -","- C20 H14 Cu4 Mo8 N14 O34 -","- C20 H14 Cu4 Mo8 N14 O34 -","1","0.5","","Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Zhuanfang; Yu, Yan; Liu, Heng; Yu, Tingting","Tuning the dimension of POM-based inorganic‒organic hybrids from 3D self-penetrating framework to 1D poly-pendant chain via changing POM clusters and introducing secondary spacers","CrystEngComm","2014","16","10","2045","","10.1039/c3ce42064g","","","0.71073","MoKα","","0.0325","0.0268","","","0.0663","0.0692","","","","","","1.031","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213681","13.47","0.004","25.55","0.007","9.964","0.003","90","","91.569","0.004","90","","3427.9","1.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H50 Cl6 N6 O14 Pr2 -","- C72 H50 Cl6 N6 O14 Pr2 -","- C144 H100 Cl12 N12 O28 Pr4 -","2","0.5","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0576","0.0347","","","0.0682","0.0766","","","","","","0.984","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213682","9.8762","0.0014","13.3762","0.0019","13.76","0.002","85.263","0.002","85.703","0.002","71.627","0.002","1716.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H50 Cl6 N6 Nd2 O14 -","- C72 H46 Cl6 N6 Nd2 O14 -","- C72 H46 Cl6 N6 Nd2 O14 -","1","0.5","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0615","0.0434","","","0.0957","0.1048","","","","","","1.038","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213683","9.87","0.004","13.299","0.005","13.741","0.005","85.436","0.006","85.671","0.005","71.838","0.005","1705.9","1.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H50 Cl6 N6 O14 Sm2 -","- C72 H50 Cl6 N6 O14 Sm2 -","- C72 H50 Cl6 N6 O14 Sm2 -","1","0.5","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0801","0.056","","","0.1133","0.1245","","","","","","1.013","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213684","8.676","0.005","13.215","0.005","14.791","0.005","100.259","0.005","98.005","0.005","92.052","0.005","1649.3","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 N3 O7 Sm -","- C36 H25 Cl3 N3 O7 Sm -","- C72 H50 Cl6 N6 O14 Sm2 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0299","0.0255","","","0.0587","0.0601","","","","","","1.049","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213685","9.938","0.003","13.296","0.003","13.692","0.003","85.412","0.004","85.738","0.004","71.375","0.004","1706.7","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H50 Cl6 Eu2 N6 O14 -","- C72 H50 Cl6 Eu2 N6 O14 -","- C72 H50 Cl6 Eu2 N6 O14 -","1","0.5","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0578","0.0446","","","0.0917","0.0978","","","","","","1.023","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213686","8.694","0.003","13.21","0.004","14.787","0.005","100.236","0.006","97.994","0.006","92.172","0.006","1651.6","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 Eu N3 O7 -","- C36 H25 Cl3 Eu N3 O7 -","- C72 H50 Cl6 Eu2 N6 O14 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.082","0.0516","","","0.0907","0.1033","","","","","","0.974","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213687","8.6934","0.0009","13.1762","0.0013","14.7709","0.0015","100.235","0.001","97.94","0.001","92.176","0.001","1645.7","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 Gd N3 O7 -","- C36 H25 Cl3 Gd N3 O7 -","- C72 H50 Cl6 Gd2 N6 O14 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0556","0.0387","","","0.0751","0.0812","","","","","","1.02","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213688","8.684","0.005","13.13","0.005","14.77","0.005","100.221","0.005","97.912","0.005","92.257","0.005","1638.1","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 N3 O7 Tb -","- C36 H25 Cl3 N3 O7 Tb -","- C72 H50 Cl6 N6 O14 Tb2 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0493","0.0368","","","0.0784","0.0817","","","","","","1.078","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213689","8.689","0.005","13.109","0.005","14.771","0.005","100.206","0.005","97.819","0.005","92.396","0.005","1636.7","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 Dy N3 O7 -","- C36 H23 Cl3 Dy N3 O7 -","- C72 H46 Cl6 Dy2 N6 O14 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0635","0.046","","","0.0934","0.0993","","","","","","1.039","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213690","8.703","0.002","13.1","0.003","14.761","0.004","100.253","0.004","97.766","0.004","92.399","0.004","1637.1","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 Ho N3 O7 -","- C36 H25 Cl3 Ho N3 O7 -","- C72 H50 Cl6 Ho2 N6 O14 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0729","0.0468","","","0.0812","0.0907","","","","","","0.994","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213691","8.7004","0.0018","13.066","0.003","14.779","0.003","100.219","0.003","97.697","0.003","92.384","0.003","1634.8","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 Er N3 O7 -","- C36 H23 Cl3 Er N3 O7 -","- C72 H46 Cl6 Er2 N6 O14 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0785","0.0507","","","0.1049","0.118","","","","","","0.986","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213692","8.692","0.005","13.033","0.005","14.775","0.005","100.252","0.005","97.701","0.005","92.426","0.005","1628.4","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 N3 O7 Tm -","- C36 H25 Cl3 N3 O7 Tm -","- C72 H50 Cl6 N6 O14 Tm2 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0472","0.0359","","","0.0722","0.0754","","","","","","0.967","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213693","8.6999","0.0008","13.0183","0.0012","14.8094","0.0014","100.207","0.001","97.549","0.001","92.53","0.001","1632.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 N3 O7 Yb -","- C36 H25 Cl3 N3 O7 Yb -","- C72 H50 Cl6 N6 O14 Yb2 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0416","0.0323","","","0.0622","0.066","","","","","","1.001","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213694","8.701","0.0008","13.0007","0.0012","14.7847","0.0014","100.22","0.002","97.514","0.002","92.537","0.002","1627.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 Lu N3 O7 -","- C36 H23 Cl3 Lu N3 O7 -","- C72 H46 Cl6 Lu2 N6 O14 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.0648","0.0444","","","0.0797","0.0888","","","","","","0.997","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213695","8.706","0.003","13.108","0.005","14.788","0.005","100.278","0.006","97.723","0.006","92.392","0.006","1641.7","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Cl3 N3 O7 Y -","- C36 H25 Cl3 N3 O7 Y -","- C72 H50 Cl6 N6 O14 Y2 -","2","1","","Carter, Korey P.; Pope, Simon J. A.; Cahill, Christopher L.","A series of Ln-p-chlorobenzoic acid‒terpyridine complexes: lanthanide contraction effects, supramolecular interactions and luminescent behavior","CrystEngComm","2014","16","10","1873","","10.1039/c3ce42267d","","x-ray","0.71073","MoKα","","0.1085","0.0554","","","0.1031","0.1241","","","","","","0.977","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213696","21.065","0.005","12.657","0.003","11.992","0.003","90","","90","","90","","3197.3","1.3","100","3","100","3","","","","","","","","5","P m m a","-P 2a 2a","51","","","","- C16 H112 Br O38 P -","- C16 H102.5 Br O38 P -","- C32 H205 Br2 O76 P2 -","2","0.25","","Muromachi, Sanehiro; Takeya, Satoshi; Yamamoto, Yoshitaka; Ohmura, Ryo","Characterization of tetra-n-butylphosphonium bromide semiclathrate hydrate by crystal structure analysis","CrystEngComm","2014","16","10","2056","","10.1039/c3ce41942h","","","0.7107","MoKα","","0.0715","0.0646","","","0.1858","0.1899","","","","","","1.119","","","","has coordinates,has disorder","180467","2020-10-21","18:00:00",""
"7213697","10.4352","0.0016","9.1374","0.0013","42.862","0.007","90","","90.359","0.003","90","","4086.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 F5 N3 O3 -","- C21 H20 F5 N3 O3 -","- C168 H160 F40 N24 O24 -","8","2","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.1029","0.0638","","","0.1644","0.1862","","","","","","1.002","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213698","6.303","0.006","7.483","0.007","17.132","0.015","85.192","0.018","81.417","0.018","83.941","0.018","792.6","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H13 F5 N2 O2 -","- C17 H13 F5 N2 O2 -","- C34 H26 F10 N4 O4 -","2","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.0886","0.0565","","","0.1549","0.175","","","","","","1.009","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213699","6.214","0.006","7.246","0.007","15.518","0.014","93.009","0.012","96.517","0.012","95.237","0.013","689.9","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H9 F5 N2 O2 -","- C15 H9 F5 N2 O2 -","- C30 H18 F10 N4 O4 -","2","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.1059","0.089","","","0.2421","0.2584","","","","","","1.091","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7213700","18.85","0.003","9.519","0.0013","13.5917","0.0019","90","","100.231","0.002","90","","2400","0.6","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H28 F5 N3 O3 -","- C25 H28 F5 N3 O3 -","- C100 H112 F20 N12 O12 -","4","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.0922","0.0811","","","0.3056","0.3173","","","","","","1.233","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213701","8.796","0.0009","20.174","0.002","10.7947","0.0012","90","","105.704","0.003","90","","1844","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 F5 N2 O2 -","- C19 H17 F5 N2 O2 -","- C76 H68 F20 N8 O8 -","4","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.0858","0.0463","","","0.1133","0.1318","","","","","","1.013","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213702","6.235","0.004","7.257","0.005","32.88","0.02","87.826","0.013","89.408","0.012","84.552","0.013","1479.9","1.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H11 F5 N2 O2 -","- C16 H11 F5 N2 O2 -","- C64 H44 F20 N8 O8 -","4","2","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.0885","0.0749","","","0.222","0.2331","","","","","","1.082","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213703","5.352","0.006","7.971","0.008","12.471","0.013","73.23","0.02","79.202","0.019","89.85","0.02","499.6","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H11 N O -","- C13 H11 N O -","- C26 H22 N2 O2 -","2","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.084","0.0646","","","0.177","0.1886","","","","","","0.96","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213704","16.8272","0.0018","9.5857","0.001","13.9962","0.0014","90","","91.955","0.002","90","","2256.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 F5 N3 O3 -","- C23 H24 F5 N3 O3 -","- C92 H96 F20 N12 O12 -","4","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.0704","0.0442","","","0.1268","0.1439","","","","","","0.982","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213705","5.434","0.004","9.157","0.007","24.3","0.019","90","","90","","90","","1209.1","1.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H6 F5 N O -","- C13 H6 F5 N O -","- C52 H24 F20 N4 O4 -","4","1","","Wang, Ji-Liang; Xu, Jia-Su; Wang, Dong-Yun; Wang, Hui; Li, Zhan-Ting; Zhang, Dan-Wei","Anti-parallel sheet structures of side-chain-free γ-, δ-, and ε-dipeptides stabilized by benzene‒pentafluorobenzene stacking","CrystEngComm","2014","16","10","2078","","10.1039/c3ce42060d","","","0.71073","MoKα","","0.0454","0.0377","","","0.1027","0.1093","","","","","","1.026","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213706","24.102","0.002","11.0566","0.0009","21.667","0.002","90","","90.299","0.003","90","","5773.9","0.9","223","2","223","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C16 H48 Ag2 I9 La O8 Pb2 S8 -","- C16 H48 Ag2 I9 La O8 Pb2 S8 -","- C64 H192 Ag8 I36 La4 O32 Pb8 S32 -","4","0.5","","Tang, Chunying; Wang, Fang; Jia, Dingxian; Jiang, Wenqing; Zhang, Yong","Syntheses and characterizations of polymeric silver iodoplumbates, and iodoplumbates with lanthanide complexes","CrystEngComm","2014","16","10","2016","","10.1039/c3ce41759j","","","0.71073","MoKα","","0.0653","0.0573","","","0.1472","0.1529","","","","","","1.042","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213707","10.6777","0.001","24.857","0.002","22.051","0.002","90","","90","","90","","5852.7","0.9","223","2","223","2","","","","","","","","8","C c c m","-C 2 2c","66","","","","- C16 H48 Ag2 Gd I9 O8 Pb2 S8 -","- C16 Ag2 Gd I9 O8 Pb2 S8 -","- C64 Ag8 Gd4 I36 O32 Pb8 S32 -","4","0.25","","Tang, Chunying; Wang, Fang; Jia, Dingxian; Jiang, Wenqing; Zhang, Yong","Syntheses and characterizations of polymeric silver iodoplumbates, and iodoplumbates with lanthanide complexes","CrystEngComm","2014","16","10","2016","","10.1039/c3ce41759j","","","0.71073","MoKα","","0.077","0.0557","","","0.1573","0.1796","","","","","","1.047","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213708","10.717","0.002","24.883","0.005","21.972","0.004","90","","90","","90","","5859.3","1.9","293","2","293","2","","","","","","","","8","C c c m","-C 2 2c","66","","","","- C16 H48 Ag2 I9 O8 Pb2 S8 Tm -","- C16 Ag2 I9 O8 Pb2 S8 Tm -","- C64 Ag8 I36 O32 Pb8 S32 Tm4 -","4","0.25","","Tang, Chunying; Wang, Fang; Jia, Dingxian; Jiang, Wenqing; Zhang, Yong","Syntheses and characterizations of polymeric silver iodoplumbates, and iodoplumbates with lanthanide complexes","CrystEngComm","2014","16","10","2016","","10.1039/c3ce41759j","","","0.71073","MoKα","","0.0641","0.0561","","","0.1022","0.1048","","","","","","1.278","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213709","18.634","0.003","15.6835","0.0017","24.675","0.003","90","","107.995","0.003","90","","6858.4","1.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H54 I11 La O9 Pb4 S9 -","- C18 H30 I11 La O9 Pb4 S9 -","- C72 H120 I44 La4 O36 Pb16 S36 -","4","1","","Tang, Chunying; Wang, Fang; Jia, Dingxian; Jiang, Wenqing; Zhang, Yong","Syntheses and characterizations of polymeric silver iodoplumbates, and iodoplumbates with lanthanide complexes","CrystEngComm","2014","16","10","2016","","10.1039/c3ce41759j","","","0.71073","MoKα","","0.065","0.0428","","","0.0996","0.1205","","","","","","1.106","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213710","18.549","0.004","15.654","0.003","24.592","0.005","90","","107.85","0.03","90","","6797","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H54 I11 O9 Pb4 Pr S9 -","- C18 H24 I11 O9 Pb4 Pr S9 -","- C72 H96 I44 O36 Pb16 Pr4 S36 -","4","1","","Tang, Chunying; Wang, Fang; Jia, Dingxian; Jiang, Wenqing; Zhang, Yong","Syntheses and characterizations of polymeric silver iodoplumbates, and iodoplumbates with lanthanide complexes","CrystEngComm","2014","16","10","2016","","10.1039/c3ce41759j","","","0.71073","MoKα","","0.0683","0.0719","","","0.0938","0.1049","","","","","","1.11","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213711","18.6984","0.0019","15.5382","0.0012","24.498","0.003","90","","108.218","0.002","90","","6760.9","1.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H54 I11 Nd O9 Pb4 S9 -","- C18 H48 I11 Nd O9 Pb4 S9 -","- C72 H192 I44 Nd4 O36 Pb16 S36 -","4","1","","Tang, Chunying; Wang, Fang; Jia, Dingxian; Jiang, Wenqing; Zhang, Yong","Syntheses and characterizations of polymeric silver iodoplumbates, and iodoplumbates with lanthanide complexes","CrystEngComm","2014","16","10","2016","","10.1039/c3ce41759j","","","0.71073","MoKα","","0.0506","0.0328","","","0.0626","0.0909","","","","","","1.111","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213712","7.2256","0.0002","11.6583","0.0004","12.7817","0.0004","90","","90","","90","","1076.71","0.06","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- B5 Cs2 Li3 O10 -","- B5 Cs2 Li3 O10 -","- B20 Cs8 Li12 O40 -","4","0.5","","Yang, Yun; Su, Xin; Pan, Shilie; Zhang, Min; Wang, Ying; Han, Jian; Yang, Zhihua","Crystal growth and calculation of the electronic band structure and density of states of Li3Cs2B5O10","CrystEngComm","2014","16","10","1978","","10.1039/c3ce42084a","","","0.71073","MoKα","","0.0248","0.0246","","","0.0586","0.0587","","","","","","1.036","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213713","18.4648","0.001","18.9507","0.001","12.1406","0.0007","90","","114.522","0.001","90","","3865.1","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 Cu2 I2 N4 -","- C16 H20 Cu2 I2 N4 -","- C128 H160 Cu16 I16 N32 -","8","1","","Yuan, Shuai; Liu, Shan-Shan; Sun, Di","Two isomeric [Cu4I4] luminophores: solvothermal/mechanochemical syntheses, structures and thermochromic luminescence properties","CrystEngComm","2014","16","10","1927","","10.1039/c3ce42195c","","","0.71073","MoKα","","0.0608","0.0589","","","0.1832","0.1856","","","","","","1.089","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213714","18.4469","0.001","18.9875","0.0011","12.1745","0.0007","90","","114.546","0.001","90","","3878.9","0.4","160","2","160","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 Cu2 I2 N4 -","- C16 H20 Cu2 I2 N4 -","- C128 H160 Cu16 I16 N32 -","8","1","","Yuan, Shuai; Liu, Shan-Shan; Sun, Di","Two isomeric [Cu4I4] luminophores: solvothermal/mechanochemical syntheses, structures and thermochromic luminescence properties","CrystEngComm","2014","16","10","1927","","10.1039/c3ce42195c","","","0.71073","MoKα","","0.0582","0.0548","","","0.1711","0.1777","","","","","","1.069","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213715","18.4558","0.0011","19.0332","0.0011","12.2097","0.0008","90","","114.555","0.001","90","","3901.1","0.4","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 Cu2 I2 N4 -","- C16 H20 Cu2 I2 N4 -","- C128 H160 Cu16 I16 N32 -","8","1","","Yuan, Shuai; Liu, Shan-Shan; Sun, Di","Two isomeric [Cu4I4] luminophores: solvothermal/mechanochemical syntheses, structures and thermochromic luminescence properties","CrystEngComm","2014","16","10","1927","","10.1039/c3ce42195c","","","0.71073","MoKα","","0.0507","0.0475","","","0.1356","0.1383","","","","","","1.088","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213716","18.4183","0.0015","19.1626","0.0016","12.278","0.001","90","","114.633","0.001","90","","3939.1","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 Cu2 I2 N4 -","- C16 H20 Cu2 I2 N4 -","- C128 H160 Cu16 I16 N32 -","8","1","","Yuan, Shuai; Liu, Shan-Shan; Sun, Di","Two isomeric [Cu4I4] luminophores: solvothermal/mechanochemical syntheses, structures and thermochromic luminescence properties","CrystEngComm","2014","16","10","1927","","10.1039/c3ce42195c","","","0.71073","MoKα","","0.0339","0.0262","","","0.062","0.0654","","","","","","1.034","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213717","17.9843","0.0018","14.9569","0.0014","22.464","0.002","90","","111.631","0.002","90","","5617","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H30 Cu2 I2 N6 -","- C24 H30 Cu2 I2 N6 -","- C192 H240 Cu16 I16 N48 -","8","1","","Yuan, Shuai; Liu, Shan-Shan; Sun, Di","Two isomeric [Cu4I4] luminophores: solvothermal/mechanochemical syntheses, structures and thermochromic luminescence properties","CrystEngComm","2014","16","10","1927","","10.1039/c3ce42195c","","","0.71073","MoKα","","0.0818","0.0445","","","0.08","0.091","","","","","","0.856","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213718","8.156","0.0002","10.4612","0.0003","12.4373","0.0004","70.127","0.001","84.695","0.002","79.552","0.002","980.88","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 Cl4 Cu2 N8 O20 -","- C32 H28 Cl4 Cu2 N8 O20 -","- C32 H28 Cl4 Cu2 N8 O20 -","1","0.5","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.0449","0.0323","","","0.073","0.0781","","","","","","1.062","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213719","7.9852","0.0003","24.5926","0.0011","9.3471","0.0004","90","","100.87","0.003","90","","1802.62","0.13","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H13 Cl Cu N4 O6 -","- C18 H13 Cl Cu N4 O6 -","- C72 H52 Cl4 Cu4 N16 O24 -","4","1","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.0793","0.0579","","","0.1444","0.1582","","","","","","1.021","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7213720","13.4187","0.0006","12.5647","0.0006","21.7018","0.0005","90","","100.669","0.003","90","","3595.7","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H82 Cu4 N16 O25 -","- C64 H82 Cu4 N16 O25 -","- C128 H164 Cu8 N32 O50 -","2","0.5","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.106","0.0548","","","0.1105","0.1289","","","","","","1.046","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213721","8.7094","0.0003","9.5978","0.0003","10.6996","0.0003","96.294","0.002","102.423","0.002","95.889","0.002","860.82","0.05","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H17 Cl Cu N2 O8 S2 -","- C10 H17 Cl Cu N2 O8 S2 -","- C20 H34 Cl2 Cu2 N4 O16 S4 -","2","1","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.0511","0.0335","","","0.0778","0.0847","","","","","","1.025","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213722","10.9002","0.0003","12.4076","0.0004","12.8803","0.0002","90","","98.5","0.002","90","","1722.87","0.08","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C10 H17 Cl Cu N2 O8 S2 -","- C10 H17 Cl Cu N2 O8 S2 -","- C40 H68 Cl4 Cu4 N8 O32 S8 -","4","1","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.0435","0.0318","","","0.0711","0.076","","","","","","1.063","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213723","16.1013","0.0004","12.1614","0.0002","18.9485","0.0005","90","","90","","90","","3710.39","0.15","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H13 Cl Cu N4 O6 -","- C18 H13 Cl Cu N4 O6 -","- C144 H104 Cl8 Cu8 N32 O48 -","8","1","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.0578","0.0419","","","0.1155","0.1275","","","","","","1.079","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213724","14.1287","0.0007","8.6553","0.0003","15.737","0.0008","90","","110.535","0.002","90","","1802.17","0.14","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 Cl2 Cu N4 O12 -","- C12 H12 Cl2 Cu N4 O12 -","- C48 H48 Cl8 Cu4 N16 O48 -","4","0.5","","Golenya, Irina A.; Gumienna-Kontecka, Elzbieta; Haukka, Matti; Korsun, Oleksandr M.; Kalugin, Oleg N.; Fritsky, Igor O.","Copper(ii) complexes of 3- and 4-picolinehydroxamic acids: from mononuclear compounds to 1D- and 2D-coordination polymers","CrystEngComm","2014","16","10","1904","","10.1039/c3ce42343c","","","0.71073","MoKα","","0.0404","0.0323","","","0.0857","0.0912","","","","","","1.059","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213725","27.908","0.005","27.908","0.005","6.521","0.005","90","0.005","90","0.005","90","0.005","5079","4","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C28 H32 N2 O2 -","- C28 H32 N2 O2 -","- C224 H256 N16 O16 -","8","0.5","","Zhang, Ruilong; Zhang, Qiong; Liu, Zhaodi; Yang, Longmei; Wu, Jieying; Zhou, Hongping; Yang, Jiaxiang; Tian, Yupeng","Two polymorphs and cocrystal of styryl-pyridine derivatives with tuned emission induced by Co2+ and Zn(phen)32+","CrystEngComm","2014","16","10","2039","","10.1039/c3ce42069h","","","0.71069","MoKα","","0.1679","0.0749","","","0.1921","0.2462","","","","","","1.141","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213726","8.5234","0.0015","10.7419","0.0019","14.505","0.003","73.507","0.002","83.091","0.002","76.901","0.002","1238","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 N2 O2 -","- C28 H32 N2 O2 -","- C56 H64 N4 O4 -","2","1","","Zhang, Ruilong; Zhang, Qiong; Liu, Zhaodi; Yang, Longmei; Wu, Jieying; Zhou, Hongping; Yang, Jiaxiang; Tian, Yupeng","Two polymorphs and cocrystal of styryl-pyridine derivatives with tuned emission induced by Co2+ and Zn(phen)32+","CrystEngComm","2014","16","10","2039","","10.1039/c3ce42069h","","","0.71073","MoKα","","0.1809","0.0943","","","0.2441","0.3201","","","","","","1.059","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213727","10.976","0.005","12.928","0.005","18.049","0.005","90.231","0.005","92.082","0.005","113.369","0.005","2349","1.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H40 Cl2 N7 O9 Zn -","- C50 H40 Cl2 N7 O9 Zn -","- C100 H80 Cl4 N14 O18 Zn2 -","2","1","","Zhang, Ruilong; Zhang, Qiong; Liu, Zhaodi; Yang, Longmei; Wu, Jieying; Zhou, Hongping; Yang, Jiaxiang; Tian, Yupeng","Two polymorphs and cocrystal of styryl-pyridine derivatives with tuned emission induced by Co2+ and Zn(phen)32+","CrystEngComm","2014","16","10","2039","","10.1039/c3ce42069h","","","0.71069","MoKα","","0.1143","0.0731","","","0.2088","0.2326","","","","","","1.325","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213728","12.0653","0.0005","29.4244","0.0012","7.6893","0.0003","90","","90","","90","","2729.81","0.19","296","2","296","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","Hup A Form H2","","","- C15 H20 N2 O2 -","- C15 H18 N2 O1.9435 -","- C120 H144 N16 O15.548 -","8","2","","Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng","Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation","CrystEngComm","2014","16","10","1919","","10.1039/c3ce41965g","","","0.71073","MoKα","","0.1092","0.0497","","","0.0793","0.0912","","","","","","0.827","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213729","14.7583","0.0014","29.841","0.003","7.5013","0.0008","90","","90","","90","","3303.6","0.6","296","2","296","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","Hup A Form S1","","","- C17.5 H24 N2 O1.5 -","- C17.5 H24 N2 O1.5 -","- C140 H192 N16 O12 -","8","2","","Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng","Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation","CrystEngComm","2014","16","10","1919","","10.1039/c3ce41965g","","","0.71073","MoKα","","0.0879","0.0575","","","0.1286","0.143","","","","","","0.995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213730","8.0666","0.0006","16.294","0.0012","12.7096","0.001","90","","94.054","0.004","90","","1666.3","0.2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","Hup A Form S4","","","- C18 H25 N2 O -","- C18 H25 N2 O -","- C72 H100 N8 O4 -","4","2","","Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng","Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation","CrystEngComm","2014","16","10","1919","","10.1039/c3ce41965g","","","0.71073","MoKα","","0.0433","0.0422","","","0.1168","0.1186","","","","","","1.042","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213731","12.1","0.002","29.76","0.006","7.7","0.0015","90","","90","","90","","2772.7","0.9","273","2","273","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","Hup A Form s3","","","- C15.25 H18.75 N2.25 O1.5 -","- C15.25 H18.75 N2.25 O1.5 -","- C122 H150 N18 O12 -","8","2","","Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng","Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation","CrystEngComm","2014","16","10","1919","","10.1039/c3ce41965g","","","0.71073","MoKα","","0.0821","0.056","","","0.1505","0.1681","","","","","","1.023","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213732","19.9216","0.0004","7.4733","0.0001","15.2146","0.0003","90","","130.274","0.001","90","","1728.22","0.06","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","Hup A Form S2","","","- C19 H26 N2 O2 -","- C19 H26 N2 O2 -","- C76 H104 N8 O8 -","4","1","","Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng","Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation","CrystEngComm","2014","16","10","1919","","10.1039/c3ce41965g","","","0.71073","MoKα","","0.0369","0.0361","","","0.1011","0.102","","","","","","1.053","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213733","11.1699","0.0002","14.0489","0.0003","27.7447","0.0003","102.364","0.001","97.794","0.001","100.39","0.002","4113.77","0.13","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C74 H63 Cl Cu5 I4 N6 O25 Sm3 -","- C74 Cl Cu5 I4 N6 O25 Sm3 -","- C148 Cl2 Cu10 I8 N12 O50 Sm6 -","2","1","","Fang, Wei-Hui; Yang, Guo-Yu","Constructing heterometallic frameworks with highly connected topology based on edge-to-edge hexanuclear lanthanide clusters","CrystEngComm","2014","16","10","1885","","10.1039/c3ce42224k","","","1.54178","CuKα","","0.0881","0.076","","","0.2019","0.2164","","","","","","0.991","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213734","11.2148","0.0002","17.3605","0.0002","26.9709","0.0005","84.067","0.001","85.012","0.002","71.92","0.002","4956.7","0.15","293","2","293","2","","","","","","","","8","P 1","P 1","1","","","","- C168 H142 Cl2 Cu14 I12 N14 O53 Sm6 -","- C168 Cl2 Cu14 I12 N14 O53 Sm6 -","- C168 Cl2 Cu14 I12 N14 O53 Sm6 -","1","1","","Fang, Wei-Hui; Yang, Guo-Yu","Constructing heterometallic frameworks with highly connected topology based on edge-to-edge hexanuclear lanthanide clusters","CrystEngComm","2014","16","10","1885","","10.1039/c3ce42224k","","","0.71073","MoKα","","0.0534","0.0475","","","0.1328","0.1382","","","","","","1.026","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213735","10.6782","0.0002","8.3255","0.0001","20.312","0.0005","90","","105.218","0.003","90","","1742.44","0.06","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-nitro-benzylidene)-hydrazine","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-nitro-benzylidene)-hydrazine","","- C17 H16 N4 O4 S -","- C17 H16 N4 O4 S -","- C68 H64 N16 O16 S4 -","4","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0397","0.0366","","","0.1008","0.1048","","","","","","1.039","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213736","14.3069","0.0003","7.0786","0.0002","14.4568","0.0006","90","","91.803","0.002","90","","1463.36","0.08","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(2-methyl-benzylidene)-hydrazine","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(2-methyl-benzylidene)-hydrazine","","- C16 H15 N3 O2 S -","- C16 H15 N3 O2 S -","- C64 H60 N12 O8 S4 -","4","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0352","0.0334","","","0.0975","0.0995","","","","","","1.07","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213737","7.317","0.0001","13.0149","0.0002","16.1806","0.0002","90","","90","","90","","1540.88","0.04","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","","- C16 H15 N3 O2 S -","- C16 H15 N3 O2 S -","- C64 H60 N12 O8 S4 -","4","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.029","0.0275","","","0.0756","0.0772","","","","","","1.065","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213738","8.1464","0.0003","8.3969","0.0003","11.1659","0.0004","86.728","0.003","84.54","0.003","86.4","0.003","757.83","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-methyl-benzylidene)-hydrazine","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-methyl-benzylidene)-hydrazine","","- C16 H15 N3 O2 S -","- C16 H15 N3 O2 S -","- C32 H30 N6 O4 S2 -","2","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0388","0.0346","","","0.1022","0.1081","","","","","","0.972","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213739","26.6368","0.001","7.1909","0.0002","8.6143","0.0003","90","","112.741","0.004","90","","1521.74","0.1","296","2","296","2","","","","","","","","5","P 1 n 1","P -2yac","7","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methoxy-benzylidene)-hydrazine","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-methyl-benzylidene)-hydrazine","","- C16 H15 N3 O3 S -","- C16 H15 N3 O3 S -","- C64 H60 N12 O12 S4 -","4","2","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0517","0.0419","","","0.1273","0.1377","","","","","","1.043","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213740","14.1043","0.0002","8.4919","0.0001","28.3452","0.0004","90","","93.671","0.002","90","","3388","0.08","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4-[(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1l6-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-hydrazonomethyl]-2-ethoxy-phenol","4-[(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1l6-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-hydrazonomethyl]-2-ethoxy-phenol","","- C18 H19 N3 O3 S -","- C18 H19 N3 O3 S -","- C144 H152 N24 O24 S8 -","8","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.062","0.06","","","0.1888","0.1915","","","","","","1.048","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213741","6.6454","0.0001","10.9886","0.0002","21.2138","0.0004","90","","90","","90","","1549.11","0.05","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(2-methoxy-benzylidene)-hydrazine","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(2-methoxy-benzylidene)-hydrazine","","- C16 H15 N3 O3 S -","- C16 H15 N3 O3 S -","- C64 H60 N12 O12 S4 -","4","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0308","0.0297","","","0.0806","0.0818","","","","","","0.922","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213742","8.2437","0.0004","9.5959","0.0005","11.1377","0.0006","95.383","0.004","107.003","0.004","112.475","0.005","757.18","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-methoxy-benzylidene)-hydrazine","<i>N</i>-(1,1-Dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(3-methoxy-benzylidene)-hydrazine","","- C16 H15 N3 O3 S -","- C16 H15 N3 O3 S -","- C32 H30 N6 O6 S2 -","2","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0373","0.0348","","","0.0991","0.1024","","","","","","0.962","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213743","8.4612","0.0003","8.35","0.0003","24.9103","0.0009","90","","94.49","0.003","90","","1754.54","0.11","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","","- C18 H19 N3 O2 S -","- C18 H19 N3 O2 S -","- C72 H76 N12 O8 S4 -","4","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.0608","0.0533","","","0.1526","0.1637","","","","","","1.041","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213744","8.5087","0.0005","9.0853","0.0006","19.3952","0.0008","89.564","0.004","79.817","0.004","73.739","0.006","1415.28","0.15","296","2","296","2","","","","","","","","5","P -1","-P 1","2","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","","- C15 H13 N3 O2 S -","- C15 H13 N3 O2 S -","- C60 H52 N12 O8 S4 -","4","2","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.1163","0.0851","","","0.2201","0.2664","","","","","","1.05","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213745","6.3407","0.0001","16.6106","0.0004","14.4754","0.0003","90","","90","","90","","1524.59","0.05","296","2","296","2","","","","","","","","6","P n a 21","P 2c -2n","33","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","<i>N</i>-(2-Ethyl-1,1-dioxo-2,3-dihydro-1<i>H</i>-1λ^6^-benzo[<i>e</i>][1,2] thiazin-4-ylidene)-<i>N</i>'-(4-methyl-benzylidene)-hydrazine","","- C15 H12 Br N3 O2 S -","- C15 H12 Br N3 O2 S -","- C60 H48 Br4 N12 O8 S4 -","4","1","","Aman, Farhana; Asiri, Abdullah M.; Siddiqui, Waseeq A.; Arshad, Muhammad Nadeem; Ashraf, Adnan; Zakharov, Nikita S.; Blatov, Vladislav A.","Multilevel topological description of molecular packings in 1,2-benzothiazines","CrystEngComm","2014","16","10","1963","","10.1039/c3ce42218f","","","1.54184","CuKα","","0.057","0.0565","","","0.1507","0.152","","","","","","1.039","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213746","9.215","0.0003","18.8491","0.0005","10.429","0.0003","90","","100.392","0.003","90","","1781.75","0.09","284","2","284","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cu F6 N12 O6 S4 -","- C28 H24 Cu F6 N12 O6 S4 -","- C56 H48 Cu2 F12 N24 O12 S8 -","2","0.5","","Ma, Jian-Ping; Liu, Shao-Chen; Zhao, Chao-Wei; Zhang, Xiao-Meng; Sun, Chuan-Zhi; Dong, Yu-Bin","Reversible visual thermochromic coordination polymers via single-crystal-to-single-crystal transformation","CrystEngComm","2014","16","3","304","","10.1039/c3ce41886c","","","0.71073","MoKα","","0.0441","0.0333","","","0.0725","0.0781","","","","","","1.048","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213747","9.2224","0.0007","18.8786","0.0013","10.4661","0.0008","90","","100.366","0.007","90","","1792.5","0.2","323","2","323","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cu F6 N12 O6 S4 -","- C28 H24 Cu F6 N12 O6 S4 -","- C56 H48 Cu2 F12 N24 O12 S8 -","2","0.5","","Ma, Jian-Ping; Liu, Shao-Chen; Zhao, Chao-Wei; Zhang, Xiao-Meng; Sun, Chuan-Zhi; Dong, Yu-Bin","Reversible visual thermochromic coordination polymers via single-crystal-to-single-crystal transformation","CrystEngComm","2014","16","3","304","","10.1039/c3ce41886c","","","0.71073","MoKα","","0.0754","0.0434","","","0.0823","0.0996","","","","","","1.081","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213748","9.2249","0.0009","18.8564","0.0013","10.4413","0.0011","90","","100.292","0.01","90","","1787","0.3","353","2","353","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cu F6 N12 O6 S4 -","- C28 H24 Cu F6 N12 O6 S4 -","- C56 H48 Cu2 F12 N24 O12 S8 -","2","0.5","","Ma, Jian-Ping; Liu, Shao-Chen; Zhao, Chao-Wei; Zhang, Xiao-Meng; Sun, Chuan-Zhi; Dong, Yu-Bin","Reversible visual thermochromic coordination polymers via single-crystal-to-single-crystal transformation","CrystEngComm","2014","16","3","304","","10.1039/c3ce41886c","","","0.71073","MoKα","","0.0689","0.0444","","","0.0874","0.1007","","","","","","1.079","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213749","9.2121","0.0008","18.8386","0.0013","10.4187","0.001","90","","100.408","0.009","90","","1778.3","0.3","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cu F6 N12 O6 S4 -","- C28 H24 Cu F6 N12 O6 S4 -","- C56 H48 Cu2 F12 N24 O12 S8 -","2","0.5","","Ma, Jian-Ping; Liu, Shao-Chen; Zhao, Chao-Wei; Zhang, Xiao-Meng; Sun, Chuan-Zhi; Dong, Yu-Bin","Reversible visual thermochromic coordination polymers via single-crystal-to-single-crystal transformation","CrystEngComm","2014","16","3","304","","10.1039/c3ce41886c","","","0.71073","MoKα","","0.0853","0.0488","","","0.0847","0.1047","","","","","","1.06","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213750","8.4724","0.0015","9.3461","0.0017","11.4906","0.0019","82.012","0.002","76.92","0.002","69.835","0.002","830.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H7 N4 O8 Zn2 -","- C15 H7 N4 O8 Zn2 -","- C30 H14 N8 O16 Zn4 -","2","1","","He, Hongming; Sun, Fuxing; Su, Hongmin; Jia, Jiangtao; Li, Qin; Zhu, Guangshan","Syntheses, structures and luminescence properties of three metal‒organic frameworks based on 5-(4-(2H-tetrazol-5-yl)phenoxy)isophthalic acid","CrystEngComm","2014","16","3","339","","10.1039/c3ce41764f","","","0.71073","MoKα","","0.0399","0.0382","","","0.1037","0.1049","","","","","","1.082","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213751","9.1794","0.0009","9.46","0.0009","11.1538","0.001","90.726","0.001","100.252","0.001","105.265","0.001","917.66","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H7 Cd2 N4 O9 -","- C15 H7 Cd2 N4 O9 -","- C30 H14 Cd4 N8 O18 -","2","1","","He, Hongming; Sun, Fuxing; Su, Hongmin; Jia, Jiangtao; Li, Qin; Zhu, Guangshan","Syntheses, structures and luminescence properties of three metal‒organic frameworks based on 5-(4-(2H-tetrazol-5-yl)phenoxy)isophthalic acid","CrystEngComm","2014","16","3","339","","10.1039/c3ce41764f","","","0.71073","MoKα","","0.031","0.0244","","","0.057","0.0604","","","","","","1.034","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213752","9.117","0.016","9.452","0.016","10.914","0.019","97.53","0.03","92.11","0.02","103.25","0.03","905","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H7 Co2 N4 O9 -","- C15 H7 Co2 N4 O9 -","- C30 H14 Co4 N8 O18 -","2","1","","He, Hongming; Sun, Fuxing; Su, Hongmin; Jia, Jiangtao; Li, Qin; Zhu, Guangshan","Syntheses, structures and luminescence properties of three metal‒organic frameworks based on 5-(4-(2H-tetrazol-5-yl)phenoxy)isophthalic acid","CrystEngComm","2014","16","3","339","","10.1039/c3ce41764f","","","0.71073","MoKα","","0.0877","0.0603","","","0.1572","0.1768","","","","","","1.022","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213753","12.9517","0.0017","14.733","0.002","20.052","0.003","90","","129.256","0.008","90","","2962.8","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 Cu3 N28 O2 -","- C30 H30 Cu3 N28 O2 -","- C60 H60 Cu6 N56 O4 -","2","0.5","","Goswami, Soumyabrata; Sanda, Suresh; Konar, Sanjit","A porous metal organic framework with a bcu-type topology involving in situ ligand formation ‒ synthesis, structure, magnetic property and gas adsorption studies","CrystEngComm","2014","16","3","369","","10.1039/c3ce41612g","","","0.71073","MoKα","","0.1281","0.0634","","","0.1371","0.1537","","","","","","0.905","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213754","9.4435","0.0004","11.7657","0.0005","14.9918","0.0007","110.335","0.002","90.018","0.002","93.142","0.002","1559.23","0.12","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H22 F6 La2 O20 P6 -","- C18 H22 F6 La2 O20 P6 -","- C36 H44 F12 La4 O40 P12 -","2","1","","Vilela, Sérgio M. F.; Fernandes, José A.; Ananias, Duarte; Carlos, Luís D.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Photoluminescent layered lanthanide‒organic framework based on a novel trifluorotriphosphonate organic linker","CrystEngComm","2014","16","3","344","","10.1039/c3ce41482e","","","0.71073","MoKα","","0.0805","0.0512","","","0.1148","0.1266","","","","","","1.083","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213755","9.7829","0.0005","9.9524","0.0005","17.051","0.0009","90","","100.424","0.002","90","","1632.74","0.15","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H16 F3 O11 P3 -","- C9 H16 F3 O11 P3 -","- C36 H64 F12 O44 P12 -","4","1","","Vilela, Sérgio M. F.; Fernandes, José A.; Ananias, Duarte; Carlos, Luís D.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Photoluminescent layered lanthanide‒organic framework based on a novel trifluorotriphosphonate organic linker","CrystEngComm","2014","16","3","344","","10.1039/c3ce41482e","","","0.71073","MoKα","","0.0449","0.0345","","","0.0924","0.0977","","","","","","1.054","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213756","8.1025","0.0003","8.7996","0.0003","14.951","0.0006","90","","90","","90","","1065.99","0.07","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H6 Cl3 F3 -","- C9 H6 Cl3 F3 -","- C36 H24 Cl12 F12 -","4","1","","Vilela, Sérgio M. F.; Fernandes, José A.; Ananias, Duarte; Carlos, Luís D.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Photoluminescent layered lanthanide‒organic framework based on a novel trifluorotriphosphonate organic linker","CrystEngComm","2014","16","3","344","","10.1039/c3ce41482e","","","0.71073","MoKα","","0.0399","0.0314","","","0.0671","0.0717","","","","","","1.042","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213757","10.3141","0.0006","10.5339","0.0006","15.0122","0.001","69.566","0.003","71.856","0.003","69.669","0.003","1399.25","0.15","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H36 F3 O9 P3 -","- C21 H36 F3 O9 P3 -","- C42 H72 F6 O18 P6 -","2","1","","Vilela, Sérgio M. F.; Fernandes, José A.; Ananias, Duarte; Carlos, Luís D.; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Photoluminescent layered lanthanide‒organic framework based on a novel trifluorotriphosphonate organic linker","CrystEngComm","2014","16","3","344","","10.1039/c3ce41482e","","","0.71073","MoKα","","0.1017","0.052","","","0.1122","0.1298","","","","","","1.021","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213758","12.3512","0.0007","20.7502","0.0012","18.8896","0.0011","90","","90.759","0.001","90","","4840.8","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H31 Dy3 N2 O20 -","- C46 H31 Dy3 N2 O20 -","- C184 H124 Dy12 N8 O80 -","4","1","","Liu, Qing-Yan; Li, Yi-Lei; Wang, Yu-Ling; Liu, Cai-Ming; Ding, Li-Wen; Liu, Ying","Ionothermal synthesis of a 3D dysprosium‒1,4-benzenedicarboxylate framework based on the 1D rod-shaped dysprosium‒carboxylate building blocks exhibiting slow magnetization relaxation","CrystEngComm","2014","16","3","486","","10.1039/c3ce41624k","","","0.71073","MoKα","","0.0439","0.0256","","","0.0566","0.0647","","","","","","1.001","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213759","7.126","0.0014","10.736","0.002","10.971","0.002","60.99","0.03","89.03","0.03","86.86","0.03","732.9","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Naphthalene-perylene-7,7,8,8-tetracyanoquinodimethane complex","","- C42 H24 N4 -","- C42 H24 N4 -","- C42 H24 N4 -","1","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.0851","0.0509","","","0.1182","0.1394","","","","","","0.896","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213760","7.2362","0.0015","11.072","0.003","11.308","0.003","62.06","0.02","86.353","0.019","81.766","0.019","792.1","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Pyrene-perylene-7,7,8,8-tetracyanoquinodimethane complex","","- C48 H26 N4 -","- C48 H26 N4 -","- C48 H26 N4 -","1","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.1154","0.0903","","","0.2492","0.2735","","","","","","1.077","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213761","7.004","0.002","10.09","0.005","11.783","0.005","107.42","0.05","106.46","0.03","93.44","0.04","752.4","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Pyrene-7,7,8,8-tetracyanoquinodimethane complex (2:1)","","- C44 H24 N4 -","- C44 H24 N4 -","- C44 H24 N4 -","1","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.1418","0.0945","","","0.2292","0.2737","","","","","","0.977","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213762","6.9917","0.0014","10.069","0.002","14.671","0.003","90","","103.52","0.03","90","","1004.2","0.4","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Pyrene-7,7,8,8-tetracyanoquinodimethane complex","","- C28 H14 N4 -","- C28 H14 N4 -","- C56 H28 N8 -","2","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.0407","0.0337","","","0.0792","0.0823","","","","","","1.036","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213763","7.1533","0.0005","7.9721","0.0005","9.2258","0.0005","80.107","0.005","89.79","0.005","86.67","0.005","517.41","0.06","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Chrysene-7,7,8,8-tetracyanoquinodimethane complex","","- C30 H16 N4 -","- C30 H16 N4 -","- C30 H16 N4 -","1","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.0372","0.033","","","0.0887","0.0916","","","","","","1.088","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213764","6.7083","0.0009","8.0897","0.0012","9.118","0.002","101.212","0.016","97.72","0.015","99.521","0.012","471.54","0.15","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Phenanthrene-7,7,8,8-tetracyanoquinodimethane complex","","- C26 H14 N4 -","- C26 H14 N4 -","- C26 H14 N4 -","1","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.1716","0.0761","","","0.1763","0.2282","","","","","","0.967","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213765","7.4928","0.001","7.8003","0.001","8.1026","0.0011","84.297","0.006","81.124","0.006","61.343","0.005","410.4","0.1","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","Naphthalene-TCNQ complex","","- C22 H12 N4 -","- C22 H12 N4 -","- C22 H12 N4 -","1","0.5","","Dobrowolski, Michał A.; Garbarino, Gaston; Mezouar, Mohamed; Ciesielski, Arkadiusz; Cyrański, Michał K.","Structural diversities of charge transfer organic complexes. Focus on benzenoid hydrocarbons and 7,7,8,8-tetracyanoquinodimethane","CrystEngComm","2014","16","3","415","","10.1039/c3ce41703d","","","0.71073","MoKα","","0.035","0.0292","","","0.0795","0.0833","","","","","","1.054","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213766","7.9666","0.0016","9.4084","0.0019","9.6154","0.0019","89.66","0.03","71.19","0.03","69.77","0.03","635.6","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H11 Cu I N3 O -","- C12 H11 Cu I N3 O -","- C24 H22 Cu2 I2 N6 O2 -","2","1","","Zhang, Zhu-Yan; Deng, Zhao-Peng; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui; Gao, Shan","Self-assembly of [Cu3I2]- or [CuI]n-based (n = 2, 4, and ∞) coordination polymers from unsymmetrical bis(pyridyl) and in situ ligands: syntheses, structures, and properties","CrystEngComm","2014","16","3","359","","10.1039/c3ce41774c","","","0.71073","MoKα","","0.0945","0.0607","","","0.1218","0.1664","","","","","","1.078","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213767","23.0737","0.0014","11.5118","0.0007","16.6416","0.0009","90","","90","","90","","4420.3","0.4","295","2","295","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C42 H39 Cu3 I2 N4 P2 -","- C40 H36 Cu3 I2 N3 P2 -","- C160 H144 Cu12 I8 N12 P8 -","4","0.5","","Zhang, Zhu-Yan; Deng, Zhao-Peng; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui; Gao, Shan","Self-assembly of [Cu3I2]- or [CuI]n-based (n = 2, 4, and ∞) coordination polymers from unsymmetrical bis(pyridyl) and in situ ligands: syntheses, structures, and properties","CrystEngComm","2014","16","3","359","","10.1039/c3ce41774c","","","0.71073","MoKα","","0.0966","0.051","","","0.122","0.1531","","","","","","1.099","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213768","9.825","0.002","12.261","0.003","11.798","0.002","90","","93.34","0.03","90","","1418.8","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H9 Cu2 I2 N3 -","- C11 H9 Cu2 I2 N3 -","- C44 H36 Cu8 I8 N12 -","4","1","","Zhang, Zhu-Yan; Deng, Zhao-Peng; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui; Gao, Shan","Self-assembly of [Cu3I2]- or [CuI]n-based (n = 2, 4, and ∞) coordination polymers from unsymmetrical bis(pyridyl) and in situ ligands: syntheses, structures, and properties","CrystEngComm","2014","16","3","359","","10.1039/c3ce41774c","","","0.71073","MoKα","","0.084","0.0491","","","0.1025","0.1369","","","","","","1.055","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213769","18.782","0.004","9.3645","0.0019","18.609","0.004","90","","97.15","0.03","90","","3247.6","1.2","295","2","295","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C22 H24 Cu4 I4 N6 O -","- C22 H22 Cu4 I4 N6 O -","- C88 H88 Cu16 I16 N24 O4 -","4","1","","Zhang, Zhu-Yan; Deng, Zhao-Peng; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui; Gao, Shan","Self-assembly of [Cu3I2]- or [CuI]n-based (n = 2, 4, and ∞) coordination polymers from unsymmetrical bis(pyridyl) and in situ ligands: syntheses, structures, and properties","CrystEngComm","2014","16","3","359","","10.1039/c3ce41774c","","","0.71073","MoKα","","0.0955","0.0544","","","0.1434","0.1933","","","","","","1.094","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213770","18.5585","0.001","4.28","0.0002","19.0844","0.0009","90","","108.395","0.005","90","","1438.43","0.13","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H11 Cu2 I2 N3 -","- C11 H11 Cu2 I2 N3 -","- C44 H44 Cu8 I8 N12 -","4","0.5","","Zhang, Zhu-Yan; Deng, Zhao-Peng; Zhang, Xian-Fa; Huo, Li-Hua; Zhao, Hui; Gao, Shan","Self-assembly of [Cu3I2]- or [CuI]n-based (n = 2, 4, and ∞) coordination polymers from unsymmetrical bis(pyridyl) and in situ ligands: syntheses, structures, and properties","CrystEngComm","2014","16","3","359","","10.1039/c3ce41774c","","","0.71073","MoKα","","0.0541","0.0376","","","0.0804","0.0896","","","","","","1.046","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213771","12.797","0.003","13.532","0.003","14.117","0.003","77.43","0.03","82.7","0.03","75.15","0.03","2299.7","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H60 Ag4 N14 O42 Si W12 -","- C70 H56 Ag4 N14 O42 Si W12 -","- C70 H56 Ag4 N14 O42 Si W12 -","1","0.5","","Wang, La-Mei; Wang, Yan; Fan, Yong; Xiao, Li-Na; Hu, Yang-Yang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing","The design, syntheses and characterization of a series of hybrids based on polyoxometalates and metal complexes","CrystEngComm","2014","16","3","430","","10.1039/c3ce41611a","","","0.71073","MoKα","","0.1192","0.102","","","0.229","0.2414","","","","","","1.196","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213772","12.208","0.002","22.96","0.005","12.372","0.003","90","","113.85","0.03","90","","3171.7","1.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C40 H37 Cu Mo12 N8 O41 Si -","- C40 H32 Cu Mo12 N8 O41 Si -","- C80 H64 Cu2 Mo24 N16 O82 Si2 -","2","1","","Wang, La-Mei; Wang, Yan; Fan, Yong; Xiao, Li-Na; Hu, Yang-Yang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing","The design, syntheses and characterization of a series of hybrids based on polyoxometalates and metal complexes","CrystEngComm","2014","16","3","430","","10.1039/c3ce41611a","","","0.71073","MoKα","","0.0567","0.0525","","","0.1274","0.1321","","","","","","1.015","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213773","30.526","0.006","14.052","0.003","19.953","0.004","90","","118.88","0.03","90","","7494","3","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C46 H40 Cd2 Mo12 N8 O50 P V2 -","- C46 H32 Cd2 Mo12 N8 O50 P V2 -","- C184 H128 Cd8 Mo48 N32 O200 P4 V8 -","4","0.5","","Wang, La-Mei; Wang, Yan; Fan, Yong; Xiao, Li-Na; Hu, Yang-Yang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing","The design, syntheses and characterization of a series of hybrids based on polyoxometalates and metal complexes","CrystEngComm","2014","16","3","430","","10.1039/c3ce41611a","","","0.71073","MoKα","","0.0813","0.0576","","","0.141","0.155","","","","","","1.056","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213774","24.293","0.005","10.896","0.002","29.975","0.006","90","","90","","90","","7934","3","296","2","296","2","","","","","","","","8","P c c a","-P 2a 2ac","54","","","","- C52 H46 Cu4 Mo12 N10 O45 P V2 -","- C52 H40 Cu4 Mo12 N10 O45 P V2 -","- C208 H160 Cu16 Mo48 N40 O180 P4 V8 -","4","0.5","","Wang, La-Mei; Wang, Yan; Fan, Yong; Xiao, Li-Na; Hu, Yang-Yang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing","The design, syntheses and characterization of a series of hybrids based on polyoxometalates and metal complexes","CrystEngComm","2014","16","3","430","","10.1039/c3ce41611a","","","0.71073","MoKα","","0.1097","0.0672","","","0.1975","0.2277","","","","","","1.014","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213775","13.2145","0.0011","24.934","0.002","27.184","0.002","90","","90","","90","","8956.9","1.2","296","2","296","2","","","","","","","","8","I b a m","-I 2 2c","72","","","","- C68 H48 Cu4 Mo12 N12 O42 Si V2 -","- C68 H48 Cu4 Mo12 N12 O42 Si V2 -","- C272 H192 Cu16 Mo48 N48 O168 Si4 V8 -","4","0.25","","Wang, La-Mei; Wang, Yan; Fan, Yong; Xiao, Li-Na; Hu, Yang-Yang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing","The design, syntheses and characterization of a series of hybrids based on polyoxometalates and metal complexes","CrystEngComm","2014","16","3","430","","10.1039/c3ce41611a","","","0.71073","MoKα","","0.0716","0.0518","","","0.1347","0.1477","","","","","","1.046","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213776","13.2295","0.0008","24.9102","0.0017","27.2377","0.0019","90","","90","","90","","8976.2","1","296","2","296","2","","","","","","","","8","I b a m","-I 2 2c","72","","","","- C68 H48 Cu4 Ge Mo12 N12 O42 V2 -","- C68 H48 Cu4 Ge Mo12 N12 O42 V2 -","- C272 H192 Cu16 Ge4 Mo48 N48 O168 V8 -","4","0.25","","Wang, La-Mei; Wang, Yan; Fan, Yong; Xiao, Li-Na; Hu, Yang-Yang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing","The design, syntheses and characterization of a series of hybrids based on polyoxometalates and metal complexes","CrystEngComm","2014","16","3","430","","10.1039/c3ce41611a","","","0.71073","MoKα","","0.0844","0.0602","","","0.1708","0.1923","","","","","","1.038","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213777","10.5623","0.0005","18.0907","0.0005","23.0081","0.001","90","","102.177","0.003","90","","4297.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H37 Gd N8 Ni O13 -","- C41 H37 Gd N8 Ni O13 -","- C164 H148 Gd4 N32 Ni4 O52 -","4","1","","Ion, Adrian E.; Nica, Simona; Madalan, Augustin M.; Maxim, Catalin; Julve, Miguel; Lloret, Francesc; Andruh, Marius","One-dimensional coordination polymers constructed from di- and trinuclear {3d‒4f} tectons. A new useful spacer in crystal engineering: 1,3-bis(4-pyridyl)azulene","CrystEngComm","2014","16","3","319","","10.1039/c3ce41592a","","","0.71073","MoKα","","0.0607","0.0461","","","0.101","0.1068","","","","","","1.062","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213778","9.406","0.0014","13.526","0.003","18.568","0.003","74.727","0.013","81.42","0.012","80.592","0.013","2234.2","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H36 Eu N7 O14 Zn -","- C39 H34 Eu N7 O14 Zn -","- C78 H68 Eu2 N14 O28 Zn2 -","2","1","","Ion, Adrian E.; Nica, Simona; Madalan, Augustin M.; Maxim, Catalin; Julve, Miguel; Lloret, Francesc; Andruh, Marius","One-dimensional coordination polymers constructed from di- and trinuclear {3d‒4f} tectons. A new useful spacer in crystal engineering: 1,3-bis(4-pyridyl)azulene","CrystEngComm","2014","16","3","319","","10.1039/c3ce41592a","","","0.71073","MoKα","","0.1402","0.0878","","","0.2089","0.239","","","","","","0.984","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213779","9.0187","0.0018","9.5438","0.0019","10.835","0.002","87.16","0.017","89.548","0.017","61.353","0.015","817.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H22 Cu2 Gd N7 O14 -","- C28 H22 Cu2 Gd N7 O14 -","- C28 H22 Cu2 Gd N7 O14 -","1","0.5","","Ion, Adrian E.; Nica, Simona; Madalan, Augustin M.; Maxim, Catalin; Julve, Miguel; Lloret, Francesc; Andruh, Marius","One-dimensional coordination polymers constructed from di- and trinuclear {3d‒4f} tectons. A new useful spacer in crystal engineering: 1,3-bis(4-pyridyl)azulene","CrystEngComm","2014","16","3","319","","10.1039/c3ce41592a","","","0.71073","MoKα","","0.066","0.0484","","","0.109","0.1165","","","","","","0.958","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213780","15.051","0.003","30.966","0.006","16.201","0.003","90","","93.23","0.03","90","","7539","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H30 Dy N3 Ni2 O23 -","- C40 H30 Dy N3 Ni2 O23 -","- C160 H120 Dy4 N12 Ni8 O92 -","4","1","","Ion, Adrian E.; Nica, Simona; Madalan, Augustin M.; Maxim, Catalin; Julve, Miguel; Lloret, Francesc; Andruh, Marius","One-dimensional coordination polymers constructed from di- and trinuclear {3d‒4f} tectons. A new useful spacer in crystal engineering: 1,3-bis(4-pyridyl)azulene","CrystEngComm","2014","16","3","319","","10.1039/c3ce41592a","","","0.71073","MoKα","","0.093","0.0578","","","0.1515","0.1652","","","","","","0.951","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213781","11.595","0.002","13.96","0.003","12.667","0.002","90","","102.092","0.003","90","","2004.9","0.6","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C46 H38 Mn N8 O5 -","- C46 H38 Mn N8 O5 -","- C92 H76 Mn2 N16 O10 -","2","1","","Wu, Zhe; Sun, Wujuan; Chai, Ying; Zhao, Wenjie; Wu, He; Shi, Ting; Yang, Xuwu","A series of coordination polymers based on a new 2′,5′-dimethyl-1,1′:4′,1′′-terphenyl-3,3′′-dicarboxylic acid ligand: structures, luminescence, and magnetic properties","CrystEngComm","2014","16","3","406","","10.1039/c3ce41971a","","","0.71073","MoKα","","0.1042","0.0717","","","0.174","0.207","","","","","","1","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213782","10.551","0.003","12.28","0.003","14.417","0.004","82.256","0.005","88.642","0.005","79.904","0.004","1822.3","0.9","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H30 Cd N4 O4 -","- C40 H30 Cd N4 O4 -","- C80 H60 Cd2 N8 O8 -","2","1","","Wu, Zhe; Sun, Wujuan; Chai, Ying; Zhao, Wenjie; Wu, He; Shi, Ting; Yang, Xuwu","A series of coordination polymers based on a new 2′,5′-dimethyl-1,1′:4′,1′′-terphenyl-3,3′′-dicarboxylic acid ligand: structures, luminescence, and magnetic properties","CrystEngComm","2014","16","3","406","","10.1039/c3ce41971a","","","0.71073","MoKα","","0.0418","0.0367","","","0.0972","0.1057","","","","","","1.078","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213783","11.4316","0.001","22.867","0.002","14.3083","0.0012","90","","91.096","0.002","90","","3739.6","0.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C90 H64 Cd3 N4 O12 -","- C90 H64 Cd3 N4 O12 -","- C180 H128 Cd6 N8 O24 -","2","0.5","","Wu, Zhe; Sun, Wujuan; Chai, Ying; Zhao, Wenjie; Wu, He; Shi, Ting; Yang, Xuwu","A series of coordination polymers based on a new 2′,5′-dimethyl-1,1′:4′,1′′-terphenyl-3,3′′-dicarboxylic acid ligand: structures, luminescence, and magnetic properties","CrystEngComm","2014","16","3","406","","10.1039/c3ce41971a","","","0.71073","MoKα","","0.1103","0.0562","","","0.1106","0.1435","","","","","","0.992","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213784","11.3771","0.0014","22.53","0.003","14.3009","0.0017","90","","91.055","0.002","90","","3665.1","0.8","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C90 H64 Mn3 N4 O12 -","- C90 H64 Mn3 N4 O12 -","- C180 H128 Mn6 N8 O24 -","2","0.5","","Wu, Zhe; Sun, Wujuan; Chai, Ying; Zhao, Wenjie; Wu, He; Shi, Ting; Yang, Xuwu","A series of coordination polymers based on a new 2′,5′-dimethyl-1,1′:4′,1′′-terphenyl-3,3′′-dicarboxylic acid ligand: structures, luminescence, and magnetic properties","CrystEngComm","2014","16","3","406","","10.1039/c3ce41971a","","","0.71073","MoKα","","0.0767","0.0449","","","0.1237","0.1532","","","","","","1","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213785","21.075","0.002","7.0239","0.0007","31.99","0.003","90","","104.356","0.002","90","","4587.6","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H48 Mn2 N2 O11 -","- C50 H48 Mn2 N2 O11 -","- C200 H192 Mn8 N8 O44 -","4","1","","Wu, Zhe; Sun, Wujuan; Chai, Ying; Zhao, Wenjie; Wu, He; Shi, Ting; Yang, Xuwu","A series of coordination polymers based on a new 2′,5′-dimethyl-1,1′:4′,1′′-terphenyl-3,3′′-dicarboxylic acid ligand: structures, luminescence, and magnetic properties","CrystEngComm","2014","16","3","406","","10.1039/c3ce41971a","","","0.71073","MoKα","","0.1255","0.0596","","","0.1447","0.202","","","","","","0.996","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213786","19.134","0.004","12.902","0.003","22.579","0.005","90","","91.1","0.03","90","","5573","2","153","2","426","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C100 H98 Cl4 Fe6 N4 O26 S10 -","- C100 H98 Cl4 Fe6 N4 O26 S10 -","- C200 H196 Cl8 Fe12 N8 O52 S20 -","2","0.5","","Jiang, Guomin; Wang, Miao; Gu, Xuefang; Chen, Tingting; Shang, Yanfang; Tang, Yanfeng; Jiang, Guoqing; Shi, Yujun","Synthesis, structure and characterization of Fe6 molecular clusters with peripheral sulfur atom-capped silver nanoparticles","CrystEngComm","2014","16","3","472","","10.1039/c3ce41444b","","","0.71073","MoKα","","0.1081","0.0856","","","0.2021","0.2197","","","","","","1.091","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213787","15.365","0.003","31.833","0.006","16.779","0.003","90","","90","","90","","8207","3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C58 H72 Mn4 N28 O32 -","- C58 H53 Mn4 N28 O28 -","- C232 H212 Mn16 N112 O112 -","4","0.5","","Li, Huijun; Xu, Zhouqing; Zhao, Bei; Jia, Yanyuan; Ding, Ran; Hou, Hongwei; Fan, Yaoting","Nuclearity control of manganese polymers dependent on structural differences in the coligands and magnetic properties studies","CrystEngComm","2014","16","12","2470","","10.1039/c3ce41553h","","","0.71073","MoKα","","0.1058","0.0878","","","0.2055","0.2171","","","","","","1.104","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213788","13.519","0.003","14.955","0.003","15.356","0.003","102.35","0.03","109.47","0.03","110.99","0.03","2529.4","1.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H52 Mn3 N10 O22 -","- C43 H50 Mn3 N10 O22 -","- C86 H100 Mn6 N20 O44 -","2","1","","Li, Huijun; Xu, Zhouqing; Zhao, Bei; Jia, Yanyuan; Ding, Ran; Hou, Hongwei; Fan, Yaoting","Nuclearity control of manganese polymers dependent on structural differences in the coligands and magnetic properties studies","CrystEngComm","2014","16","12","2470","","10.1039/c3ce41553h","","","0.71073","MoKα","","0.045","0.0402","","","0.1055","0.1098","","","","","","1.089","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213789","13.527","0.003","14.982","0.003","15.036","0.003","62.09","0.03","67.21","0.03","74.82","0.03","2470.4","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H50 Mn3 N10 O22 -","- C42 H48 Mn3 N10 O21 -","- C84 H96 Mn6 N20 O42 -","2","1","","Li, Huijun; Xu, Zhouqing; Zhao, Bei; Jia, Yanyuan; Ding, Ran; Hou, Hongwei; Fan, Yaoting","Nuclearity control of manganese polymers dependent on structural differences in the coligands and magnetic properties studies","CrystEngComm","2014","16","12","2470","","10.1039/c3ce41553h","","","0.71073","MoKα","","0.088","0.0772","","","0.2068","0.2168","","","","","","1.067","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213790","28.334","0.006","13.063","0.003","6.7989","0.0014","90","","90","","90","","2516.5","0.9","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C25 H27 Mn N5 O9 -","- C25 H27 Mn N5 O9 -","- C100 H108 Mn4 N20 O36 -","4","1","","Li, Huijun; Xu, Zhouqing; Zhao, Bei; Jia, Yanyuan; Ding, Ran; Hou, Hongwei; Fan, Yaoting","Nuclearity control of manganese polymers dependent on structural differences in the coligands and magnetic properties studies","CrystEngComm","2014","16","12","2470","","10.1039/c3ce41553h","","","0.71073","MoKα","","0.051","0.0435","","","0.0958","0.1107","","","","","","1.032","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213791","9.7736","0.0004","6.5159","0.0002","11.9527","0.0005","90","","105.729","0.002","90","","732.69","0.05","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 N O3 -","- C17 H19 N O3 -","- C34 H38 N2 O6 -","2","1","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.0349","0.0339","","","0.0964","0.099","","","","","","0.825","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213792","24.03","0.003","24.03","0.003","15.0512","0.0019","90","","90","","90","","8691.2","1.9","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H72 N8 Ni4 O16 -","- C68 H72 N8 Ni4 O16 -","- C272 H288 N32 Ni16 O64 -","4","0.25","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.0931","0.0488","","","0.1235","0.1385","","","","","","0.936","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213793","23.871","0.0019","15.5094","0.0013","19.9409","0.0019","90","","107.492","0.005","90","","7041.2","1.1","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C56 H40 N8 Ni4 O20 -","- C56 H40 N8 Ni4 O20 -","- C224 H160 N32 Ni16 O80 -","4","1","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.0493","0.0391","","","0.101","0.1063","","","","","","1.048","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213794","26.43","0.0019","15.9077","0.0011","35.039","0.003","90","","109.497","0.001","90","","13887.1","1.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C67 H66 N12 Ni4 O20 -","- C67 H66 N12 Ni4 O20 -","- C536 H528 N96 Ni32 O160 -","8","1","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.068","0.0574","","","0.1302","0.136","","","","","","1.042","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213795","14.3328","0.0017","16.1942","0.0019","16.976","0.002","71.996","0.002","68.484","0.002","66.013","0.002","3289.3","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H84 N4 Ni4 O16 -","- C56 H84 N4 Ni4 O16 -","- C112 H168 N8 Ni8 O32 -","2","1","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.03","0.0242","","","0.0624","0.0643","","","","","","1.055","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213796","14.8226","0.0012","15.9005","0.0013","17.7741","0.0014","85.655","0.002","66.279","0.001","72.521","0.002","3653.2","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H74 N4 Ni4 O16 -","- C72 H74 N4 Ni4 O16 -","- C144 H148 N8 Ni8 O32 -","2","1","","Karmakar, Sibasree; Khanra, Sumit","Polynuclear coordination compounds: a magnetostructural study of ferromagnetically coupled Ni4O4 cubane core motif","CrystEngComm","2014","16","12","2371","","10.1039/c3ce41125g","","","0.71073","MoKα","","0.1314","0.1272","","","0.2762","0.2784","","","","","","1.055","","","","has coordinates,has disorder","180468","2020-10-21","18:00:00",""
"7213797","27.7056","0.0006","23.395","0.0006","21.0709","0.0004","90","","113.911","0.002","90","","12485.4","0.5","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C139 H58 O96 Tm12 -","- C139 H58 O96 Tm12 -","- C278 H116 O192 Tm24 -","2","0.25","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0439","0.0326","","","0.0727","0.0757","","","","","","0.937","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213798","12.143","0.002","24.875","0.005","19.669","0.004","90","","102.9","0.03","90","","5791","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H6 Nd O10 -","- C16 H6 Nd O10 -","- C128 H48 Nd8 O80 -","8","1","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0598","0.0504","","","0.1486","0.1536","","","","","","1.114","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213799","11.66","0.002","12.245","0.002","13.568","0.003","64.88","0.03","68.25","0.03","88.14","0.03","1611.1","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H18 Eu3 O26 -","- C48 H18 Eu3 O26 -","- C48 H18 Eu3 O26 -","1","0.5","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0407","0.0325","","","0.0838","0.0995","","","","","","1.076","","","","has coordinates","180468","2020-10-21","18:00:00",""
"7213800","11.609","0.002","12.227","0.002","13.554","0.003","65","0.03","69.14","0.03","87.75","0.03","1615.2","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H18 O26 Tb3 -","- C48 H18 O26 Tb3 -","- C48 H18 O26 Tb3 -","1","0.5","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0467","0.0393","","","0.1218","0.1247","","","","","","1.145","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213801","11.647","0.002","12.247","0.002","13.604","0.003","65.01","0.03","67.88","0.03","88.32","0.03","1609.8","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H18 N0 O26 Sm3 -","- C48 H18 O26 Sm3 -","- C48 H18 O26 Sm3 -","1","0.5","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0309","0.0274","","","0.0882","0.0899","","","","","","1.098","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213802","11.5976","0.0011","12.213","0.0011","13.5187","0.0012","65.039","0.006","68.351","0.006","87.858","0.006","1597.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H18 Dy3 N0 O26 -","- C48 H18 Dy3 O26 -","- C48 H18 Dy3 O26 -","1","0.5","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0428","0.0333","","","0.0802","0.083","","","","","","0.927","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213803","19.318","0.004","14.082","0.003","8.8793","0.0018","90","","100.31","0.03","90","","2376.5","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H6 Er2 O16 -","- C19 H6 Er2 O16 -","- C76 H24 Er8 O64 -","4","0.5","","Zhang, Liying; Song, Tianyou; Xu, Jianing; Sun, Jiayin; Zeng, Shuangli; Wu, Yuncong; Fan, Yong; Wang, Li","Polymorphic Ln(iii) and BPTC-based porous metal‒organic frameworks with visible, NIR photoluminescent and magnetic properties","CrystEngComm","2014","16","12","2440","","10.1039/c3ce42181c","","","0.71073","MoKα","","0.0206","0.0193","","","0.0471","0.0476","","","","","","1.099","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213804","10.5171","0.0004","18.7049","0.0006","10.6498","0.0006","90","","102.156","0.004","90","","2048.07","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 N2 O8 -","- C24 H20 N2 O8 -","- C96 H80 N8 O32 -","4","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0924","0.0494","","","0.0809","0.096","","","","","","1.001","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213805","19.8521","0.0019","17.5183","0.001","10.0543","0.0006","90","","90.024","0.007","90","","3496.6","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Co N O9 -","- C12 H16 Co N O9 -","- C96 H128 Co8 N8 O72 -","8","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0989","0.0776","","","0.1738","0.188","","","","","","1.056","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213806","19.9019","0.0015","17.4988","0.0009","10.0418","0.0004","90","","90.003","0.005","90","","3497.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Mn N O9 -","- C12 H16 Mn N O9 -","- C96 H128 Mn8 N8 O72 -","8","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0911","0.0711","","","0.1638","0.1718","","","","","","1.035","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213807","20.073","0.009","17.96","0.008","10.293","0.006","90","","94.471","0.01","90","","3699","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 Cd N O8 -","- C12 H16 Cd N O8 -","- C96 H128 Cd8 N8 O64 -","8","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.1119","0.0795","","","0.1821","0.1961","","","","","","1.062","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213808","27.733","0.015","10.217","0.006","14.405","0.008","90","","92.45","0.009","90","","4078","4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H32 N6 O11 Zn2 -","- C44 H32 N6 O11 Zn2 -","- C176 H128 N24 O44 Zn8 -","4","0.5","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0745","0.0527","","","0.1482","0.1624","","","","","","1.057","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213809","10.235","0.005","9.554","0.005","24.242","0.009","90","","112.62","0.016","90","","2188.2","1.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C44 H42 Cd2 N6 O13 -","- C44 H36 Cd2 N6 O13 -","- C88 H72 Cd4 N12 O26 -","2","0.5","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0483","0.0384","","","0.0971","0.1027","","","","","","1.014","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213810","27.937","0.008","10.472","0.003","14.34","0.005","90","","90.467","0.007","90","","4195","2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H18 N3 O5 Zn -","- C24 H16 N3 O5 Zn -","- C192 H128 N24 O40 Zn8 -","8","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0987","0.0546","","","0.1234","0.1392","","","","","","1.035","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213811","10.746","0.004","15.84","0.005","15.859","0.006","90","","130.94","0.04","90","","2039.2","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 Cu N3 O5 -","- C24 H18 Cu N3 O5 -","- C96 H72 Cu4 N12 O20 -","4","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0512","0.0388","","","0.0907","0.0972","","","","","","1.014","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213812","28.13","0.004","9.703","0.005","15.619","0.006","90","","100.37","0.03","90","","4193","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 N3 Ni O6 -","- C22 H18 N3 Ni O6 -","- C176 H144 N24 Ni8 O48 -","8","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.1319","0.0631","","","0.1327","0.1569","","","","","","1.033","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213813","10.523","0.004","16.289","0.007","11.71","0.004","90","","91.087","0.007","90","","2006.8","1.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 N3 O5 Zn -","- C24 H18 N3 O5 Zn -","- C96 H72 N12 O20 Zn4 -","4","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0832","0.0525","","","0.1122","0.1274","","","","","","0.977","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213814","11.405","0.0008","11.156","0.0008","15.193","0.0011","90","","94.211","0.001","90","","1927.9","0.2","296","2","296","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C44 H34 Cu N6 O8 -","- C44 H34 Cu N6 O8 -","- C88 H68 Cu2 N12 O16 -","2","1","","Jia, Chunmei; Lin, Qiang; Yuan, Wenbing","A series of coordination polymers constructed by a flexible tetracarboxylic acid: synthesis, structural diversity and luminescent properties","CrystEngComm","2014","16","12","2508","","10.1039/c3ce42127a","","","0.71073","MoKα","","0.0625","0.0402","","","0.0731","0.0786","","","","","","1.005","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213815","14.424","0.005","16.241","0.006","16.635","0.01","104.014","0.009","105.078","0.009","109.873","0.006","3296","3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H49 N5 O4 -","- C33 H49 N5 O4 -","- C132 H196 N20 O16 -","4","2","","Maity, Suman Kumar; Bera, Santu; Paikar, Arpita; Pramanik, Apurba; Haldar, Debasish","Fabrication of self-assembled peptidomimetic microspheres and hydrogen peroxide responsive release of nicotinamide","CrystEngComm","2014","16","12","2527","","10.1039/c3ce41796d","","","0.71073","MoKα","","0.1274","0.0887","","","0.2717","0.3288","","","","","","1.258","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213816","7.1357","0.0005","20.7857","0.0012","7.6013","0.0004","90","","116.33","0.003","90","","1010.46","0.11","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 N3 O4 -","- C9 H9 N3 O4 -","- C36 H36 N12 O16 -","4","1","","Maity, Suman Kumar; Bera, Santu; Paikar, Arpita; Pramanik, Apurba; Haldar, Debasish","Fabrication of self-assembled peptidomimetic microspheres and hydrogen peroxide responsive release of nicotinamide","CrystEngComm","2014","16","12","2527","","10.1039/c3ce41796d","","","0.71073","MoKα","","0.0806","0.0582","","","0.1594","0.1824","","","","","","0.923","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213817","13.466","0.005","9.033","0.003","18.952","0.007","90","","95.102","0.005","90","","2296.2","1.4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Cl2 N6 O3 S4 U -","- C14 H12 Cl2 N6 O3 S4 U -","- C56 H48 Cl8 N24 O12 S16 U4 -","4","0.5","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0354","0.0281","","","0.0541","0.0561","","","","","","1.008","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213818","6.4685","0.0013","15.007","0.003","25.732","0.005","90","","90","","90","","2497.9","0.9","100","2","100","2","","","","","","","","7","P b c m","-P 2c 2b","57","","","","- C14 H14 Br2 N6 O4 S4 U -","- C14 H10 Br2 N6 O4 S4 U -","- C56 H40 Br8 N24 O16 S16 U4 -","4","0.5","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0313","0.0243","","","0.0526","0.0549","","","","","","1.057","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213819","6.6151","0.0018","14.993","0.004","25.896","0.007","90","","91.068","0.004","90","","2567.9","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 I2 N6 O4 S4 U -","- C14 H10 I2 N6 O4 S4 U -","- C56 H40 I8 N24 O16 S16 U4 -","4","1","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0736","0.057","","","0.1276","0.1333","","","","","","1.15","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213820","6.7452","0.0004","15.1032","0.0008","25.9377","0.0014","90","","90","","90","","2642.4","0.3","293","2","293","2","","","","","","","","7","P b c m","-P 2c 2b","57","","","","- C14 H14 I2 N6 O4 S4 U -","- C14 H10 I2 N6 O4 S4 U -","- C56 H40 I8 N24 O16 S16 U4 -","4","0.5","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.072","0.0358","","","0.0648","0.0752","","","","","","1.001","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213821","13.407","0.003","8.8724","0.0017","24.9","0.005","90","","102.363","0.003","90","","2893.2","1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 N8 O7 S6 U -","- C16 H10 N8 O7 S6 U -","- C64 H40 N32 O28 S24 U4 -","4","0.5","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0338","0.0317","","","0.0765","0.0775","","","","","","1.032","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213822","14.654","0.002","9.0207","0.0014","17.766","0.003","90","","92.078","0.002","90","","2346.9","0.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H18 N6 O3 S4 U -","- C16 H16 N6 O3 S4 U -","- C64 H64 N24 O12 S16 U4 -","4","0.5","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0264","0.0223","","","0.0449","0.046","","","","","","1.067","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213823","8.761","0.002","16.018","0.004","16.129","0.004","90","","95.282","0.004","90","","2253.8","0.9","100","2","100","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C16 H18 N6 O3 S4 U -","- C16 H16 N6 O3 S4 U -","- C64 H64 N24 O12 S16 U4 -","4","1","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0591","0.0418","","","0.0909","0.0986","","","","","","1.031","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213824","8.758","0.0007","16.0178","0.0014","16.1291","0.0014","90","","95.253","0.001","90","","2253.2","0.3","100","2","100","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C14 H16 N8 O3 S4 U -","- C14 H14 N8 O3 S4 U -","- C56 H56 N32 O12 S16 U4 -","4","1","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0497","0.0345","","","0.0594","0.0631","","","","","","1.061","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213825","13.3879","0.0015","8.6863","0.001","23.486","0.003","90","","98.305","0.001","90","","2702.6","0.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H24 N8 O3 S4 U -","- C18 H22 N8 O3 S4 U -","- C72 H88 N32 O12 S16 U4 -","4","0.5","","Surbella III, Robert G.; Cahill, Christopher L.","The exploration of supramolecular interactions stemming from the [UO2(NCS)4(H2O)]2− tecton and substituted pyridinium cations","CrystEngComm","2014","16","12","2352","","10.1039/c3ce42106f","","x-ray","0.71073","MoKα","","0.0156","0.0151","","","0.0345","0.0347","","","","","","1.215","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213826","8.4358","0.0018","10.074","0.002","15.079","0.003","71.071","0.005","87.931","0.006","67.631","0.006","1115.3","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H21 N3 O9 Zn1.5 -","- C22 H21 N3 O9 Zn1.5 -","- C44 H42 N6 O18 Zn3 -","2","1","","Niu, Yan-Fei; Zhao, Wen; Han, Jie; GeTian,; Zhao, Xiao-Li","Unprecedented metal-ion metathesis in a metal‒carboxylate chain-based metal‒organic framework","CrystEngComm","2014","16","12","2344","","10.1039/c3ce42214c","","","0.71073","MoKα","","0.0445","0.0411","","","0.1209","0.1268","","","","","","1.114","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213827","6.4411","0.0004","6.8211","0.0004","10.012","0.0006","94.14","0.003","93.01","0.003","117.31","0.003","388.01","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H5 N O5 Sr -","- C7 H5 N O5 Sr -","- C14 H10 N2 O10 Sr2 -","2","1","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.0186","0.0181","","","0.0488","0.0491","","","","","","1.169","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213828","7.4636","0.0015","10.502","0.002","11.744","0.002","98.5","0.03","94.57","0.03","92.14","0.03","906.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H14 Cu N2 O12 Sr -","- C14 H14 Cu N2 O12 Sr -","- C28 H28 Cu2 N4 O24 Sr2 -","2","1","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.029","0.022","","","0.0568","0.0594","","","","","","1.023","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213829","7.3083","0.0005","12.0765","0.0009","13.4566","0.0009","112.818","0.001","95.89","0.001","103.909","0.001","1036.85","0.13","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H38 Co2 N4 O29 Sr2 -","- C28 H38 Co2 N4 O29 Sr2 -","- C28 H38 Co2 N4 O29 Sr2 -","1","0.5","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.0376","0.0281","","","0.0619","0.0654","","","","","","1.009","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213830","18.324","0.003","13.794","0.003","8.7635","0.0017","90","","107.405","0.003","90","","2113.7","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 N2 Ni O15 Sr -","- C14 H20 N2 Ni O15 Sr -","- C56 H80 N8 Ni4 O60 Sr4 -","4","0.5","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.04","0.0336","","","0.0936","0.0967","","","","","","1.048","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213831","7.323","0.004","22.223","0.011","16.991","0.009","90","","90","","90","","2765","3","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H28 N2 Ni O19 Sr -","- C14 H27 N2 Ni O19 Sr -","- C56 H108 N8 Ni4 O76 Sr4 -","4","0.5","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.0412","0.0342","","","0.1276","0.1323","","","","","","1.16","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213832","8.5324","0.0013","22.302","0.003","16.57","0.002","90","","93.783","0.003","90","","3146.2","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 N3 Ni O22 Sr2 -","- C21 H29 N3 Ni O22 Sr2 -","- C84 H116 N12 Ni4 O88 Sr8 -","4","1","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.0534","0.0334","","","0.0681","0.0745","","","","","","1.011","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213833","7.917","0.004","10.835","0.005","20.769","0.01","90","","92.825","0.01","90","","1779.4","1.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O13 Sr Zn -","- C14 H14 N2 O13 Sr Zn -","- C56 H56 N8 O52 Sr4 Zn4 -","4","1","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.0479","0.0378","","","0.1015","0.1107","","","","","","1.06","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213834","16.484","0.003","14.875","0.003","26.826","0.005","90","","90","","90","","6578","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H33 N3 O24 Sr2 Zn -","- C21 H31 N3 O24 Sr2 Zn -","- C168 H248 N24 O192 Sr16 Zn8 -","8","1","","Chen, Yanmei; She, Shixiong; Gao, Qian; Gao, Dandan; Wang, Derong; Li, Yahong; Liu, Wei; Li, Wu","Synthesis, structures and properties of the first series of SrII‒MII (M = Cu, Co, Ni and Zn) coordination polymers based on pyridine-2,5-dicarboxylic acid","CrystEngComm","2014","16","6","1091","","10.1039/c3ce41975d","","","0.71073","MoKα","","0.0354","0.0248","","","0.0551","0.0586","","","","","","1.027","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213835","9.86","0.002","13.113","0.003","11.65","0.002","90","","101.99","0.03","90","","1473.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 Cd N2 O6 -","- C12 H12 Cd N2 O6 -","- C48 H48 Cd4 N8 O24 -","4","1","","Gao, Song; Fan, Rui-Qing; Qiang, Liang-Sheng; Wang, Ping; Chen, Shuo; Wang, Xin-Ming; Yang, Yu-Lin","Effects of solvents and temperature on the luminescence properties of Cd-isonicotinic acid frameworks based on mono-, bi-, and trinuclear cluster units","CrystEngComm","2014","16","6","1113","","10.1039/c3ce42216j","","","0.71073","MoKα","","0.1051","0.1022","","","0.2763","0.2771","","","","","","1.078","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213836","10.39","0.002","12.295","0.003","12.497","0.003","79.31","0.03","68.2","0.03","69.58","0.03","1386.2","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H22 Cd2 N4 O10 S -","- C18 H22 Cd2 N4 O10 S -","- C36 H44 Cd4 N8 O20 S2 -","2","1","","Gao, Song; Fan, Rui-Qing; Qiang, Liang-Sheng; Wang, Ping; Chen, Shuo; Wang, Xin-Ming; Yang, Yu-Lin","Effects of solvents and temperature on the luminescence properties of Cd-isonicotinic acid frameworks based on mono-, bi-, and trinuclear cluster units","CrystEngComm","2014","16","6","1113","","10.1039/c3ce42216j","","","0.71073","MoKα","","0.0832","0.0555","","","0.1563","0.1735","","","","","","1.057","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213837","12.048","0.002","12.28","0.003","19.092","0.004","91.92","0.03","98.1","0.03","117.88","0.03","2455.9","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H23 Cd3 N5.5 O11.5 -","- C33 H21 Cd3 N5.5 O11.5 -","- C66 H42 Cd6 N11 O23 -","2","1","","Gao, Song; Fan, Rui-Qing; Qiang, Liang-Sheng; Wang, Ping; Chen, Shuo; Wang, Xin-Ming; Yang, Yu-Lin","Effects of solvents and temperature on the luminescence properties of Cd-isonicotinic acid frameworks based on mono-, bi-, and trinuclear cluster units","CrystEngComm","2014","16","6","1113","","10.1039/c3ce42216j","","","0.71073","MoKα","","0.045","0.0405","","","0.1332","0.1378","","","","","","1.063","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213838","8.8851","0.0004","14.3096","0.0004","8.3842","0.0004","90","","93.12","0.005","90","","1064.41","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Cu N6 O10 -","- C22 H16 Cu N6 O10 -","- C44 H32 Cu2 N12 O20 -","2","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0545","0.0355","","","0.0689","0.0752","","","","","","1.006","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213839","8.4928","0.0005","9.6404","0.0006","12.5967","0.0008","68.102","0.006","71.434","0.006","64.579","0.006","848.72","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H34 Cu N8 O12 -","- C30 H34 Cu N8 O12 -","- C30 H34 Cu N8 O12 -","1","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0582","0.0429","","","0.0894","0.099","","","","","","1.061","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213840","9.4293","0.0004","10.2259","0.0005","17.1533","0.0011","91.634","0.005","99.933","0.004","93.062","0.004","1625.66","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H28 Co2 N8 O12 -","- C28 H21 Co2 N8 O12 -","- C56 H42 Co4 N16 O24 -","2","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0932","0.0545","","","0.099","0.1145","","","","","","1.042","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213841","9.3382","0.001","9.6636","0.0009","10.2665","0.0011","98.072","0.008","95.881","0.009","101.077","0.009","892.16","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Co N4 O8 -","- C14 H18 Co N4 O8 -","- C28 H36 Co2 N8 O16 -","2","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0388","0.034","","","0.0845","0.089","","","","","","1.046","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213842","11.0788","0.0004","12.6965","0.001","12.7879","0.0006","65.776","0.006","86.62","0.003","83.387","0.004","1629.34","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H62 Co5 N16 O28 -","- C56 H62 Co5 N16 O28 -","- C56 H62 Co5 N16 O28 -","1","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0666","0.0473","","","0.1092","0.1202","","","","","","1.015","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213843","8.912","0.0005","10.0898","0.0006","10.3129","0.0004","67.551","0.004","67.6","0.005","77.935","0.005","790.2","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Cd N4 O6 -","- C14 H14 Cd N4 O6 -","- C28 H28 Cd2 N8 O12 -","2","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0321","0.0275","","","0.0622","0.0646","","","","","","1.038","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213844","8.8056","0.0007","17.5516","0.0011","13.9196","0.0011","90","","126.483","0.005","90","","1729.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 Cd N4 O6 -","- C15 H16 Cd N4 O6 -","- C60 H64 Cd4 N16 O24 -","4","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0666","0.0442","","","0.0959","0.107","","","","","","1.07","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213845","7.8508","0.0005","17.7308","0.001","10.7154","0.0007","90","","93.285","0.006","90","","1489.14","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 Cd2 N6 O17 -","- C22 H28 Cd2 N6 O17 -","- C44 H56 Cd4 N12 O34 -","2","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0347","0.0275","","","0.0574","0.0625","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213846","7.8034","0.0004","17.5927","0.0009","10.5797","0.0005","90","","93.25","0.005","90","","1450.08","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 Mn2 N6 O17 -","- C22 H28 Mn2 N6 O17 -","- C44 H56 Mn4 N12 O34 -","2","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0383","0.0333","","","0.0851","0.0886","","","","","","1.06","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213847","9.7401","0.0003","15.6078","0.0003","16.5583","0.0004","90","","123.019","0.002","90","","2110.66","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 Mn N5 O7 -","- C17 H13 Mn N5 O7 -","- C68 H52 Mn4 N20 O28 -","4","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of coordination polymers constructed by the semi-rigid bifunctional ligand 5-((1H-1,2,4-triazol-1-yl)methoxy) isophthalic acid: syntheses, structures and the role of solvents","CrystEngComm","2014","16","6","1136","","10.1039/c3ce42048e","","","0.71073","MoKα","","0.0511","0.0412","","","0.1074","0.1141","","","","","","1.043","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7213848","11.435","0.0007","5.204","0.0002","16.4787","0.001","90","","124.283","0.004","90","","810.24","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H7 N O4 P Zn -","- C5 H7 N O4 P Zn -","- C20 H28 N4 O16 P4 Zn4 -","4","1","","Tian, Jumei; Li, Bo; Zhang, Xiaoying; Zhang, Jingping","Transition metal phosphite complexes: from one-dimensional chain, two-dimensional sheet, to three-dimensional architecture with unusual magnetic properties","CrystEngComm","2014","16","6","1071","","10.1039/c3ce41741g","","","0.71073","MoKα","","0.0539","0.0456","","","0.1128","0.1224","","","","","","1.081","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213849","16.696","","14.997","","7.4","","90","","104.42","","90","","1794.51","","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C10 H15 N2 Ni O10 P -","- C10 H15 N2 Ni O10 P -","- C40 H60 N8 Ni4 O40 P4 -","4","1","","Tian, Jumei; Li, Bo; Zhang, Xiaoying; Zhang, Jingping","Transition metal phosphite complexes: from one-dimensional chain, two-dimensional sheet, to three-dimensional architecture with unusual magnetic properties","CrystEngComm","2014","16","6","1071","","10.1039/c3ce41741g","","","0.71073","MoKα","","0.0597","0.0553","","","0.1455","0.1487","","","","","","1.034","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213850","17.189","0.005","14.748","0.005","7.469","0.005","90","","100.047","0.005","90","","1864.4","1.5","195","2","195","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C20 H30 Co2 N4 O21 P2 -","- C20 H30 Co2 N4 O21 P2 -","- C40 H60 Co4 N8 O42 P4 -","2","0.5","","Tian, Jumei; Li, Bo; Zhang, Xiaoying; Zhang, Jingping","Transition metal phosphite complexes: from one-dimensional chain, two-dimensional sheet, to three-dimensional architecture with unusual magnetic properties","CrystEngComm","2014","16","6","1071","","10.1039/c3ce41741g","","","0.71069","MoKα","","0.0598","0.0541","","","0.1285","0.1321","","","","","","1.053","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213851","11.032","0.0005","11.032","0.0005","22.838","0.0013","90","","90","","120","","2407.1","0.2","293","2","293","2","","","","","","","","6","P 6/m c c","-P 6 2c","192","","","","- C30 H42 Co3 N6 O15 P2 -","- C30 H36 Co3 N6 O14.996 P2 -","- C60 H72 Co6 N12 O29.992 P4 -","2","0.0833333","","Tian, Jumei; Li, Bo; Zhang, Xiaoying; Zhang, Jingping","Transition metal phosphite complexes: from one-dimensional chain, two-dimensional sheet, to three-dimensional architecture with unusual magnetic properties","CrystEngComm","2014","16","6","1071","","10.1039/c3ce41741g","","","0.71073","MoKα","","0.0808","0.0661","","","0.1503","0.1584","","","","","","1.015","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213852","7.9316","0.0004","11.5548","0.0003","20.3743","0.001","87.909","0.003","80.351","0.004","75.405","0.003","1781.41","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H37 N6 O11 Zn2 -","- C34 H29 N6 O11 Zn2 -","- C68 H58 N12 O22 Zn4 -","2","1","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","0.71073","MoKα","","0.0656","0.0379","","","0.0772","0.0824","","","","","","0.883","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213853","10.088","0.0004","10.185","0.0004","15.041","0.0007","109.498","0.004","92.338","0.004","115.87","0.09","1278.7","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H30 N6 O6 Zn -","- C22 H30 N6 O6 Zn -","- C44 H60 N12 O12 Zn2 -","2","1","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","0.71073","MoKα","","0.0563","0.04","","","0.1082","0.1125","","","","","","0.939","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213854","10.142","0.002","11.524","0.002","11.819","0.002","85.816","0.015","88.121","0.017","77.469","0.017","1344.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H32 Cd0 N6 O8 Zn -","- C23 H32 N6 O8 Zn -","- C46 H64 N12 O16 Zn2 -","2","1","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","1.54184","CuKα","","0.1288","0.0731","","","0.1671","0.1969","","","","","","1.066","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213855","30.249","0.003","9.1097","0.0003","18.2763","0.0013","90","","122.814","0.011","90","","4232.6","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H50 N12 O8 Zn2 -","- C38 H30 N12 O8 Zn2 -","- C152 H120 N48 O32 Zn8 -","4","0.5","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","1.54184","CuKα","","0.1069","0.0722","","","0.1742","0.1908","","","","","","1.079","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213856","10.149","0.0007","10.423","0.0007","14.596","0.001","75.494","0.006","81.455","0.006","66.286","0.007","1366.58","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H34 Cd N6 O7 -","- C22 H18 Cd N6 O7 -","- C44 H36 Cd2 N12 O14 -","2","1","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","0.71073","MoKα","","0.0511","0.0367","","","0.095","0.098","","","","","","0.949","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213857","10.1865","0.001","13.716","0.002","15.936","0.002","111.617","0.013","93.704","0.009","95.474","0.01","2048.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H90 Cd4 N18 O17 -","- C74 H88 Cd4 N18 O17 -","- C74 H88 Cd4 N18 O17 -","1","0.5","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","0.71073","MoKα","","0.1002","0.0393","","","0.0657","0.0735","","","","","","0.781","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213858","17.429","0.003","5.81","0.001","25.244","0.005","90","","130.351","0.012","90","","1948.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 Cl2 N6 Zn -","- C14 H24 Cl2 N6 Zn -","- C56 H96 Cl8 N24 Zn4 -","4","1","","Wu, Hua; Lü, Xiao-Li; Yang, Chun-Long; Dong, Chang-Xun; Wu, Mei-Sheng","Diverse topologies of seven d10 coordination polymers constructed from a long ligand and different carboxylates","CrystEngComm","2014","16","6","992","","10.1039/c3ce41974f","","","0.71073","MoKα","","0.1255","0.0317","","","0.0334","0.0373","","","","","","0.635","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213859","15.0205","0.0016","8.6335","0.001","10.1078","0.0011","90","","95.43","0.002","90","","1304.9","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 Fe N2 O16 P4 -","- C20 H28 Fe N2 O16 P4 -","- C40 H56 Fe2 N4 O32 P8 -","2","0.5","","Zhou, Wei; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Dai, Lu-Lu; Sun, Tong; Li, Wen-Zhu; Ma, Ming-Xue; Luo, Hui","Syntheses, crystal structures, surface photovoltage, luminescence and molecular recognition properties of zinc(ii) and iron(ii) carboxyphosphonates with 2D and 3D supramolecular structures","CrystEngComm","2014","16","6","1174","","10.1039/c3ce41976b","","","0.71073","MoKα","","0.0483","0.0418","","","0.1267","0.1323","","","","","","1.004","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213860","15.2874","0.0018","8.1363","0.001","11.36","0.0014","90","","94.136","0.002","90","","1409.3","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 N O8 P2 Zn2 -","- C10 H11 N O8 P2 Zn2 -","- C40 H44 N4 O32 P8 Zn8 -","4","1","","Zhou, Wei; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Dai, Lu-Lu; Sun, Tong; Li, Wen-Zhu; Ma, Ming-Xue; Luo, Hui","Syntheses, crystal structures, surface photovoltage, luminescence and molecular recognition properties of zinc(ii) and iron(ii) carboxyphosphonates with 2D and 3D supramolecular structures","CrystEngComm","2014","16","6","1174","","10.1039/c3ce41976b","","","0.71073","MoKα","","0.0586","0.0344","","","0.0923","0.116","","","","","","1.002","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213861","15.5562","0.0015","9.6049","0.0009","10.2192","0.001","90","","99.109","0.002","90","","1507.7","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 Fe2 N O9 P2 -","- C10 H13 Fe2 N O9 P2 -","- C40 H52 Fe8 N4 O36 P8 -","4","1","","Zhou, Wei; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Dai, Lu-Lu; Sun, Tong; Li, Wen-Zhu; Ma, Ming-Xue; Luo, Hui","Syntheses, crystal structures, surface photovoltage, luminescence and molecular recognition properties of zinc(ii) and iron(ii) carboxyphosphonates with 2D and 3D supramolecular structures","CrystEngComm","2014","16","6","1174","","10.1039/c3ce41976b","","","0.71073","MoKα","","0.0584","0.0423","","","0.0972","0.1042","","","","","","1.015","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213862","18.5137","0.0012","19.2404","0.0012","8.0478","0.0005","90","","90","","90","","2866.7","0.3","296","2","296","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C10 H13 N O8 P2 Zn -","- C10 H13 N O8 P2 Zn -","- C80 H104 N8 O64 P16 Zn8 -","8","1","","Zhou, Wei; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Dai, Lu-Lu; Sun, Tong; Li, Wen-Zhu; Ma, Ming-Xue; Luo, Hui","Syntheses, crystal structures, surface photovoltage, luminescence and molecular recognition properties of zinc(ii) and iron(ii) carboxyphosphonates with 2D and 3D supramolecular structures","CrystEngComm","2014","16","6","1174","","10.1039/c3ce41976b","","","0.71073","MoKα","","0.061","0.0392","","","0.0635","0.0679","","","","","","1","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213863","15.209","0.003","14.377","0.003","12.81","0.003","90","","91.73","0.03","90","","2799.8","1","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C6 H66 Co5 N4 O57 V11 -","- C6 H20 Co5 N4 O57 V11 -","- C12 H40 Co10 N8 O114 V22 -","2","0.25","","Liang, Yue; Zhang, Zhi-Ming; Liu, Zhu-Jun; Zhang, Ying; Zhang, Jun; Wang, En-Bo","A cobalt-containing pseudosandwich-type polyoxometalate based on a lacunary Lindqvist polyoxovanadate","CrystEngComm","2014","16","6","1187","","10.1039/c3ce41278d","","","0.71073","MoKα","","0.0791","0.0717","","","0.1686","0.1727","","","","","","0.967","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213864","26.75","0.009","14.879","0.004","18.279","0.006","90","","107.645","0.005","90","","6933","4","113","2","113","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H33 Cl2 Cu N2 O6 -","- C34 H33 Cl2 Cu N2 O5.5 -","- C272 H264 Cl16 Cu8 N16 O44 -","8","1","","Guo, Fang; Shao, Hui-de; Yang, Qi; Famulari, Antonino; Martí-Rujas, Javier","Mechanochemical dehydrochlorination and chelation reaction in the solid state: from a molecular salt to a coordination complex","CrystEngComm","2014","16","6","969","","10.1039/c3ce41900b","","","0.71073","MoKα","","0.0732","0.0634","","","0.1451","0.1512","","","","","","1.15","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213865","15.971","0.004","16.246","0.003","16.318","0.004","90","","103.582","0.014","90","","4115.5","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 Cd Cl2 N2 O5 -","- C18 H14 Cd Cl2 N2 O5 -","- C144 H112 Cd8 Cl16 N16 O40 -","8","1","","Ren, Cai-Xia; Zheng, Ai-Li; Cai, Li-Xuan; Chen, Cheng; Tan, Bin; Zhang, Jie","Anion-induced structural transformation involving interpenetration control and luminescence switching","CrystEngComm","2014","16","6","1038","","10.1039/c3ce42164c","","","0.71073","MoKα","","0.0508","0.0429","","","0.1181","0.1272","","","","","","1.009","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213866","9.1906","0.0007","11.3629","0.0006","13.6819","0.0011","113.6","0.006","105.419","0.007","91.254","0.006","1248.81","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H24 Cd N2 O9 -","- C26 H18 Cd N2 O9 -","- C52 H36 Cd2 N4 O18 -","2","1","","Ren, Cai-Xia; Zheng, Ai-Li; Cai, Li-Xuan; Chen, Cheng; Tan, Bin; Zhang, Jie","Anion-induced structural transformation involving interpenetration control and luminescence switching","CrystEngComm","2014","16","6","1038","","10.1039/c3ce42164c","","","1.54178","CuKα","","0.068","0.0604","","","0.1562","0.1629","","","","","","1.039","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213867","18.433","0.003","17.712","0.003","30.096","0.005","90","","90","","90","","9826","3","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C88 H100 Cd3 Cl2 N8 O34 -","- C88 H64 Cd3 Cl2 N8 O34 -","- C352 H256 Cd12 Cl8 N32 O136 -","4","0.5","","Ren, Cai-Xia; Zheng, Ai-Li; Cai, Li-Xuan; Chen, Cheng; Tan, Bin; Zhang, Jie","Anion-induced structural transformation involving interpenetration control and luminescence switching","CrystEngComm","2014","16","6","1038","","10.1039/c3ce42164c","","","0.71073","MoKα","","0.0752","0.0648","","","0.2061","0.2198","","","","","","1.086","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213868","18.3083","0.0018","6.8191","0.0005","22.558","0.002","90","","101.519","0.001","90","","2759.6","0.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 N10 -","- C32 H24 N10 -","- C128 H96 N40 -","4","1","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.0742","0.0444","","","0.0952","0.1061","","","","","","1.031","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213869","19.6653","0.0018","11.3358","0.0011","14.1097","0.0012","90","","90","","90","","3145.4","0.5","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C32 H24 Cl2 N10 Zn -","- C32 H24 Cl2 N10 Zn -","- C128 H96 Cl8 N40 Zn4 -","4","1","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.1508","0.0639","","","0.1382","0.1952","","","","","","1.051","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213870","10.2118","0.0009","18.3727","0.0017","18.2062","0.0016","90","","96.234","0.001","90","","3395.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 Br2 N10 Zn -","- C32 H24 Br2 N10 Zn -","- C128 H96 Br8 N40 Zn4 -","4","1","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.1663","0.0865","","","0.2127","0.2488","","","","","","0.881","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213871","10.5859","0.0007","16.938","0.0014","19.398","0.002","90","","96.545","0.001","90","","3455.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 I2 N10 Zn -","- C32 H24 I2 N10 Zn -","- C128 H96 I8 N40 Zn4 -","4","1","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.133","0.0818","","","0.2048","0.2499","","","","","","1.023","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213872","7.821","0.0005","44.97","0.003","11.0991","0.0009","90","","134.49","0.002","90","","2784.8","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H48 Cd Cl2 N20 -","- C64 H48 Cd Cl2 N20 -","- C128 H96 Cd2 Cl4 N40 -","2","0.5","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.1047","0.0782","","","0.1815","0.1932","","","","","","1.178","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213873","7.9001","0.0007","44.62","0.003","8.0308","0.0004","90","","91.642","0.002","90","","2829.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H48 Br2 Cd N20 -","- C64 H48 Br2 Cd N20 -","- C128 H96 Br4 Cd2 N40 -","2","0.5","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.0983","0.0541","","","0.0995","0.1215","","","","","","1.059","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213874","10.8437","0.0011","16.6662","0.0016","19.6797","0.0018","90","","96.639","0.001","90","","3532.7","0.6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 Cd I2 N10 -","- C32 H24 Cd I2 N10 -","- C128 H96 Cd4 I8 N40 -","4","1","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.0815","0.0513","","","0.1309","0.1444","","","","","","1.091","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213875","36.645","0.003","8.739","0.0006","25.427","0.002","90","","104.304","0.001","90","","7890.3","1","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C75 H70 Cl2 Co2 N25 O12 S2 -","- C75.006 H70.012 Cl2 Co2 N25 O12 S2 -","- C300.024 H280.048 Cl8 Co8 N100 O48 S8 -","4","0.5","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.1042","0.062","","","0.1585","0.1753","","","","","","1.067","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213876","34.166","0.003","8.528","0.0009","24.721","0.002","90","","99.831","0.002","90","","7097.1","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C64 H48 Cl3 Cu2 N23 O12 -","- C64 H48 Cl3 Cu2 N23 O12 -","- C256 H192 Cl12 Cu8 N92 O48 -","4","0.5","","Ding, Caixia; Rui, Xing; Wang, Cheng; Xie, Yongshu","Coordination polymers of a multipyridyl and pyrazolyl ligand with conformational flexibility: syntheses, structures and luminescence","CrystEngComm","2014","16","6","1010","","10.1039/c3ce42147c","","","0.71073","MoKα","","0.0726","0.0582","","","0.1777","0.1882","","","","","","1.072","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213877","25.574","0.002","8.7383","0.0008","18.346","0.002","90","","116.964","0.001","90","","3654.2","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H22 Cl2 N2 O Ru -","- C17 H22 Cl2 N2 O Ru -","- C136 H176 Cl16 N16 O8 Ru8 -","8","1","","Bacchi, A.; Cantoni, G.; Crocco, D.; Granelli, M.; Pagano, P.; Pelagatti, P.","Hydrogen-bond networks in polymorphs and solvates of metallorganic complexes containing ruthenium and aminoamide ligands","CrystEngComm","2014","16","6","1001","","10.1039/c3ce41920g","","","0.71073","MoKα","","0.0806","0.0448","","","0.0929","0.1171","","","","","","1.205","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213878","8.723","0.009","9.227","0.009","12.62","0.01","74.26","0.01","69.8","0.01","89.74","0.01","913","1.5","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C17 H22 Cl2 N2 O Ru -","- C17 H22 Cl2 N2 O Ru -","- C34 H44 Cl4 N4 O2 Ru2 -","2","2","","Bacchi, A.; Cantoni, G.; Crocco, D.; Granelli, M.; Pagano, P.; Pelagatti, P.","Hydrogen-bond networks in polymorphs and solvates of metallorganic complexes containing ruthenium and aminoamide ligands","CrystEngComm","2014","16","6","1001","","10.1039/c3ce41920g","","","0.71073","MoKα","","0.1761","0.1265","","","0.3327","0.3864","","","","","","1.5","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213879","7.766","0.001","9.144","0.001","15.613","0.002","83.304","0.003","82.977","0.003","69.036","0.003","1024.4","0.2","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H26 Cl2 N2 O2 Ru -","- C18 H26 Cl2 N2 O2 Ru -","- C36 H52 Cl4 N4 O4 Ru2 -","2","1","","Bacchi, A.; Cantoni, G.; Crocco, D.; Granelli, M.; Pagano, P.; Pelagatti, P.","Hydrogen-bond networks in polymorphs and solvates of metallorganic complexes containing ruthenium and aminoamide ligands","CrystEngComm","2014","16","6","1001","","10.1039/c3ce41920g","","","0.71073","MoKα","","0.0556","0.048","","","0.1241","0.1279","","","","","","1.01","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213880","7.6649","0.0009","9.0707","0.0011","19.817","0.002","87.882","0.002","89.682","0.002","70.084","0.002","1294.5","0.3","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H32 Cl2 N2 O2 Ru -","- C25 H32 Cl2 N2 O2 Ru -","- C50 H64 Cl4 N4 O4 Ru2 -","2","1","","Bacchi, A.; Cantoni, G.; Crocco, D.; Granelli, M.; Pagano, P.; Pelagatti, P.","Hydrogen-bond networks in polymorphs and solvates of metallorganic complexes containing ruthenium and aminoamide ligands","CrystEngComm","2014","16","6","1001","","10.1039/c3ce41920g","","","0.71073","MoKα","","0.0349","0.0276","","","0.0665","0.0698","","","","","","0.91","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213881","9.516","0.005","9.814","0.005","14.001","0.005","74.216","0.005","82.094","0.005","67.846","0.005","1164.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H28 Cl2 N2 O2 Ru -","- C23 H28 Cl2 N2 O2 Ru -","- C46 H56 Cl4 N4 O4 Ru2 -","2","1","","Bacchi, A.; Cantoni, G.; Crocco, D.; Granelli, M.; Pagano, P.; Pelagatti, P.","Hydrogen-bond networks in polymorphs and solvates of metallorganic complexes containing ruthenium and aminoamide ligands","CrystEngComm","2014","16","6","1001","","10.1039/c3ce41920g","","","0.71073","MoKα","","0.0295","0.0267","","","0.0671","0.0684","","","","","","1.068","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213882","9.3925","0.0012","10.0156","0.0016","12.669","0.0016","84.282","0.002","80.105","0.002","71.028","0.002","1109.1","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H14 Co N4 O6 S2 -","- C23 H14 Co N4 O6 S2 -","- C46 H28 Co2 N8 O12 S4 -","2","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0318","0.0284","","","0.0985","0.1007","","","","","","1.06","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213883","10.2077","0.0006","10.5027","0.0006","14.5086","0.0009","94.454","0.001","98.649","0.001","91.289","0.001","1532.19","0.16","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H18 Co F6 N4 O4 S2 -","- C31 H18 Co F6 N4 O4 S2 -","- C62 H36 Co2 F12 N8 O8 S4 -","2","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0699","0.0531","","","0.1497","0.1569","","","","","","1.05","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213884","17.8224","0.0012","27.27","0.0019","18.3256","0.0012","90","","110.532","0.001","90","","8340.8","1","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C88 H56 N16 O16 S8 Zn4 -","- C88 H56 N16 O16 S8 Zn4 -","- C352 H224 N64 O64 S32 Zn16 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0646","0.0468","","","0.1054","0.1068","","","","","","1","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213885","21.33","0.003","8.1009","0.0013","30.993","0.003","90","","122.46","0.007","90","","4518.7","1.1","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C41 H21 F12 N2 O8 S Zn2 -","- C41 H21 F12 N2 O8 S Zn2 -","- C164 H84 F48 N8 O32 S4 Zn8 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0704","0.0424","","","0.1014","0.1091","","","","","","1.002","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213886","9.5686","0.0008","10.3542","0.0008","11.0911","0.0009","80.148","0.001","83.52","0.001","72.515","0.001","1030.42","0.14","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H14 Cd N4 O4 S2 -","- C22 H14 Cd N4 O4 S2 -","- C44 H28 Cd2 N8 O8 S4 -","2","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0301","0.0276","","","0.0704","0.0716","","","","","","1.013","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213887","9.4003","0.0006","9.8766","0.0007","12.0339","0.0008","82.475","0.001","80.707","0.001","72.367","0.001","1046.79","0.12","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H14 N4 O5 S2 Zn -","- C22 H14 N4 O5 S2 Zn -","- C44 H28 N8 O10 S4 Zn2 -","2","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0286","0.0256","","","0.0817","0.0836","","","","","","1.028","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213888","10.4879","0.001","20.6148","0.0019","15.51","0.0011","90","","121.819","0.005","90","","2849.4","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 N4 O4 S2 Zn -","- C24 H24 N4 O4 S2 Zn -","- C96 H96 N16 O16 S8 Zn4 -","4","1","","Shi, Zhi-Qiang; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Syntheses, structures, and photoluminescent properties of a series of metal‒organic frameworks constructed by 5,5′-bis(1H-imidazol-1-yl)-2,2′-bithiophene and various carboxylate ligands","CrystEngComm","2014","16","5","900","","10.1039/c3ce41966e","","","0.71073","MoKα","","0.0672","0.0512","","","0.1348","0.1367","","","","","","1.092","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213889","11.4985","0.0003","21.276","0.0006","21.4387","0.0006","77.071","0.002","80.672","0.002","88.411","0.002","5044","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H53 Co2 N7 O19 -","- C61 H53 Co2 N7 O19 -","- C122 H106 Co4 N14 O38 -","2","1","","Li, Huimin; Zhou, Jingmin; Shi, Wei; Zhang, Xuejing; Zhang, Zhenjie; Zhang, Meng; Cheng, Peng","Structural diversity of four new metal‒organic frameworks with a curved tetracarboxdiimide dicarboxylic acid","CrystEngComm","2014","16","5","834","","10.1039/c3ce41805g","","","0.7107","MoKα","","0.0756","0.0565","","","0.1683","0.1788","","","","","","0.922","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213890","11.744","0.002","19.878","0.004","36.094","0.007","90","","90","","90","","8426","3","293","2","293","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C26 H16 Cu N2 O9 -","- C26 H16 Cu N2 O9 -","- C208 H128 Cu8 N16 O72 -","8","0.5","","Li, Huimin; Zhou, Jingmin; Shi, Wei; Zhang, Xuejing; Zhang, Zhenjie; Zhang, Meng; Cheng, Peng","Structural diversity of four new metal‒organic frameworks with a curved tetracarboxdiimide dicarboxylic acid","CrystEngComm","2014","16","5","834","","10.1039/c3ce41805g","","","0.71073","MoKα","","0.1248","0.0793","","","0.2195","0.2488","","","","","","1.044","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213891","11.7133","0.0003","18.7995","0.0005","24.1755","0.0006","90","","90","","90","","5323.5","0.2","293","2","293","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C20 H16 N3 O8 Zn -","- C20 H16 N3 O8 Zn -","- C160 H128 N24 O64 Zn8 -","8","1","","Li, Huimin; Zhou, Jingmin; Shi, Wei; Zhang, Xuejing; Zhang, Zhenjie; Zhang, Meng; Cheng, Peng","Structural diversity of four new metal‒organic frameworks with a curved tetracarboxdiimide dicarboxylic acid","CrystEngComm","2014","16","5","834","","10.1039/c3ce41805g","","","0.71073","MoKα","","0.0812","0.0629","","","0.1713","0.1834","","","","","","1.053","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213892","15.1796","0.0007","15.6453","0.0005","16.984","0.0015","90","","119.218","0.005","90","","3520.3","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C55 H41 Cd2 N5 O20 -","- C55 H41 Cd2 N5 O20 -","- C110 H82 Cd4 N10 O40 -","2","0.5","","Li, Huimin; Zhou, Jingmin; Shi, Wei; Zhang, Xuejing; Zhang, Zhenjie; Zhang, Meng; Cheng, Peng","Structural diversity of four new metal‒organic frameworks with a curved tetracarboxdiimide dicarboxylic acid","CrystEngComm","2014","16","5","834","","10.1039/c3ce41805g","","","0.71073","MOKα","","0.1062","0.0867","","","0.2439","0.2622","","","","","","1.069","","","","has coordinates,has disorder","180469","2020-10-21","18:00:00",""
"7213893","5.5791","0.0016","7.683","0.003","16.223","0.004","89.07","0.02","83.89","0.02","84.51","0.03","688.3","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H12 Br N O -","- C17 H12 Br N O -","- C34 H24 Br2 N2 O2 -","2","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.1319","0.0754","","","0.1368","0.1571","","","","","","1.179","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213894","5.5931","0.0012","7.6167","0.0019","15.88","0.004","88.41","0.02","83.971","0.018","84.915","0.019","670","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H12 Cl N O -","- C17 H12 Cl N O -","- C34 H24 Cl2 N2 O2 -","2","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.1012","0.0954","","","0.1231","0.1542","","","","","","1.166","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213895","5.6099","0.0014","7.6163","0.0019","14.943","0.003","88.73","0.019","84.005","0.019","85.28","0.02","632.8","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H12 F N O -","- C17 H12 F N O -","- C34 H24 F2 N2 O2 -","2","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.107","0.0631","","","0.1718","0.2027","","","","","","1.076","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213896","32.1685","0.0016","10.7211","0.0004","8.2676","0.0005","90","","95.678","0.004","90","","2837.4","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H12 I N O -","- C17 H12 I N O -","- C136 H96 I8 N8 O8 -","8","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.0793","0.0536","","","0.1177","0.1292","","","","","","1.11","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213897","6.364","0.003","17.187","0.009","12.649","0.007","90","","102.71","0.04","90","","1349.6","1.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 Br N2 O -","- C16 H11 Br N2 O -","- C64 H44 Br4 N8 O4 -","4","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.0951","0.0843","","","0.1432","0.1639","","","","","","1.15","","","","has coordinates","180469","2020-10-21","18:00:00",""
"7213898","14.176","0.003","6.0252","0.0011","15.551","0.004","90","","98.311","0.019","90","","1314.3","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 Cl N2 O -","- C16 H11 Cl N2 O -","- C64 H44 Cl4 N8 O4 -","4","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.102","0.0826","","","0.1223","0.1423","","","","","","1.16","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213899","4.9506","0.0003","14.5932","0.0014","17.6779","0.0013","90","","90","","90","","1277.14","0.17","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.1199","0.0731","","","0.1387","0.1559","","","","","","1.093","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213900","6.548","0.002","17.029","0.005","12.714","0.005","90","","102.06","0.03","90","","1386.4","0.8","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 I N2 O -","- C16 H11 I N2 O -","- C64 H44 I4 N8 O4 -","4","1","","Khavasi, Hamid Reza; Ghanbarpour, Alireza; Tehrani, Alireza Azhdari","Synthon crossover between halogen⋯π and halogen⋯halogen interaction","CrystEngComm","2014","16","5","749","","10.1039/c3ce41853g","","","0.71073","MoKα","","0.0516","0.0411","","","0.1154","0.1216","","","","","","1.157","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213901","18.3217","0.0018","11.4532","0.0013","21.918","0.002","90","","110.307","0.005","90","","4313.5","0.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H65 Cu2 N O12 -","- C33 H65 Cu2 N O12 -","- C132 H260 Cu8 N4 O48 -","4","1","","Nesterova, Oksana V.; Kirillova, Marina V.; Guedes da Silva, M. Fátima C.; Boča, Roman; Pombeiro, Armando J. L.","How to force a classical chelating ligand to a metal non-chelating bridge: the observation of a rare coordination mode of diethanolamine in the 1D complex {[Cu2(Piv)4(H3tBuDea)](Piv)}n","CrystEngComm","2014","16","5","775","","10.1039/c3ce41657g","","","0.71069","MoKα","","0.0779","0.0489","","","0.1194","0.1347","","","","","","1.01","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213902","28.41","0.008","8.844","0.003","7.497","0.002","90","","90","","90","","1883.7","1","173","2","173","2","","","","","","","","5","I m a 2","I 2 -2a","46","","","","- C19 H19 Mn N O7 -","- C19 H12 Mn N O7 -","- C76 H48 Mn4 N4 O28 -","4","0.5","","Luo, Rui; Xu, Heng; Gu, Hao-Xue; Wang, Xin; Xu, Yan; Shen, Xuan; Bao, Weiwei; Zhu, Dun-Ru","Four MOFs with 2,2′-dimethoxy-4,4′-biphenyldicarboxylic acid: syntheses, structures, topologies and properties","CrystEngComm","2014","16","5","784","","10.1039/c3ce41428k","","","0.71073","MoKα","","0.0469","0.0417","","","0.1091","0.1231","","","","","","1.164","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213903","7.631","0.002","9.033","0.003","14.87","0.004","106.822","0.003","96.077","0.003","91.721","0.003","973.6","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H23 N Ni O9 -","- C19 H23 N Ni O9 -","- C38 H46 N2 Ni2 O18 -","2","1","","Luo, Rui; Xu, Heng; Gu, Hao-Xue; Wang, Xin; Xu, Yan; Shen, Xuan; Bao, Weiwei; Zhu, Dun-Ru","Four MOFs with 2,2′-dimethoxy-4,4′-biphenyldicarboxylic acid: syntheses, structures, topologies and properties","CrystEngComm","2014","16","5","784","","10.1039/c3ce41428k","","","0.71073","MoKα","","0.0427","0.0328","","","0.0766","0.0809","","","","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213904","27.086","0.003","27.086","0.003","6.7052","0.0009","90","","90","","90","","4919.3","1","296","2","296","2","","","","","","","","4","P 4/n b m :2","-P 4a 2b","125","","","","- C16 H12 Cu O7 -","- C16 H12 Cu O7 -","- C128 H96 Cu8 O56 -","8","0.5","","Luo, Rui; Xu, Heng; Gu, Hao-Xue; Wang, Xin; Xu, Yan; Shen, Xuan; Bao, Weiwei; Zhu, Dun-Ru","Four MOFs with 2,2′-dimethoxy-4,4′-biphenyldicarboxylic acid: syntheses, structures, topologies and properties","CrystEngComm","2014","16","5","784","","10.1039/c3ce41428k","","","0.71073","MoKα","","0.0577","0.0544","","","0.182","0.1844","","","","","","1.156","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213905","21.769","0.002","21.769","0.002","44.426","0.009","90","","90","","90","","21053","5","296","2","296","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","","- C168 H148 Cd7 N4 Na2 O60 -","- C168 H145 Cd7 N4 Na2 O60 -","- C672 H580 Cd28 N16 Na8 O240 -","4","0.25","","Luo, Rui; Xu, Heng; Gu, Hao-Xue; Wang, Xin; Xu, Yan; Shen, Xuan; Bao, Weiwei; Zhu, Dun-Ru","Four MOFs with 2,2′-dimethoxy-4,4′-biphenyldicarboxylic acid: syntheses, structures, topologies and properties","CrystEngComm","2014","16","5","784","","10.1039/c3ce41428k","","","0.71073","MoKα","","0.0635","0.0565","","","0.1642","0.1703","","","","","","1.096","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7213906","16.842","0.0002","16.842","0.0002","7.249","0.0002","90","","90","","90","","2056.2","0.07","296","2","296","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C2 H15 N6 O5 P -","- C2 H15 N6 O5 P -","- C16 H120 N48 O40 P8 -","8","1","","Liu, Xitao; Wang, Xinqiang; Yin, Xin; Liu, Shande; He, Wen; Zhu, Luyi; Zhang, Guanghui; Xu, Dong","Bulk growth and physical properties of diguanidinium phosphate monohydrate (G2HP) as a multi-functional crystal","CrystEngComm","2014","16","5","930","","10.1039/c3ce41896k","","","0.71073","MoKα","","0.0423","0.0313","","","0.069","0.0752","","","","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213907","18.867","0.004","17.119","0.003","28.504","0.005","90","","112.252","0.011","90","","8521","3","113","2","113","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C75 H56.5 Cl6 Co8 N31.5 O9 -","- C60 H36 Cl6 Co8 N24 O6 -","- C240 H144 Cl24 Co32 N96 O24 -","4","1","","Han, Song-De; Chen, Yong-Qiang; Zhao, Jiong-Peng; Liu, Sui-Jun; Miao, Xiao-Hong; Hu, Tong-Liang; Bu, Xian-He","Solvent-induced structural diversities from discrete cup-shaped Co8 clusters to Co8 cluster-based chains accompanied by in situ ligand conversion","CrystEngComm","2014","16","5","753","","10.1039/c3ce42007h","","","0.71075","MoKα","","0.1021","0.0831","","","0.1972","0.2079","","","","","","1.039","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213908","30.195","0.005","20.367","0.004","33.896","0.004","90","","123.24","0.01","90","","17435","5","113","","113","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C136 H134 Cl8 Co16 N48 O27 -","- C126 H87 Cl8 Co16 N48 O17 -","- C504 H348 Cl32 Co64 N192 O68 -","4","1","","Han, Song-De; Chen, Yong-Qiang; Zhao, Jiong-Peng; Liu, Sui-Jun; Miao, Xiao-Hong; Hu, Tong-Liang; Bu, Xian-He","Solvent-induced structural diversities from discrete cup-shaped Co8 clusters to Co8 cluster-based chains accompanied by in situ ligand conversion","CrystEngComm","2014","16","5","753","","10.1039/c3ce42007h","","","0.71075","MoKα","","0.0854","0.0689","","","0.189","0.2038","","","","","","1.017","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213909","34.484","0.01","20.624","0.006","23.922","0.007","90","","90","","90","","17013","9","113","","113","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C140 H171 Cl8 Co16 N48 O41.5 -","- C124 H81 Cl8 Co16 N48 O16 -","- C496 H324 Cl32 Co64 N192 O64 -","4","1","","Han, Song-De; Chen, Yong-Qiang; Zhao, Jiong-Peng; Liu, Sui-Jun; Miao, Xiao-Hong; Hu, Tong-Liang; Bu, Xian-He","Solvent-induced structural diversities from discrete cup-shaped Co8 clusters to Co8 cluster-based chains accompanied by in situ ligand conversion","CrystEngComm","2014","16","5","753","","10.1039/c3ce42007h","","","0.71075","MoKα","","0.0905","0.0758","","","0.184","0.1961","","","","","","1.012","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213910","18.0747","0.0017","11.8777","0.0011","12.5442","0.0012","90","","90","","90","","2693.1","0.4","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H24 Cu3 N4 O12 -","- C26 H24 Cu3 N4 O12 -","- C104 H96 Cu12 N16 O48 -","4","0.5","","Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands","CrystEngComm","2014","16","5","870","","10.1039/c3ce41641k","","","0.71073","MoKα","","0.034","0.0249","","","0.0625","0.0664","","","","","","1.029","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213911","9.703","0.002","9.703","0.002","13.09","0.003","80.909","0.002","77.613","0.002","62.896","0.002","1068.9","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H44 Cu2 N8 O11 -","- C46 H42 Cu2 N8 O11 -","- C46 H42 Cu2 N8 O11 -","1","0.5","","Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands","CrystEngComm","2014","16","5","870","","10.1039/c3ce41641k","","","0.71073","MoKα","","0.0538","0.038","","","0.094","0.1039","","","","","","1.003","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213912","10.809","0.01","10.847","0.01","12.549","0.011","93.404","0.011","90.14","0.011","118.89","0.01","1285","2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H28 Cu N4 O7 -","- C27 H28 Cu N4 O7 -","- C54 H56 Cu2 N8 O14 -","2","1","","Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands","CrystEngComm","2014","16","5","870","","10.1039/c3ce41641k","","","0.71073","MoKα","","0.0973","0.0533","","","0.1016","0.1205","","","","","","1.01","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213913","9.846","0.007","14.108","0.01","19.466","0.014","97.416","0.008","104.173","0.008","104.323","0.009","2488","3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H46 Mn3 N4 O26 -","- C44 H46 Mn3 N4 O26 -","- C88 H92 Mn6 N8 O52 -","2","1","","Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands","CrystEngComm","2014","16","5","870","","10.1039/c3ce41641k","","","0.71073","MoKα","","0.0854","0.044","","","0.0913","0.1098","","","","","","1.011","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213914","9.6214","0.001","10.068","0.0011","12.9326","0.0014","80.07","0.001","81.24","0.001","62.315","0.001","1089","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H20 Mn N4 O5 -","- C23 H20 Mn N4 O5 -","- C46 H40 Mn2 N8 O10 -","2","1","","Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands","CrystEngComm","2014","16","5","870","","10.1039/c3ce41641k","","","0.71073","MoKα","","0.0442","0.0353","","","0.0999","0.1071","","","","","","1.042","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213915","16.564","0.004","18.302","0.004","15.879","0.003","90","","90","","90","","4813.8","1.8","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C27 H24 Mn N4 O5 -","- C27 H24 Mn N4 O5 -","- C216 H192 Mn8 N32 O40 -","8","1","","Chang, Xin-Hong; Qin, Jian-Hua; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Exploring the structural diversities and magnetic properties of copper(ii) and manganese(ii) complexes based on 5-methoxyisophthalate and flexible bis(imidazole) ligands","CrystEngComm","2014","16","5","870","","10.1039/c3ce41641k","","","0.71073","MoKα","","0.1346","0.0543","","","0.1072","0.1421","","","","","","0.993","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213916","8.1401","0.0014","18.984","0.003","35.484","0.006","97.85","0.004","94.141","0.004","97.048","0.004","5368.9","1.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C168 H220 N60 Ni6 O26 -","- C168 H220 N60 Ni6 O26 -","- C168 H220 N60 Ni6 O26 -","1","0.5","","Jiang, Xiang; Li, Zijian; Zhai, Yanyun; Yan, Ge; Xia, Hua; Li, Zhaohao","Porous coordination polymers based on azamacrocyclic complex: syntheses, solvent-induced reversible crystal-to-crystal transformation and gas sorption properties","CrystEngComm","2014","16","5","805","","10.1039/c3ce42021c","","","0.71073","MoKα","","0.1636","0.0872","","","0.2149","0.2432","","","","","","1.006","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7213917","31.537","0.005","20.222","0.005","18.93","0.004","90","","120.102","0.004","90","","10444","4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C180 H244 N64 Ni6 O28 -","- C180 H244 N64 Ni6 O28 -","- C360 H488 N128 Ni12 O56 -","2","0.25","","Jiang, Xiang; Li, Zijian; Zhai, Yanyun; Yan, Ge; Xia, Hua; Li, Zhaohao","Porous coordination polymers based on azamacrocyclic complex: syntheses, solvent-induced reversible crystal-to-crystal transformation and gas sorption properties","CrystEngComm","2014","16","5","805","","10.1039/c3ce42021c","","","0.71073","MoKα","","0.1797","0.0755","","","0.1627","0.1834","","","","","","1.045","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213918","8.589","0.004","17.784","0.009","38.729","0.019","90","","102.629","0.011","90","","5773","5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C96 H114 N24 Ni3 O18 -","- C96 H114 N24 Ni3 O18 -","- C192 H228 N48 Ni6 O36 -","2","0.5","","Jiang, Xiang; Li, Zijian; Zhai, Yanyun; Yan, Ge; Xia, Hua; Li, Zhaohao","Porous coordination polymers based on azamacrocyclic complex: syntheses, solvent-induced reversible crystal-to-crystal transformation and gas sorption properties","CrystEngComm","2014","16","5","805","","10.1039/c3ce42021c","","","0.71073","MoKα","","0.151","0.0693","","","0.131","0.1492","","","","","","1.013","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213919","14.6204","0.001","7.6631","0.0004","16.002","0.002","90","","97.234","0.009","90","","1778.6","0.3","120","2","120","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C5 H10 N3 O4 P -","- C5 H10 N3 O4 P -","- C40 H80 N24 O32 P8 -","8","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0405","0.0332","","","0.0973","0.1008","","","","","","1.11","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213920","10.9507","0.0004","6.4615","0.0002","11.2614","0.0003","90","","102.988","0.002","90","","776.45","0.04","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4-aminopyridinium_hydrogenosulfate","","","- C5 H8 N2 O4 S -","- C5 H8 N2 O4 S -","- C20 H32 N8 O16 S4 -","4","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0409","0.033","","","0.0944","0.1","","","","","","1.065","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213921","9.1718","0.0006","6.9081","0.0004","10.8243","0.0007","90","","93.617","0.007","90","","684.46","0.07","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H7 N3 O3 -","- C5 H7 N3 O3 -","- C20 H28 N12 O12 -","4","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0579","0.0518","","","0.1411","0.1433","","","","","","1.042","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213922","7.2785","0.0004","7.9141","0.0004","8.9022","0.0006","77.651","0.006","71.756","0.005","67.405","0.005","447.06","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H11 N2 O5 P -","- C5 H11 N2 O5 P -","- C10 H22 N4 O10 P2 -","2","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0308","0.027","","","0.0726","0.0791","","","","","","1.147","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213923","6.4515","0.0002","8.4229","0.0002","12.4728","0.0008","96.429","0.007","97.523","0.007","95.349","0.007","663.7","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H16 N4 O5 S -","- C10 H16 N4 O5 S -","- C20 H32 N8 O10 S2 -","2","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0375","0.0326","","","0.1001","0.1134","","","","","","1.192","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213924","7.0735","0.0005","11.0546","0.0008","9.4018","0.0006","90","","92.308","0.007","90","","734.57","0.09","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H8 N4 O3 -","- C5 H8 N4 O3 -","- C20 H32 N16 O12 -","4","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0409","0.0338","","","0.0853","0.0884","","","","","","1.098","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213925","17.0057","0.0011","12.7153","0.0004","9.1321","0.0003","90","","90","","90","","1974.66","0.16","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C5 H11 N5 O7 -","- C5 H11 N5 O7 -","- C40 H88 N40 O56 -","8","1","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0301","0.0283","","","0.0747","0.0757","","","","","","1.081","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213926","15.2902","0.001","15.2902","0.001","13.2563","0.0007","90","","90","","90","","3099.2","0.3","120","2","120","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bis(3,4-diaminopyridinium)_sulfate_dihydrate","","","- C10 H20 N6 O6 S -","- C10 H20 N6 O6 S -","- C80 H160 N48 O48 S8 -","8","0.5","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.1177","0.0622","","","0.154","0.1768","","","","","","1.024","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213927","6.9429","0.0003","10.2338","0.0005","14.5568","0.0008","103.319","0.002","100.97","0.003","92.592","0.003","983.78","0.09","120","2","120","2","","","","","","","","5","P -1","-P 1","2","3,4-diaminopyridinium_sulfate_dihydrate","","","- C5 H13 N3 O6 S -","- C5 H13 N3 O6 S -","- C20 H52 N12 O24 S4 -","4","2","","Hursthouse, Michael B.; Montis, Riccardo; Niitsoo, Liisa; Sarson, Jonathan; Threlfall, Terence L.; Asiri, Abdullah Mohamed; Khan, Salman Ahmad; Obaid, Abdullah Yousef; Al-Harbi, Laila Mohammad","Anhydrates and/or hydrates in nitrate, sulphate and phosphate salts of 4-aminopyridine, (4-AP) and 3,4-diaminopyridine (3,4-DAP): the role of the water molecules in the hydrates","CrystEngComm","2014","16","11","2205","","10.1039/c3ce42471e","","","0.71073","MoKα","","0.0981","0.0545","","","0.1187","0.1381","","","","","","1.054","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213928","9.8733","0.0003","13.7275","0.0005","16.1107","0.0005","102.603","0.001","105.275","0.001","106.803","0.002","1911.32","0.11","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 Co2 N8 O10 -","- C36 H40 Co2 N8 O10 -","- C72 H80 Co4 N16 O20 -","2","1","","Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti","Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers","CrystEngComm","2014","16","11","2305","","10.1039/c3ce42028k","","","0.71073","MoKα","","0.0846","0.0446","","","0.0922","0.1049","","","","","","1.015","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213929","14.9099","0.0005","21.0323","0.0007","8.5659","0.0003","90","","94.401","0.002","90","","2678.26","0.16","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H30 Co N4 O9 -","- C19 H30 Co N4 O9 -","- C76 H120 Co4 N16 O36 -","4","1","","Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti","Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers","CrystEngComm","2014","16","11","2305","","10.1039/c3ce42028k","","","0.71073","MoKα","","0.1181","0.0715","","","0.2112","0.2437","","","","","","1.056","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213930","7.941","0.0003","10.7157","0.0004","12.0719","0.0004","93.337","0.002","93.883","0.002","111.134","0.002","952.17","0.06","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H18 N4 O5 Zn -","- C17 H18 N4 O5 Zn -","- C34 H36 N8 O10 Zn2 -","2","1","","Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti","Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers","CrystEngComm","2014","16","11","2305","","10.1039/c3ce42028k","","","0.71073","MoKα","","0.0663","0.049","","","0.1364","0.1483","","","","","","1.043","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213931","5.2008","0.0003","9.1754","0.0004","16.7077","0.0008","96.307","0.003","97.88","0.003","101.052","0.003","767.47","0.07","298","","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H19 N2 O7 Zn -","- C12 H19 N2 O7 Zn -","- C24 H38 N4 O14 Zn2 -","2","1","","Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti","Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers","CrystEngComm","2014","16","11","2305","","10.1039/c3ce42028k","","","0.71073","MoKα","","0.0674","0.0453","","","0.1026","0.1101","","","","","","1.034","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213932","8.6482","0.0002","10.2848","0.0002","12.7911","0.0003","93.53","0.001","108.249","0.001","111.453","0.001","985.46","0.04","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 Cd N4 O5 -","- C18 H20 Cd N4 O5 -","- C36 H40 Cd2 N8 O10 -","2","1","","Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti","Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers","CrystEngComm","2014","16","11","2305","","10.1039/c3ce42028k","","","0.71073","MoKα","","0.0338","0.0292","","","0.0697","0.0721","","","","","","1.053","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213933","15.8904","0.0003","15.8904","0.0003","29.0281","0.001","90","","90","","90","","7329.7","0.3","298","","298","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C33 H34 Cd2 N10 O10 -","- C33 H34 Cd2 N10 O10 -","- C264 H272 Cd16 N80 O80 -","8","0.5","","Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti","Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers","CrystEngComm","2014","16","11","2305","","10.1039/c3ce42028k","","","0.71073","MoKα","","0.0292","0.0238","","","0.0505","0.0531","","","","","","1.053","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213934","8.87","0.0018","22.049","0.004","15.806","0.003","90","","98.02","0.03","90","","3061","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H11 Dy F18 N4 O6 -","- C21 H11 Dy F18 N4 O6 -","- C84 H44 Dy4 F72 N16 O24 -","4","1","","Wang, Ya-Li; Gu, Bin; Ma, Yue; Xing, Cui; Wang, Qing-Lun; Li, Li-Cun; Cheng, Peng; Liao, Dai-Zheng","A new D2d-symmetry DyIII mononuclear single-molecule magnet containing a monodentate N-heterocyclic donor ligand","CrystEngComm","2014","16","11","2283","","10.1039/c3ce42212g","","","0.71073","MoKα","","0.0872","0.0598","","","0.1149","0.1247","","","","","","1.099","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213935","8.94","0.0018","22.222","0.004","15.95","0.003","90","","97.63","0.03","90","","3140.6","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H11 F18 N4 O6 Tb -","- C21 H11 F18 N4 O6 Tb -","- C84 H44 F72 N16 O24 Tb4 -","4","1","","Wang, Ya-Li; Gu, Bin; Ma, Yue; Xing, Cui; Wang, Qing-Lun; Li, Li-Cun; Cheng, Peng; Liao, Dai-Zheng","A new D2d-symmetry DyIII mononuclear single-molecule magnet containing a monodentate N-heterocyclic donor ligand","CrystEngComm","2014","16","11","2283","","10.1039/c3ce42212g","","","0.71073","MoKα","","0.0695","0.0551","","","0.1338","0.1428","","","","","","1.102","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213936","8.935","0.0018","22.252","0.004","16.011","0.003","90","","97.77","0.03","90","","3154.1","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H11 F18 Ho N4 O6 -","- C21 H11 F18 Ho N4 O6 -","- C84 H44 F72 Ho4 N16 O24 -","4","1","","Wang, Ya-Li; Gu, Bin; Ma, Yue; Xing, Cui; Wang, Qing-Lun; Li, Li-Cun; Cheng, Peng; Liao, Dai-Zheng","A new D2d-symmetry DyIII mononuclear single-molecule magnet containing a monodentate N-heterocyclic donor ligand","CrystEngComm","2014","16","11","2283","","10.1039/c3ce42212g","","","0.71073","MoKα","","0.0826","0.0602","","","0.1381","0.1498","","","","","","1.103","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213937","28.369","0.004","28.369","0.004","14.436","0.003","90","","90","","90","","11618","3","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C80 H66 As8 Cu4 N16 O43 V14 -","- C80 H64 As8 Cu4 N16 O43 V14 -","- C320 H256 As32 Cu16 N64 O172 V56 -","4","0.25","","Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing","The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters","CrystEngComm","2014","16","11","2251","","10.1039/c3ce42450b","","","0.71073","MoKα","","0.1513","0.0654","","","0.1817","0.2244","","","","","","1.004","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213938","26.4776","0.0012","16.8267","0.0011","27.5248","0.0011","90","","90","","90","","12263.1","1.1","296","2","296","2","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C96 H66 As8 Cu4 N16 O43 V14 -","- C96 H64 As8 Cu4 N16 O43 V14 -","- C384 H256 As32 Cu16 N64 O172 V56 -","4","","","Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing","The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters","CrystEngComm","2014","16","11","2251","","10.1039/c3ce42450b","","","0.71073","MoKα","","0.0894","0.0558","","","0.1337","0.1519","","","","","","0.998","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213939","15.118","0.002","15.118","0.002","38.962","0.008","90","","90","","90","","8905","2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C36 H50 As8 N24 Ni2 O49 V14 -","- C36 H36 As8 N24 Ni2 O49 V14 -","- C144 H144 As32 N96 Ni8 O196 V56 -","4","0.25","","Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing","The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters","CrystEngComm","2014","16","11","2251","","10.1039/c3ce42450b","","","0.71073","MoKα","","0.0516","0.0379","","","0.1029","0.1084","","","","","","1.036","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213940","14.9603","0.0011","17.1932","0.0013","27.477","0.002","90","","90","","90","","7067.5","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C74 H62 N8 O22 Zn5 -","- C74 H52 N8 O22 Zn5 -","- C296 H208 N32 O88 Zn20 -","4","0.5","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71073","MoKα","","0.0847","0.0406","","","0.0863","0.1031","","","","","","1.004","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213941","28.3903","0.0012","13.8667","0.0006","14.3593","0.0006","90","","107.254","0.001","90","","5398.6","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H26 N4 O6 Zn -","- C29 H22 N4 O6 Zn -","- C232 H176 N32 O48 Zn8 -","8","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71073","MoKα","","0.0412","0.034","","","0.0906","0.0946","","","","","","1.027","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213942","9.9705","0.0006","10.7624","0.0007","15.0951","0.0014","104.684","0.001","95.097","0.001","111.948","0.001","1422.59","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H28 Cd N4 O7 -","- C29 H22 Cd N4 O7 -","- C58 H44 Cd2 N8 O14 -","2","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71073","MoKα","","0.0524","0.0398","","","0.1002","0.1135","","","","","","1.07","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213943","11.774","0.005","11.812","0.005","14.993","0.005","97.373","0.005","93.976","0.005","114.192","0.005","1869.1","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H42 Cd2 N4 O10 -","- C37 H28 Cd2 N4 O10 -","- C74 H56 Cd4 N8 O20 -","2","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71069","MoKα","","0.0542","0.038","","","0.1011","0.1128","","","","","","1.075","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213944","13.977","0.005","17.017","0.005","24.062","0.005","90","0.005","93.727","0.005","90","0.005","5711","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H30 Cd N4 O5 -","- C29 H28 Cd N4 O5 -","- C232 H224 Cd8 N32 O40 -","8","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71069","MoKα","","0.0594","0.036","","","0.0884","0.0971","","","","","","1.027","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213945","13.0926","0.0005","20.9762","0.0008","20.0992","0.0008","90","","94.123","0.001","90","","5505.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H44 N8 O13 Zn2 -","- C60 H42 N8 O13 Zn2 -","- C240 H168 N32 O52 Zn8 -","4","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71073","MoKα","","0.0839","0.051","","","0.1263","0.1448","","","","","","1.021","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213946","13.698","0.005","16.879","0.005","18.153","0.005","110.202","0.005","91.837","0.005","109.065","0.005","3673","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C81 H66 Cd3 N12 O15 -","- C81 H60 Cd3 N12 O15 -","- C162 H120 Cd6 N24 O30 -","2","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan","Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids","CrystEngComm","2014","16","11","2176","","10.1039/c3ce42339e","","","0.71069","MoKα","","0.0542","0.0408","","","0.0942","0.1032","","","","","","1.025","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213947","20.201","0.014","9.992","0.007","21.796","0.015","90","","91.234","0.012","90","","4398","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H42 Co2 N6 O9 -","- C54 H42 Co2 N6 O9 -","- C216 H168 Co8 N24 O36 -","4","0.5","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.0757","0.0472","","","0.1163","0.1359","","","","","","0.997","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213948","20.3079","0.0015","10.1909","0.0008","21.8461","0.0016","90","","91.201","0.002","90","","4520.2","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H20 Cu N3 O4 -","- C27 H20 Cu N3 O4 -","- C216 H160 Cu8 N24 O32 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.0837","0.0532","","","0.1298","0.1494","","","","","","1","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213949","20.249","0.01","10.011","0.005","22.164","0.012","90","","91.228","0.012","90","","4492","4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H20 N3 Ni O4 -","- C27 H20 N3 Ni O4 -","- C216 H160 N24 Ni8 O32 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.1267","0.0572","","","0.1034","0.1259","","","","","","1.002","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213950","27.381","0.006","11.289","0.002","18.02","0.004","90","","117.075","0.004","90","","4959.6","1.8","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C112 H94 Co4 N12 O27 -","- C112 H94 Co4 N12 O27 -","- C224 H188 Co8 N24 O54 -","2","0.5","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.0893","0.0585","","","0.1293","0.1518","","","","","","0.997","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213951","26.386","0.002","11.3957","0.001","17.5666","0.0019","90","","115.712","0.001","90","","4759.1","0.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 Cu N3 O5 -","- C28 H20 Cu N3 O5 -","- C224 H160 Cu8 N24 O40 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.1123","0.0634","","","0.1649","0.1987","","","","","","0.999","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213952","32.498","0.008","12.812","0.003","18.172","0.005","90","","94.661","0.005","90","","7541","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H35 N5 Ni O7 -","- C39 H35 N5 Ni O7 -","- C312 H280 N40 Ni8 O56 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.135","0.085","","","0.2414","0.2864","","","","","","1.002","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213953","11.6916","0.0006","11.7881","0.0006","12.651","0.0006","82.071","0.001","83.113","0.001","82.638","0.001","1703.38","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H29 Co N5 O4 -","- C39 H29 Co N5 O4 -","- C78 H58 Co2 N10 O8 -","2","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.0609","0.0487","","","0.1409","0.1518","","","","","","1.003","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213954","20.768","0.005","10.017","0.003","16.158","0.004","90","","121.098","0.004","90","","2878.3","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Mn N O6 -","- C14 H12 Mn N O6 -","- C112 H96 Mn8 N8 O48 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.0598","0.0538","","","0.185","0.1914","","","","","","0.999","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213955","17.241","0.006","15.95","0.006","16.74","0.006","90","","108.386","0.007","90","","4368","3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 N3 Ni O7 -","- C22 H20 N3 Ni O7 -","- C176 H160 N24 Ni8 O56 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.1541","0.0673","","","0.1448","0.1829","","","","","","0.997","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213956","16.821","0.0012","19.1858","0.0014","20.6555","0.0015","90","","90","","90","","6666","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C33 H33 Cu N5 O8 -","- C33 H33 Cu N5 O8 -","- C264 H264 Cu8 N40 O64 -","8","1","","Fan, Liming; Zhang, Xiutang; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and properties of a series of 2D and 3D coordination polymers based on trifunctional pyridinedicarboxylate and different (bis)imidazole bridging ligands","CrystEngComm","2014","16","11","2144","","10.1039/c3ce42203h","","","0.71073","MoKα","","0.1506","0.0658","","","0.1512","0.1747","","","","","","1.002","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213957","27.504","0.003","14.3017","0.0015","13.3049","0.0016","90","","102.667","0.002","90","","5106.2","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H44 Cd4 N12 O24 -","- C42 H28 Cd4 N12 O24 -","- C168 H112 Cd16 N48 O96 -","4","1","","Li, Jie; Sheng, Tianlu; Bai, Songyan; Hu, Shengmin; Wen, Yuehong; Fu, Ruibiao; Huang, Yihui; Xue, Zhenzhen; Wu, Xintao","A series of metal‒organic frameworks containing diverse secondary building units derived from a flexible triazine-based tetracarboxylic ligand","CrystEngComm","2014","16","11","2188","","10.1039/c3ce42045k","","","0.71073","MoKα","","0.0611","0.0547","","","0.1557","0.1647","","","","","","1.113","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213958","8.8692","0.0007","13.3176","0.0014","15.8973","0.0015","103.897","0.004","96.463","0.002","98.338","0.004","1782.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H39 N9 O13 Zn2 -","- C30 H35 N9 O13 Zn2 -","- C60 H70 N18 O26 Zn4 -","2","1","","Li, Jie; Sheng, Tianlu; Bai, Songyan; Hu, Shengmin; Wen, Yuehong; Fu, Ruibiao; Huang, Yihui; Xue, Zhenzhen; Wu, Xintao","A series of metal‒organic frameworks containing diverse secondary building units derived from a flexible triazine-based tetracarboxylic ligand","CrystEngComm","2014","16","11","2188","","10.1039/c3ce42045k","","","0.71073","MoKα","","0.0608","0.0467","","","0.1244","0.1317","","","","","","1.056","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213959","16.915","0.005","9.686","0.003","17.4","0.005","90","","106.905","0.004","90","","2727.6","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 N7 O12 Zn2.5 -","- C24 H14 N7 O12 Zn2.5 -","- C96 H56 N28 O48 Zn10 -","4","1","","Li, Jie; Sheng, Tianlu; Bai, Songyan; Hu, Shengmin; Wen, Yuehong; Fu, Ruibiao; Huang, Yihui; Xue, Zhenzhen; Wu, Xintao","A series of metal‒organic frameworks containing diverse secondary building units derived from a flexible triazine-based tetracarboxylic ligand","CrystEngComm","2014","16","11","2188","","10.1039/c3ce42045k","","","0.71073","MoKα","","0.0876","0.0797","","","0.2083","0.2169","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7213960","29.542","0.008","7.3171","0.0018","35.757","0.01","90","","98.761","0.005","90","","7639","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H44 N8 O16 Zn2 -","- C31 H32 N8 O16 Zn2 -","- C248 H256 N64 O128 Zn16 -","8","1","","Li, Jie; Sheng, Tianlu; Bai, Songyan; Hu, Shengmin; Wen, Yuehong; Fu, Ruibiao; Huang, Yihui; Xue, Zhenzhen; Wu, Xintao","A series of metal‒organic frameworks containing diverse secondary building units derived from a flexible triazine-based tetracarboxylic ligand","CrystEngComm","2014","16","11","2188","","10.1039/c3ce42045k","","","0.71073","MoKα","","0.0535","0.0479","","","0.1352","0.1411","","","","","","1.052","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213961","16.804","0.002","16.228","0.002","26.461","0.004","90","","103.17","0.002","90","","7026","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H72 Cd4 N16 O28 -","- C54.002 H56 Cd4 N16 O28 -","- C216.008 H224 Cd16 N64 O112 -","4","1","","Li, Jie; Sheng, Tianlu; Bai, Songyan; Hu, Shengmin; Wen, Yuehong; Fu, Ruibiao; Huang, Yihui; Xue, Zhenzhen; Wu, Xintao","A series of metal‒organic frameworks containing diverse secondary building units derived from a flexible triazine-based tetracarboxylic ligand","CrystEngComm","2014","16","11","2188","","10.1039/c3ce42045k","","","0.71073","MoKα","","0.0665","0.0523","","","0.1373","0.1523","","","","","","1.08","","","","has coordinates,has disorder","180470","2020-10-21","18:00:00",""
"7213962","9.7346","0.0019","9.761","0.002","12.173","0.002","103.67","0.03","102.74","0.03","107.87","0.03","1014.6","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H19 Ag N2 O4 -","- C24 H19 Ag N2 O4 -","- C48 H38 Ag2 N4 O8 -","2","1","","Li, Ni-Ya; Ge, Yu; Wang, Tao; Wang, Shu-Jun; Ji, Xue-Ying; Liu, Dong","Construction of a series of coordination polymers based on 1,4-naphthalenedicarboxylic and flexible dipyridyl ligands","CrystEngComm","2014","16","11","2168","","10.1039/c3ce42148a","","","0.71073","MoKα","","0.0413","0.0337","","","0.0688","0.0711","","","","","","1.114","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213963","11.812","0.002","9.6182","0.0019","19.06","0.004","90","","103.55","0.03","90","","2105.1","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 Ag N2 O4 -","- C25 H21 Ag N2 O4 -","- C100 H84 Ag4 N8 O16 -","4","1","","Li, Ni-Ya; Ge, Yu; Wang, Tao; Wang, Shu-Jun; Ji, Xue-Ying; Liu, Dong","Construction of a series of coordination polymers based on 1,4-naphthalenedicarboxylic and flexible dipyridyl ligands","CrystEngComm","2014","16","11","2168","","10.1039/c3ce42148a","","","0.71073","MoKα","","0.0406","0.0327","","","0.0833","0.089","","","","","","1.017","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213964","15.72","0.003","16.12","0.003","13.476","0.003","90","","116.42","0.03","90","","3058.2","1.3","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H12 Cd N O4 -","- C18 H12 Cd N O4 -","- C144 H96 Cd8 N8 O32 -","8","1","","Li, Ni-Ya; Ge, Yu; Wang, Tao; Wang, Shu-Jun; Ji, Xue-Ying; Liu, Dong","Construction of a series of coordination polymers based on 1,4-naphthalenedicarboxylic and flexible dipyridyl ligands","CrystEngComm","2014","16","11","2168","","10.1039/c3ce42148a","","","0.71073","MoKα","","0.0259","0.0249","","","0.0622","0.0628","","","","","","1.192","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213965","16.616","0.003","15.383","0.003","14.774","0.003","90","","120.63","0.03","90","","3249.4","1.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H26 Cd2 N2 O8 -","- C37 H26 Cd2 N2 O8 -","- C148 H104 Cd8 N8 O32 -","4","0.5","","Li, Ni-Ya; Ge, Yu; Wang, Tao; Wang, Shu-Jun; Ji, Xue-Ying; Liu, Dong","Construction of a series of coordination polymers based on 1,4-naphthalenedicarboxylic and flexible dipyridyl ligands","CrystEngComm","2014","16","11","2168","","10.1039/c3ce42148a","","","0.71073","MoKα","","0.0344","0.0277","","","0.056","0.058","","","","","","1.135","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213966","18.884","0.004","16.206","0.003","10.375","0.002","90","","90","","90","","3175.1","1.1","298","2","298","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C18 H12 N O4 Zn -","- C18 H12 N O4 Zn -","- C144 H96 N8 O32 Zn8 -","8","","","Li, Ni-Ya; Ge, Yu; Wang, Tao; Wang, Shu-Jun; Ji, Xue-Ying; Liu, Dong","Construction of a series of coordination polymers based on 1,4-naphthalenedicarboxylic and flexible dipyridyl ligands","CrystEngComm","2014","16","11","2168","","10.1039/c3ce42148a","","","0.71073","MoKα","","0.0754","0.0716","","","0.1798","0.184","","","","","","1.067","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7213967","16.466","0.003","15.188","0.003","25.146","0.005","90","","90","","90","","6289","2","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H28 Co2 N2 O9 -","- C37 H28 Co2 N2 O9 -","- C296 H224 Co16 N16 O72 -","8","1","","Li, Ni-Ya; Ge, Yu; Wang, Tao; Wang, Shu-Jun; Ji, Xue-Ying; Liu, Dong","Construction of a series of coordination polymers based on 1,4-naphthalenedicarboxylic and flexible dipyridyl ligands","CrystEngComm","2014","16","11","2168","","10.1039/c3ce42148a","","","0.71073","MoKα","","0.0363","0.0308","","","0.0762","0.0799","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7213968","14.07","0.003","22.001","0.004","20.966","0.004","90","","101.07","0.03","90","","6369","2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H56 Cd3 N8 O20 S3 -","- C48 H56 Cd3 N8 O20 S3 -","- C192 H224 Cd12 N32 O80 S12 -","4","1","","Li, Duan-Xiu; Ni, Chun-Yan; Chen, Min-Min; Dai, Ming; Zhang, Wen-Hua; Yan, Wen-Yan; Qi, Hai-Xiao; Ren, Zhi-Gang; Lang, Jian-Ping","Construction of Cd(ii) coordination polymers used as catalysts for the photodegradation of organic dyes in polluted water","CrystEngComm","2014","16","11","2158","","10.1039/c3ce42360c","","","0.71073","MoKα","","0.0558","0.0486","","","0.1161","0.1202","","","","","","1.108","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213969","15.6677","0.0005","15.6677","0.0005","15.6677","0.0005","90","","90","","90","","3846.1","0.2","153","2","153","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C18 H15 Cd N4 O6 -","- C18 H15 Cd N4 O6 -","- C144 H120 Cd8 N32 O48 -","8","0.166667","","Li, Duan-Xiu; Ni, Chun-Yan; Chen, Min-Min; Dai, Ming; Zhang, Wen-Hua; Yan, Wen-Yan; Qi, Hai-Xiao; Ren, Zhi-Gang; Lang, Jian-Ping","Construction of Cd(ii) coordination polymers used as catalysts for the photodegradation of organic dyes in polluted water","CrystEngComm","2014","16","11","2158","","10.1039/c3ce42360c","","","0.71073","MoKα","","0.0702","0.0586","","","0.1264","0.1321","","","","","","1.094","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213970","17.9901","0.0015","13.5567","0.0012","15.6762","0.0016","90","","91.684","0.009","90","","3821.6","0.6","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H46 Cd2 N4 O19 S2 -","- C26 H46 Cd2 N4 O19 S2 -","- C104 H184 Cd8 N16 O76 S8 -","4","1","","Li, Duan-Xiu; Ni, Chun-Yan; Chen, Min-Min; Dai, Ming; Zhang, Wen-Hua; Yan, Wen-Yan; Qi, Hai-Xiao; Ren, Zhi-Gang; Lang, Jian-Ping","Construction of Cd(ii) coordination polymers used as catalysts for the photodegradation of organic dyes in polluted water","CrystEngComm","2014","16","11","2158","","10.1039/c3ce42360c","","","0.71073","MoKα","","0.1405","0.0993","","","0.2354","0.261","","","","","","0.997","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213971","25.3104","0.0009","13.9294","0.0005","19.6913","0.0007","90","","128.818","0.001","90","","5409.1","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H24 Cd N6 O8 -","- C24 H24 Cd N6 O8 -","- C192 H192 Cd8 N48 O64 -","8","1","","Li, Duan-Xiu; Ni, Chun-Yan; Chen, Min-Min; Dai, Ming; Zhang, Wen-Hua; Yan, Wen-Yan; Qi, Hai-Xiao; Ren, Zhi-Gang; Lang, Jian-Ping","Construction of Cd(ii) coordination polymers used as catalysts for the photodegradation of organic dyes in polluted water","CrystEngComm","2014","16","11","2158","","10.1039/c3ce42360c","","","0.71073","MoKα","","0.0406","0.032","","","0.0714","0.075","","","","","","1.059","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213972","11.4349","0.0006","15.545","0.0006","12.8179","0.0006","90","","113.755","0.006","90","","2085.41","0.19","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.71073","MoKα","","0.0797","0.0571","","","0.1517","0.1693","","","","","","1.054","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213973","11.262","0.006","14.9356","0.0012","12.497","0.004","90","","113.73","0.06","90","","1924.3","1.5","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1415","0.0989","","","0.2333","0.2625","","","","","","1.555","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213974","11.096","0.002","14.494","0.003","12.262","0.003","90","","113.85","0.03","90","","1803.6","0.8","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1037","0.0775","","","0.1535","0.1713","","","","","","1.536","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213975","11.053","0.002","14.338","0.003","12.136","0.002","90","","113.76","0.03","90","","1760.3","0.7","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1241","0.077","","","0.1592","0.1864","","","","","","1.49","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213976","10.991","0.006","14.1391","0.0008","12.033","0.004","90","","113.83","0.05","90","","1710.5","1.3","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0974","0.0758","","","0.1681","","","","","","","1.422","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213977","10.954","0.002","14.032","0.003","11.962","0.002","90","","113.77","0.03","90","","1682.7","0.7","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0753","0.0674","","","0.163","0.1687","","","","","","1.488","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213978","10.93","0.002","13.961","0.003","11.922","0.002","90","","113.76","0.03","90","","1665","0.7","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0797","0.0687","","","0.1658","0.173","","","","","","1.434","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213979","10.135","0.009","15.0384","0.0016","10.9","0.007","90","","107.52","0.09","90","","1584.2","1.9","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0794","0.0561","","","0.1083","0.1193","","","","","","1.411","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213980","10.118","0.018","15.012","0.003","10.877","0.011","90","","107.53","0.16","90","","1575","4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0724","0.0545","","","0.1129","0.1223","","","","","","1.456","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213981","10.117","0.018","15.004","0.003","10.869","0.011","90","","107.52","0.16","90","","1573","4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.071","0.0548","","","0.1277","0.1354","","","","","","1.53","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213982","10.052","0.002","14.932","0.003","10.789","0.002","90","","107.39","0.03","90","","1545.4","0.6","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.071","0.0504","","","0.1042","0.117","","","","","","1.261","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213983","9.985","0.002","14.855","0.003","10.722","0.002","90","","107.35","0.03","90","","1518","0.6","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1027","0.078","","","0.1827","0.208","","","","","","1.131","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213984","9.894","0.002","14.736","0.003","10.588","0.002","90","","107.21","0.03","90","","1474.6","0.6","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BenzothiopheneDTE","1,2-Bis(2-methyl benzothiophen-3-yl) perfluorocyclopentene","","- C23 H14 F6 S2 -","- C23 H14 F6 S2 -","- C92 H56 F24 S8 -","4","1","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0557","0.0436","","","0.0962","0.1031","","","","","","1.29","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213985","20.5687","0.001","8.8331","0.0002","11.4381","0.0005","90","","122.177","0.006","90","","1758.95","0.17","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.71073","MoKα","","0.0577","0.041","","","0.1143","0.1293","","","","","","0.963","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213986","19.69","0.06","8.8311","0.0018","11.46","0.003","90","","116.72","0.05","90","","1780","6","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1296","0.0895","","","0.216","0.2454","","","","","","1.096","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213987","19.672","0.029","8.6717","0.0008","11.0787","0.0009","90","","120.594","0.013","90","","1627","2","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0963","0.0766","","","0.1825","0.1996","","","","","","1.104","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213988","19.3247","0.0061","8.6243","0.0006","10.9544","0.0007","90","","120.113","0.014","90","","1579.3","0.6","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0883","0.0728","","","0.1772","0.1906","","","","","","1.043","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213989","18.4265","0.0046","8.4721","0.0006","10.633","0.0007","90","","118.512","0.015","90","","1458.6","0.4","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0832","0.0713","","","0.1441","0.1505","","","","","","1.053","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213990","18.0508","0.0011","8.3848","0.0008","10.551","0.023","90","","118.132","0.023","90","","1408","3","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1193","0.0982","","","0.2321","0.2507","","","","","","1.089","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213991","17.874","0.008","8.336","0.0007","10.524","0.013","90","","117.9","0.2","90","","1386","3","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","0.5","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1031","0.0934","","","0.1927","0.1994","","","","","","1.081","","","","has coordinates,has disorder","211415","2020-10-21","18:00:00",""
"7213992","10.506","0.002","16.364","0.003","15.514","0.003","90","","98.95","0.03","90","","2634.7","0.9","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C136 H112 F48 S16 -","8","2","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0922","0.0712","","","0.1779","0.2025","","","","","","1.055","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213993","10.4886","0.001","16.3135","0.0016","15.5602","0.0096","90","","99.0816","0.0016","90","","2629.1","1.7","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C136 H112 F48 S16 -","8","2","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.085","0.0689","","","0.1714","0.1851","","","","","","1.051","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213994","10.4663","0.0008","16.259","0.0012","15.427","0.0072","90","","99.409","0.012","90","","2589.9","1.2","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C136 H112 F48 S16 -","8","2","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0718","0.0615","","","0.165","0.1752","","","","","","1.068","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213995","10.4211","0.0007","16.1206","0.0012","15.169","0.0068","90","","99.83","0.011","90","","2510.9","1.2","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C136 H112 F48 S16 -","8","2","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0795","0.0613","","","0.1546","0.1699","","","","","","1.065","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213996","10.377","0.002","16.06","0.003","15.031","0.003","90","","100.45","0.03","90","","2463.4","0.9","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C136 H112 F48 S16 -","8","2","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.1158","0.0824","","","0.1875","0.2172","","","","","","1.437","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213997","10.3834","0.0005","16.0279","0.0008","15.0219","0.0045","90","","100.443","0.007","90","","2458.6","0.8","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DimethylthiopheneDTE","1,2-Bis(2,5-dimethylthiophen-3-yl) perfluorocyclopentene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C136 H112 F48 S16 -","8","2","","Woodall, Christopher H.; Brayshaw, Simon K.; Schiffers, Stefanie; Allan, David R.; Parsons, Simon; Valiente, Rafael; Raithby, Paul R.","High-pressure crystallographic and spectroscopic studies on two molecular dithienylethene switches","CrystEngComm","2014","16","11","2119","","10.1039/c3ce41933a","","","0.6889","synchrotron","","0.0718","0.0525","","","0.1281","0.1458","","","","","","1.017","","","","has coordinates","211415","2020-10-21","18:00:00",""
"7213998","48.2903","0.0015","13.6014","0.0003","22.1554","0.0005","90","","100.647","0.003","90","","14301.5","0.6","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C20 H145 Cu N20 Na2 O148 P4 Tb W34 -","- C12 H52 Cu N12 Na2 O136 P4 Tb W34 -","- C48 H208 Cu4 N48 Na8 O544 P16 Tb4 W136 -","4","0.5","","Zhao, Hai-Yan; Zhao, Jun-Wei; Yang, Bai-Feng; He, Huan; Yang, Guo-Yu","A series of organic‒inorganic hybrids based on lanthanide-substituted Dawson-type phosphotungstate dimers and copper‒en linkers","CrystEngComm","2014","16","11","2230","","10.1039/c3ce42029a","","","0.71073","MoKα","","0.0581","0.047","","","0.119","0.1234","","","","","","1.043","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7213999","48.3988","0.0017","13.6295","0.0004","22.1644","0.0006","90","","100.66","0.003","90","","14368.5","0.8","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C20 H149 Cu Eu N20 Na2 O150 P4 W34 -","- C12 H56 Cu Eu N12 Na2 O144 P4 W34 -","- C48 H224 Cu4 Eu4 N48 Na8 O576 P16 W136 -","4","0.5","","Zhao, Hai-Yan; Zhao, Jun-Wei; Yang, Bai-Feng; He, Huan; Yang, Guo-Yu","A series of organic‒inorganic hybrids based on lanthanide-substituted Dawson-type phosphotungstate dimers and copper‒en linkers","CrystEngComm","2014","16","11","2230","","10.1039/c3ce42029a","","","0.71073","MoKα","","0.0545","0.0367","","","0.0795","0.0848","","","","","","1.075","","","","has coordinates","180470","2020-10-21","18:00:00",""
"7214000","48.4356","0.0012","13.5979","0.0003","22.1157","0.0005","90","","100.54","0.002","90","","14320.1","0.6","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C24 H157 Cu N24 Na2 O146 P4 Sm W34 -","- C12 H56 Cu N12 Na2 O146 P4 Sm W34 -","- C48 H224 Cu4 N48 Na8 O584 P16 Sm4 W136 -","4","0.5","","Zhao, Hai-Yan; Zhao, Jun-Wei; Yang, Bai-Feng; He, Huan; Yang, Guo-Yu","A series of organic‒inorganic hybrids based on lanthanide-substituted Dawson-type phosphotungstate dimers and copper‒en linkers","CrystEngComm","2014","16","11","2230","","10.1039/c3ce42029a","","","0.71073","MoKα","","0.0601","0.0424","","","0.1034","0.1127","","","","","","1.056","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214001","48.5506","0.0011","13.6364","0.0005","22.1072","0.0005","90","","100.436","0.002","90","","14394.1","0.7","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C18 H127 Ce Cu N18 Na2 O143 P4 W34 -","- C12 H52 Ce Cu N12 Na2 O142 P4 W34 -","- C48 H208 Ce4 Cu4 N48 Na8 O568 P16 W136 -","4","0.5","","Zhao, Hai-Yan; Zhao, Jun-Wei; Yang, Bai-Feng; He, Huan; Yang, Guo-Yu","A series of organic‒inorganic hybrids based on lanthanide-substituted Dawson-type phosphotungstate dimers and copper‒en linkers","CrystEngComm","2014","16","11","2230","","10.1039/c3ce42029a","","","0.71073","MoKα","","0.0934","0.0746","","","0.182","0.1974","","","","","","1.012","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214002","9.1367","0.0002","9.1367","0.0002","25.9692","0.001","90","","90","","120","","1877.45","0.09","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C0 H2 In N0 O6 P2 -","- H2 In O6 P2 -","- H18 In9 O54 P18 -","9","0.5","","Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang","Solvothermal syntheses and structures of four indium‒phosphite coordination polymers","CrystEngComm","2014","16","11","2266","","10.1039/c3ce42059k","","","0.71073","MoKα","","0.0176","0.0159","","","0.0385","0.0388","","","","","","1.006","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214003","5.4121","0.001","10.234","0.0018","10.5108","0.0019","113.234","0.002","95.522","0.003","92.534","0.002","530.32","0.17","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C3 H14 F In N2 O6 P2 -","- C3 H14 F In N2 O6 P2 -","- C6 H28 F2 In2 N4 O12 P4 -","2","1","","Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang","Solvothermal syntheses and structures of four indium‒phosphite coordination polymers","CrystEngComm","2014","16","11","2266","","10.1039/c3ce42059k","","","0.71073","MoKα","","0.0285","0.0247","","","0.0562","0.0592","","","","","","1.087","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214004","8.2519","0.0003","8.2519","0.0003","7.6934","0.0004","90","","90","","120","","453.69","0.03","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- H3 In2 O9 P3 -","- H3 In2 O9 P3 -","- H6 In4 O18 P6 -","2","0.166667","","Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang","Solvothermal syntheses and structures of four indium‒phosphite coordination polymers","CrystEngComm","2014","16","11","2266","","10.1039/c3ce42059k","","","0.71073","MoKα","","0.018","0.0175","","","0.0433","0.0437","","","","","","1.233","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214005","13.8148","0.0018","13.8148","0.0018","18.612","0.005","90","","90","","120","","3076.2","1","296","2","296","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C0 H7 In4 N0 O24 P7 -","- H7 In4 O24 P7 -","- H28 In16 O96 P28 -","4","0.333333","","Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang","Solvothermal syntheses and structures of four indium‒phosphite coordination polymers","CrystEngComm","2014","16","11","2266","","10.1039/c3ce42059k","","","0.71073","MoKα","","0.0555","0.0434","","","0.1198","0.1247","","","","","","1.082","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214006","6.8098","0.0014","31.143","0.006","13.07","0.004","90","","120.24","0.02","90","","2394.7","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 La2 N O19 -","- C18 H18 La2 N O19 -","- C72 H72 La8 N4 O76 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.1349","0.1078","","","0.2664","0.2906","","","","","","1.082","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214007","6.7147","0.0013","30.942","0.006","12.909","0.004","90","","120.14","0.02","90","","2319.4","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N O19 Pr2 -","- C18 H18 N O19 Pr2 -","- C72 H72 N4 O76 Pr8 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.0465","0.0405","","","0.0909","0.0942","","","","","","1.105","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214008","6.7129","0.0013","30.855","0.006","12.888","0.004","90","","120.73","0.02","90","","2294.6","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N O19 Sm2 -","- C18 H18 N O19 Sm2 -","- C72 H72 N4 O76 Sm8 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.0637","0.0588","","","0.1381","0.1404","","","","","","1.183","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214009","6.674","0.0013","30.729","0.006","12.805","0.004","90","0.03","120.67","0.02","90","0.03","2258.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Eu2 N O19 -","- C18 H18 Eu2 N O19 -","- C72 H72 Eu8 N4 O76 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.0309","0.028","","","0.0659","0.0672","","","","","","1.121","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214010","6.675","0.0013","30.726","0.006","12.841","0.004","90","","120.81","0.02","90","","2262","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Gd2 N O19 -","- C18 H18 Gd2 N O19 -","- C72 H72 Gd8 N4 O76 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.0648","0.0605","","","0.1432","0.145","","","","","","1.179","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214011","6.666","0.0013","30.662","0.006","12.798","0.004","90","","120.79","0.02","90","","2247.1","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N O19 Tb2 -","- C18 H18 N O19 Tb2 -","- C72 H72 N4 O76 Tb8 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.0825","0.0565","","","0.1149","0.1277","","","","","","1.105","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214012","6.661","0.0013","30.58","0.006","12.763","0.003","90","","121","0.02","90","","2228.4","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Dy2 N O19 -","- C18 H18 Dy2 N O19 -","- C72 H72 Dy8 N4 O76 -","4","1","","Sun, Ya-guang; Li, Jian; Li, Ke-long; Xu, Zhen-he; Ding, Fu; Ren, Bao-yi; Wang, Shu-ju; You, Li-xin; Xiong, Gang; Smet, Philippe F.","A family of 3D lanthanide‒organic frameworks constructed from parallelogram secondary building units: synthesis, structures and properties","CrystEngComm","2014","16","9","1777","","10.1039/c3ce42197j","","","0.71073","MoKα","","0.0668","0.0522","","","0.13","0.1408","","","","","","1.1","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214013","18.615","0.002","6.0317","0.0007","29.072","0.004","90","","105.908","0.002","90","","3139.2","0.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 Cl N O2 -","- C18 H16 Cl N O2 -","- C144 H128 Cl8 N8 O16 -","8","1","","Tanaka, Yuki; Tabata, Hideyuki; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Control of crystal structures of fluorescent two-component supramolecular systems by varying substituents and their positions","CrystEngComm","2014","16","9","1741","","10.1039/c3ce42128g","","","0.71073","MoKα","","0.0796","0.0482","","","0.1049","0.1165","","","","","","1.017","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214014","10.5204","0.0007","8.7184","0.0006","33.531","0.002","90","","90","","90","","3075.5","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H16 Cl N O2 -","- C18 H16 Cl N O2 -","- C144 H128 Cl8 N8 O16 -","8","1","","Tanaka, Yuki; Tabata, Hideyuki; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Control of crystal structures of fluorescent two-component supramolecular systems by varying substituents and their positions","CrystEngComm","2014","16","9","1741","","10.1039/c3ce42128g","","","0.71073","MoKα","","0.0656","0.0509","","","0.1385","0.1495","","","","","","1.018","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214015","4.637","0.0018","11.658","0.004","15.392","0.005","67.925","0.012","82.161","0.015","85.996","0.018","763.7","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Br N O2 -","- C18 H16 Br N O2 -","- C36 H32 Br2 N2 O4 -","2","1","","Tanaka, Yuki; Tabata, Hideyuki; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Control of crystal structures of fluorescent two-component supramolecular systems by varying substituents and their positions","CrystEngComm","2014","16","9","1741","","10.1039/c3ce42128g","","","0.71073","MoKα","","0.0757","0.0645","","","0.1611","0.1759","","","","","","1.12","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214016","10.6279","0.0009","8.7139","0.0007","33.989","0.003","90","","90","","90","","3147.7","0.5","93","2","93","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H16 Br N O2 -","- C18 H16 Br N O2 -","- C144 H128 Br8 N8 O16 -","8","1","","Tanaka, Yuki; Tabata, Hideyuki; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Control of crystal structures of fluorescent two-component supramolecular systems by varying substituents and their positions","CrystEngComm","2014","16","9","1741","","10.1039/c3ce42128g","","","0.71073","MoKα","","0.0913","0.0524","","","0.112","0.1274","","","","","","1.052","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214017","18.404","0.005","6.025","0.0015","28.832","0.008","90","","104.628","0.003","90","","3093.4","1.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C152 H152 N8 O16 -","8","1","","Tanaka, Yuki; Tabata, Hideyuki; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Control of crystal structures of fluorescent two-component supramolecular systems by varying substituents and their positions","CrystEngComm","2014","16","9","1741","","10.1039/c3ce42128g","","","0.71073","MoKα","","0.1177","0.0537","","","0.1202","0.1497","","","","","","0.944","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214018","15.604","0.004","6.263","0.0014","15.601","0.004","90","","90.68","0.003","90","","1524.5","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C76 H76 N4 O8 -","4","1","","Tanaka, Yuki; Tabata, Hideyuki; Tajima, Nobuo; Kuroda, Reiko; Imai, Yoshitane","Control of crystal structures of fluorescent two-component supramolecular systems by varying substituents and their positions","CrystEngComm","2014","16","9","1741","","10.1039/c3ce42128g","","","0.71073","MoKα","","0.0526","0.0433","","","0.1152","0.1234","","","","","","1.058","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214019","4.9227","0.0002","13.9837","0.0003","15.7876","0.0003","90","","90","","90","","1086.78","0.05","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H10 Li2 O10 -","- C8 H10 Li2 O10 -","- C32 H40 Li8 O40 -","4","1","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0329","0.0308","","","0.0881","0.0895","","","","","","1.075","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214020","21.6635","0.0016","8.1817","0.0004","8.1299","0.0006","90","","98.514","0.004","90","","1425.1","0.16","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H16 Li4 O13 -","- C8 H16 Li4 O13 -","- C32 H64 Li16 O52 -","4","0.5","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0391","0.0327","","","0.0919","0.095","","","","","","1.079","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214021","5.3722","0.0002","13.4257","0.0011","12.451","0.001","90","","91.272","0.005","90","","897.81","0.11","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H7 Na O8 -","- C8 H7 Na O8 -","- C32 H28 Na4 O32 -","4","1","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0517","0.0369","","","0.0976","0.1032","","","","","","1.039","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214022","8.4001","0.0007","13.7383","0.0011","6.4302","0.0004","90","","104.284","0.005","90","","719.12","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H14 K2 O12 -","- C8 H14 K2 O12 -","- C16 H28 K4 O24 -","2","0.5","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0355","0.0283","","","0.07","0.0725","","","","","","1.065","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214023","8.6068","0.0002","5.5968","0.0002","10.716","0.0003","90","","92.205","0.002","90","","515.81","0.03","150","2","150","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C8 H7 K O8 -","- C8 H7 K O8 -","- C16 H14 K2 O16 -","2","0.5","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0351","0.0329","","","0.0915","0.0923","","","","","","1.077","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214024","8.1309","0.0004","9.662","0.0005","12.7399","0.0005","90","","90","","90","","1000.86","0.08","150","2","150","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C8 H7 O8 Rb -","- C8 H7 O8 Rb -","- C32 H28 O32 Rb4 -","4","0.5","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0277","0.0232","","","0.0654","0.0673","","","","","","1.072","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214025","9.8276","0.0003","9.8276","0.0003","10.2207","0.0005","90","","90","","90","","987.13","0.06","150","2","150","2","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C8 H7 Cs O8 -","- C8 H4 Cs O8 -","- C32 H16 Cs4 O32 -","4","0.5","","Thuéry, Pierre","Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid","CrystEngComm","2014","16","9","1724","","10.1039/c3ce41565a","","","0.71073","MoKα","","0.0261","0.0231","","","0.0605","0.0613","","","","","","1.155","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214026","6.2442","0.0005","13.1523","0.0012","8.5929","0.0005","90","","96.82","0.006","90","","700.7","0.09","120","2","120","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C2 H5 N3 O3 P S -","- C2 H5 N3 O3 P S -","- C8 H20 N12 O12 P4 S4 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.5418","CuKα","","0.0834","0.0769","","0.0679","0.0662","0.0662","","","","","","1.1054","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214027","5.2","0.00007","10.2243","0.00015","13.06242","0.00017","90","","90","","90","","694.481","0.017","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","2-amino-1,3,4-thiadiazolium(1+) hydrogen sulphate","","","- C2 H5 N3 O4 S2 -","- C2 H5 N3 O4 S2 -","- C8 H20 N12 O16 S8 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.54178","CuKα","","0.0202","0.0202","","","0.0503","0.0503","","","","","","0.879","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214028","4.4119","0.0001","21.9024","0.0005","7.519","0.0002","90","","94.531","0.002","90","","724.3","0.03","120","2","120","2","","","","","","","","6","C 1 c 1","C -2yc","9","2-amino-1,3,4-thiadiazolium(1+) dihydrogen phosphate","","","- C2 H6 N3 O4 P S -","- C2 H6 N3 O4 P S -","- C8 H24 N12 O16 P4 S4 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.54178","CuKα","","0.0297","0.0296","","","0.0839","0.084","","","","","","1.082","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214029","6.6897","0.0002","8.3773","0.0002","10.9734","0.0003","90","","103.301","0.003","90","","598.47","0.03","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-amino-1,3,4-thiadiazolium(1+) nitrate","","","- C2 H4 N4 O3 S -","- C2 H4 N4 O3 S -","- C8 H16 N16 O12 S4 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.54178","CuKα","","0.0435","0.0402","","","0.1077","0.1125","","","","","","1.099","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214030","5.5377","0.0001","13.9715","0.0002","7.6737","0.0001","90","","93.472","0.001","90","","592.624","0.016","120","2","120","2","","","","","","","","6","P 1 c 1","P -2yc","7","Bis(2-amino-1,3,4-thiadiazolium(1+) selenate monohydrate","","","- C4 H8 N6 O5 S2 Se -","- C4 H8 N6 O5 S2 Se -","- C8 H16 N12 O10 S4 Se2 -","2","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.54178","CuKα","","0.035","0.035","","","0.0873","0.0873","","","","","","1.129","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214031","4.9574","0.0001","8.7771","0.0002","14.2055","0.0003","90","","97.481","0.002","90","","612.84","0.02","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","2-amino-1,3,4-thiadiazolium(1+) chloride monohydrate","","","- C2 H6 Cl N3 O S -","- C2 H6 Cl N3 O S -","- C8 H24 Cl4 N12 O4 S4 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.54178","CuKα","","0.0652","0.0642","","","0.1793","0.181","","","","","","1.127","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214032","4.9817","0.0001","20.0865","0.0003","11.0569","0.0002","90","","90.643","0.002","90","","1106.34","0.03","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","2-amino-1,3,4-tihiadiazole 2-amino-1,3,4-thiadiazolium(1+) perchlorate","","","- C4 H7 Cl N6 O4 S2 -","- C4 H7 Cl N6 O4 S2 -","- C16 H28 Cl4 N24 O16 S8 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","1.54178","CuKα","","0.0301","0.0292","","","0.0784","0.0793","","","","","","1.038","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214033","5.0168","0.0003","18.6658","0.0011","7.4367","0.0005","90","","102.148","0.002","90","","680.8","0.07","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","2-amino-1,3,5-thiadiazolium(1+) perchlorate","","","- C3 H Cl N3 O4 S -","- C2 H4 Cl N3 O4 S -","- C8 H16 Cl4 N12 O16 S4 -","4","1","","Matulková, I.; Cihelka, J.; Pojarová, M.; Fejfarová, K.; Dušek, M.; Císařová, I.; Vaněk, P.; Kroupa, J.; Němec, P.; Tesařová, N.; Němec, I.","Molecular crystals of 2-amino-1,3,4-thiadiazole with inorganic oxyacids ‒ crystal engineering, phase transformations and NLO properties","CrystEngComm","2014","16","9","1763","","10.1039/c3ce42306a","","","0.71073","MoKα","","0.0235","0.0223","","","0.0646","0.0662","","","","","","0.597","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214034","46.552","0.013","15.749","0.004","22.925","0.006","90","","90","","90","","16807","8","223","2","223","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C30 H66 Cl K La Mo12 N20 O78 P -","- C30 H30 Cl K La Mo12 N20 O68 P -","- C240 H240 Cl8 K8 La8 Mo96 N160 O544 P8 -","8","2","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0602","0.049","","","0.114","0.1203","","","","","","1.037","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214035","46.525","0.007","15.707","0.002","22.889","0.003","90","","90","","90","","16727","4","223","2","223","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C30 H66 Ce Cl K Mo12 N20 O78 P -","- C30 H30 Ce Cl K Mo12 N20 O68 P -","- C240 H240 Ce8 Cl8 K8 Mo96 N160 O544 P8 -","8","2","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0582","0.0476","","","0.107","0.113","","","","","","1.036","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214036","46.551","0.005","15.6964","0.0017","22.913","0.003","90","","90","","90","","16742","3","223","2","223","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C30 H69 Cl Mo12 N20 O79 P Pr -","- C30 H30 Cl Mo12 N20 O65 P Pr -","- C240 H240 Cl8 Mo96 N160 O520 P8 Pr8 -","8","2","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0835","0.0564","","","0.1245","0.1357","","","","","","1.015","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214037","22.648","0.004","15.759","0.003","23.177","0.004","90","","90","","90","","8272","3","223","2","223","2","","","","","","","","9","P n m a","-P 2ac 2n","62","","","","- C30 H62 Cl K Mo12 N20 Nd O76 P -","- C30 H30 Cl K Mo12 N20 Nd O64 P -","- C120 H120 Cl4 K4 Mo48 N80 Nd4 O256 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.1094","0.0831","","","0.2169","0.2369","","","","","","1.091","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214038","22.655","0.013","15.874","0.009","23.21","0.013","90","","90","","90","","8347","8","223","2","223","2","","","","","","","","9","P n m a","-P 2ac 2n","62","","","","- C30 H58 Cl K Mo12 N20 O74 P Sm -","- C30 H30 Cl K Mo12 N20 O65 P Sm -","- C120 H120 Cl4 K4 Mo48 N80 O260 P4 Sm4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0913","0.0648","","","0.1748","0.1914","","","","","","1.118","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214039","22.524","0.004","15.876","0.003","23.193","0.004","90","","90","","90","","8294","3","223","2","223","2","","","","","","","","9","P n m a","-P 2ac 2n","62","","","","- C30 H58 Cl Eu K Mo12 N20 O74 P -","- C30 H30 Cl Eu K Mo12 N20 O65 P -","- C120 H120 Cl4 Eu4 K4 Mo48 N80 O260 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0932","0.0628","","","0.1618","0.1773","","","","","","1.086","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214040","22.485","0.003","15.879","0.002","23.163","0.003","90","","90","","90","","8270.1","1.9","223","2","223","2","","","","","","","","9","P n m a","-P 2ac 2n","62","","","","- C30 H58 Cl Gd K Mo12 N20 O74 P -","- C30 H30 Cl Gd K Mo12 N20 O65 P -","- C120 H120 Cl4 Gd4 K4 Mo48 N80 O260 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0834","0.0587","","","0.1553","0.1691","","","","","","1.109","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214041","16.5175","0.0013","14.4895","0.0012","33.998","0.003","90","","99.206","0.002","90","","8031.9","1.2","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H60 K2 Mo12 N21 O77 P -","- C30 H30 K2 Mo12 N21 O67 P -","- C120 H120 K8 Mo48 N84 O268 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.095","0.0657","","","0.1736","0.195","","","","","","1.056","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214042","16.4852","0.0011","14.4496","0.0009","33.998","0.002","90","","99.185","0.002","90","","7994.6","0.9","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H62 K2 Mo12 N21 O78 P -","- C30 H30 K2 Mo12 N21 O68 P -","- C120 H120 K8 Mo48 N84 O272 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0719","0.0608","","","0.1457","0.1516","","","","","","1.051","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214043","16.488","0.0007","14.4729","0.0006","33.9442","0.0013","90","","99.196","0.002","90","","7996","0.6","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H62 K2 Mo12 N21 O78 P -","- C30 H30 K2 Mo12 N21 O69 P -","- C120 H120 K8 Mo48 N84 O276 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0756","0.0557","","","0.1388","0.1497","","","","","","1.065","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214044","16.536","0.002","14.4599","0.0018","33.916","0.004","90","","99.14","0.004","90","","8006.7","1.7","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H62 K2 Mo12 N21 O78 P -","- C30 H30 K2 Mo12 N21 O67 P -","- C120 H120 K8 Mo48 N84 O268 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0749","0.0531","","","0.1381","0.152","","","","","","1.093","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214045","16.5232","0.0015","14.4587","0.0012","33.985","0.003","90","","99.026","0.003","90","","8018.6","1.2","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 K2 Mo12 N20 O76 P -","- C30 H30 K2 Mo12 N20 O65 P -","- C120 H120 K8 Mo48 N80 O260 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.1025","0.0688","","","0.193","0.2092","","","","","","1.077","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214046","16.622","0.002","14.5029","0.0019","33.98","0.005","90","","98.924","0.004","90","","8092.3","1.9","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H61 K2 Mo12 N20 O75 P -","- C30 H30 K2 Mo12 N20 O65 P -","- C120 H120 K8 Mo48 N80 O260 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0561","0.0489","","","0.1439","0.1482","","","","","","1.094","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214047","16.543","0.002","14.4575","0.0018","33.922","0.004","90","","99.052","0.004","90","","8012.1","1.7","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H61 K2 Mo12 N20 O75 P -","- C30 H30 K2 Mo12 N20 O67 P -","- C120 H120 K8 Mo48 N80 O268 P4 -","4","0.5","","Han, Bao-Xia; Wang, Chuan-Zeng; Chen, Kai; Xiao, Xin; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang","Coordination and supramolecular assemblies of K+/Ln3+ to perhydroxycucurbit[5]uril in the presence of [PMo12O40]3−: potential application in isolation of light lanthanides","CrystEngComm","2014","16","9","1615","","10.1039/c3ce42063a","","","0.71073","MoKα","","0.0842","0.0649","","","0.1967","0.219","","","","","","1.077","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214048","14.812","0.006","13.727","0.005","14.452","0.005","90","","112.457","0.006","90","","2715.6","1.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20 Co F6 N2 O4 -","- C29 H20 Co F6 N2 O4 -","- C116 H80 Co4 F24 N8 O16 -","4","1","","Han, Li-Wei; Lü, Jian; Lin, Zu-Jin; Cao, Rong","Cobalt-cluster-based coordination polymers with size-matching mixed ligands","CrystEngComm","2014","16","9","1749","","10.1039/c3ce42110d","","","0.71073","MoKα","","0.0604","0.0481","","","0.0897","0.0958","","","","","","1.112","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214049","13.336","0.006","24.714","0.01","14.403","0.006","90","","112.42","0.007","90","","4388","3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C92 H58 Co3 F24 N4 O16 -","- C92 H58 Co3 F24 N4 O16 -","- C184 H116 Co6 F48 N8 O32 -","2","0.5","","Han, Li-Wei; Lü, Jian; Lin, Zu-Jin; Cao, Rong","Cobalt-cluster-based coordination polymers with size-matching mixed ligands","CrystEngComm","2014","16","9","1749","","10.1039/c3ce42110d","","","0.71073","MoKα","","0.0834","0.0644","","","0.1602","0.1745","","","","","","1.069","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214050","15.792","0.005","15.821","0.005","18.031","0.006","100.763","0.004","100.701","0.002","100.779","0.003","4233","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H94 Co5 F24 N8 O22 -","- C92 H56 Co5 F24 N4 O18 -","- C92 H56 Co5 F24 N4 O18 -","1","0.5","","Han, Li-Wei; Lü, Jian; Lin, Zu-Jin; Cao, Rong","Cobalt-cluster-based coordination polymers with size-matching mixed ligands","CrystEngComm","2014","16","9","1749","","10.1039/c3ce42110d","","","0.71073","MoKα","","0.0902","0.0702","","","0.1948","0.2067","","","","","","0.93","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214051","9.5231","0.001","10.2095","0.0011","11.7475","0.0013","105.625","0.001","91.665","0.001","106.879","0.001","1045.4","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H22 N6 O6 Zn -","- C17 H22 N6 O6 Zn -","- C34 H44 N12 O12 Zn2 -","2","1","","Han, Min-Le; Chang, Xin-Hong; Feng, Xun; Ma, Lu-Fang; Wang, Li-Ya","Temperature and pH driven self-assembly of Zn(ii) coordination polymers: crystal structures, supramolecular isomerism, and photoluminescence","CrystEngComm","2014","16","9","1687","","10.1039/c3ce41968a","","","0.71073","MoKα","","0.0369","0.0302","","","0.0734","0.077","","","","","","1.062","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214052","16.879","0.004","8.2185","0.0018","22.862","0.005","90","","92.936","0.002","90","","3167.3","1.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 N9 O8 Zn2 -","- C30 H30 N9 O8 Zn2 -","- C120 H120 N36 O32 Zn8 -","4","1","","Han, Min-Le; Chang, Xin-Hong; Feng, Xun; Ma, Lu-Fang; Wang, Li-Ya","Temperature and pH driven self-assembly of Zn(ii) coordination polymers: crystal structures, supramolecular isomerism, and photoluminescence","CrystEngComm","2014","16","9","1687","","10.1039/c3ce41968a","","","0.71073","MoKα","","0.0327","0.0254","","","0.0615","0.0648","","","","","","1.03","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214053","9.2209","0.0011","10.2628","0.0012","12.7492","0.0015","111.664","0.001","93.59","0.001","112.631","0.001","1005","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H18 N6 O6 Zn -","- C16 H18 N6 O6 Zn -","- C32 H36 N12 O12 Zn2 -","2","1","","Han, Min-Le; Chang, Xin-Hong; Feng, Xun; Ma, Lu-Fang; Wang, Li-Ya","Temperature and pH driven self-assembly of Zn(ii) coordination polymers: crystal structures, supramolecular isomerism, and photoluminescence","CrystEngComm","2014","16","9","1687","","10.1039/c3ce41968a","","","0.71073","MoKα","","0.0526","0.0454","","","0.1462","0.1526","","","","","","1.113","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214054","17.257","0.004","10.829","0.003","17.134","0.004","90","","101.765","0.003","90","","3134.7","1.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H30 N6 O14 Zn2 -","- C25 H30 N6 O14 Zn2 -","- C100 H120 N24 O56 Zn8 -","4","0.5","","Han, Min-Le; Chang, Xin-Hong; Feng, Xun; Ma, Lu-Fang; Wang, Li-Ya","Temperature and pH driven self-assembly of Zn(ii) coordination polymers: crystal structures, supramolecular isomerism, and photoluminescence","CrystEngComm","2014","16","9","1687","","10.1039/c3ce41968a","","","0.71073","MoKα","","0.0507","0.036","","","0.0858","0.0946","","","","","","1.041","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214055","18.004","0.005","9.661","0.003","19.023","0.005","90","","112.238","0.003","90","","3062.7","1.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H30 N6 O14 Zn2 -","- C25 H30 N6 O14 Zn2 -","- C100 H120 N24 O56 Zn8 -","4","0.5","","Han, Min-Le; Chang, Xin-Hong; Feng, Xun; Ma, Lu-Fang; Wang, Li-Ya","Temperature and pH driven self-assembly of Zn(ii) coordination polymers: crystal structures, supramolecular isomerism, and photoluminescence","CrystEngComm","2014","16","9","1687","","10.1039/c3ce41968a","","","0.71073","MoKα","","0.0407","0.0305","","","0.0714","0.0774","","","","","","0.95","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214056","20.682","0.003","10.4091","0.0013","19.858","0.003","90","","118.104","0.003","90","","3771","0.9","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H15 Cd N7 O8 -","- C14 H15 Cd N7 O8 -","- C112 H120 Cd8 N56 O64 -","8","1","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.71075","MoKα","","0.0581","0.0411","","","0.0855","0.0936","","","","","","1.021","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214057","21.049","0.004","10.4209","0.0017","20.232","0.004","90","","120.052","0.004","90","","3841.3","1.2","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H15 Cd I N6 O6 -","- C14 H15 Cd I N6 O6 -","- C112 H120 Cd8 I8 N48 O48 -","8","1","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.71075","MoKα","","0.0847","0.0538","","","0.1443","0.1615","","","","","","1.066","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214058","7.6185","0.0004","9.5814","0.0014","10.5272","0.0016","85.45","0.02","69.833","0.014","70.509","0.013","679.44","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H12 Cd N3 O7 -","- C11 H12 Cd N3 O7 -","- C22 H24 Cd2 N6 O14 -","2","1","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.7107","MoKα","","0.0277","0.0247","","","0.0645","0.0665","","","","","","1.019","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214059","13.2282","0.0016","14.3543","0.0016","16.899","0.002","90","","100.845","0.003","90","","3151.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H32 Cd N12 O13 S -","- C20 H31 Cd N12 O13 S -","- C80 H124 Cd4 N48 O52 S4 -","4","1","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.7107","MoKα","","0.0468","0.0395","","","0.0935","0.0976","","","","","","1.075","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214060","9.5996","0.001","9.7638","0.0014","9.866","0.0017","88.15","0.017","77.431","0.015","64.293","0.01","811.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H14 Cd N3 O7 -","- C11 H10 Cd N3 O7 -","- C22 H20 Cd2 N6 O14 -","2","1","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.7107","MoKα","","0.0398","0.0372","","","0.1127","0.1151","","","","","","1.083","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214061","11.014","0.002","10.8512","0.0018","17.237","0.004","90","","106.171","0.005","90","","1978.6","0.7","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H44 Cd2 N12 O21 -","- C22 H36 Cd2 N12 O21 -","- C44 H72 Cd4 N24 O42 -","2","0.5","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.71075","MoKα","","0.0663","0.0511","","","0.1328","0.1434","","","","","","1.053","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214062","19.6725","0.0014","10.3235","0.0007","10.5318","0.0007","90","","90","","90","","2138.9","0.3","223","2","223","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C20 H16 Cd N6 O6 -","- C20 H16 Cd N6 O6 -","- C80 H64 Cd4 N24 O24 -","4","0.5","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.71075","MoKα","","0.0422","0.0358","","","0.0925","0.0969","","","","","","1.084","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214063","8.0884","0.0014","9.9983","0.0019","10.646","0.002","113.859","0.003","95.105","0.002","91.085","0.002","782.8","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H13 Cd N4 O9 -","- C11 H13 Cd N4 O9 -","- C22 H26 Cd2 N8 O18 -","2","1","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.71075","MoKα","","0.0241","0.0208","","","0.0435","0.044","","","","","","0.995","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214064","8.891","0.003","9.658","0.003","13.359","0.004","100.128","0.004","90.511","0.003","116.456","0.004","1006","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H30 Cd3 N12 O18 S2 -","- C28 H30 Cd3 N12 O18 S2 -","- C28 H30 Cd3 N12 O18 S2 -","1","0.5","","Ding, Jian-Gang; Zhu, Xia; Cui, Yan-Feng; Liang, Na; Sun, Peng-Peng; Chen, Qian; Li, Bao-Long; Li, Hai-Yan","Structurally versatile cadmium coordination polymers based on bis(1,2,4-triazol)ethane and rigid aromatic multicarboxylates: syntheses, structures and properties","CrystEngComm","2014","16","9","1632","","10.1039/c3ce42189a","","","0.7107","MoKα","","0.035","0.029","","","0.0672","0.0759","","","","","","1.031","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214065","4.3006","0.0012","12.286","0.004","21.406","0.006","90","","90","","90","","1131","0.6","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H10 F3 N O2 S -","- C10 H10 F3 N O2 S -","- C40 H40 F12 N4 O8 S4 -","4","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0422","0.0371","","","0.0862","0.0892","","","","","","1.052","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214066","9.359","0.003","19.512","0.006","18.547","0.006","90","","90","","90","","3386.9","1.9","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C17 H17 F3 N2 S -","- C17 H17 F3 N2 S -","- C136 H136 F24 N16 S8 -","8","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.074","0.0531","","","0.1321","0.1462","","","","","","1.033","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214067","6.9316","0.0002","15.6631","0.0005","10.342","0.0003","90","","100.871","0.0018","90","","1102.68","0.06","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N2 S -","- C13 H10 N2 S -","- C52 H40 N8 S4 -","4","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0509","0.0389","","","0.0995","0.1068","","","","","","1.052","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214068","6.2054","0.0002","11.0782","0.0004","15.7022","0.0004","79.262","0.0018","81.6799","0.0018","81.0105","0.001","1040.06","0.06","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H9 N3 S -","- C12 H9 N3 S -","- C48 H36 N12 S4 -","4","2","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0439","0.0382","","","0.0991","0.1047","","","","","","1.041","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214069","4.8958","0.0002","13.2251","0.0006","15.7846","0.0008","90","","90","","90","","1022.01","0.08","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H9 N3 S -","- C12 H9 N3 S -","- C48 H36 N12 S4 -","4","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0547","0.0451","","","0.1031","0.1102","","","","","","1.095","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214070","15.6603","0.0003","7.402","0.0001","18.6797","0.0003","90","","106.78","0.0009","90","","2073.11","0.06","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 N3 S -","- C12 H9 N3 S -","- C96 H72 N24 S8 -","8","2","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0489","0.0376","","","0.0946","0.1023","","","","","","1.026","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214071","9.6844","0.0006","10.0511","0.0006","21.3621","0.0014","90","","90","","90","","2079.4","0.2","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H8 N2 S2 -","- C11 H8 N2 S2 -","- C88 H64 N16 S16 -","8","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0438","0.042","","","0.1137","0.115","","","","","","1.128","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214072","7.4294","0.0003","12.5543","0.0006","12.7463","0.0005","90","","92.878","0.003","90","","1187.36","0.09","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 N3 O2 S -","- C13 H9 N3 O2 S -","- C52 H36 N12 O8 S4 -","4","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0937","0.0611","","","0.1316","0.151","","","","","","1.102","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214073","13.173","0.003","7.018","0.0014","14.651","0.003","90","","108.59","0.03","90","","1283.8","0.5","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H8 N4 O4 S -","- C13 H8 N4 O4 S -","- C52 H32 N16 O16 S4 -","4","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0446","0.0346","","","0.1027","0.1125","","","","","","1.023","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214074","24.399","0.005","5.254","0.0011","9.3849","0.0019","90","","95.68","0.03","90","","1197.2","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 N2 O S -","- C14 H12 N2 O S -","- C56 H48 N8 O4 S4 -","4","1","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.0941","0.0557","","","0.1344","0.1544","","","","","","0.984","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214075","14.857","0.002","13.0971","0.0019","26.97","0.004","90","","90.959","0.004","90","","5247.2","1.3","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H9 F3 N2 S -","- C14 H9 F3 N2 S -","- C224 H144 F48 N32 S16 -","16","4","","Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M.","Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines","CrystEngComm","2014","16","9","1755","","10.1039/c3ce42205d","","","0.71073","MoKα","","0.1131","0.1056","","","0.3009","0.3112","","","","","","1.098","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214076","6.3326","0.0003","13.4313","0.0008","14.9364","0.0008","72.429","0.002","79.14","0.002","89.112","0.002","1188.29","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H23 F2 N5 O2 S -","- C26 H23 F2 N5 O2 S -","- C52 H46 F4 N10 O4 S2 -","2","1","","Shukla, Rahul; Mohan, T. P.; Vishalakshi, B.; Chopra, Deepak","Experimental and theoretical analysis of lp⋯π intermolecular interactions in derivatives of 1,2,4-triazoles","CrystEngComm","2014","16","9","1702","","10.1039/c3ce42286k","","","0.71073","MoKα","","0.0748","0.0636","","","0.1325","0.1383","","","","","","1.149","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214077","6.203","0.0005","13.8341","0.0012","15.109","0.0014","71.303","0.004","80.718","0.004","88.344","0.004","1211.68","0.19","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H23 Cl F N5 O2 S -","- C26 H23 Cl F N5 O2 S -","- C52 H46 Cl2 F2 N10 O4 S2 -","2","1","","Shukla, Rahul; Mohan, T. P.; Vishalakshi, B.; Chopra, Deepak","Experimental and theoretical analysis of lp⋯π intermolecular interactions in derivatives of 1,2,4-triazoles","CrystEngComm","2014","16","9","1702","","10.1039/c3ce42286k","","","0.71073","MoKα","","0.0369","0.0347","","","0.0936","0.0958","","","","","","1.048","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214078","6.5674","0.0008","13.5041","0.0017","16.236","0.002","71.902","0.006","86.12","0.006","89.592","0.006","1365.4","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C29.5 H27 Cl F N5 O2 S -","- C29.5 H27 Cl F N5 O2 S -","- C59 H54 Cl2 F2 N10 O4 S2 -","2","1","","Shukla, Rahul; Mohan, T. P.; Vishalakshi, B.; Chopra, Deepak","Experimental and theoretical analysis of lp⋯π intermolecular interactions in derivatives of 1,2,4-triazoles","CrystEngComm","2014","16","9","1702","","10.1039/c3ce42286k","","","0.71073","MoKα","","0.0462","0.0427","","","0.1108","0.1135","","","","","","1.046","","","","has coordinates,has disorder","288505","2023-12-22","15:12:04",""
"7214079","13.2318","0.0004","24.2575","0.0008","14.1063","0.0005","90","","112.851","0.004","90","","4172.4","0.3","123.01","0.1","123.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NH4[Gd(cdm)4(H2O)4].18c6.3H2O","","","- C28 H50 Gd N13 O17 -","- C28 H50 Gd N13 O17 -","- C112 H200 Gd4 N52 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","","0.7107","MoKα","","0.0386","0.0277","","","0.0563","0.0602","","","","","","1.088","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214080","13.2276","0.0005","24.22","0.0008","14.1006","0.0005","90","","112.907","0.004","90","","4161.2","0.3","123.1","0.4","123.1","0.4","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NH4[Dy(cdm)4(H2O)4].18c6.3H2O","","","- C28 H50 Dy N13 O17 -","- C28 H50 Dy N13 O17 -","- C112 H200 Dy4 N52 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","","0.7107","MoKα","","0.0514","0.0373","","","0.0727","0.0799","","","","","","1.109","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214081","13.2104","0.0006","24.2021","0.0012","14.089","0.0007","90","","112.9","0.001","90","","4149.5","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NH4[Er(cdm)4(H2O)4].18c6.3H2O","","","- C28 H50 Er N13 O17 -","- C28 H50 Er N13 O17 -","- C112 H200 Er4 N52 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","","0.71073","MoKα","","0.0402","0.0304","","","0.0615","0.0653","","","","","","1.001","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214082","13.3165","0.0004","24.168","0.0006","14.0333","0.0004","90","","112.917","0.004","90","","4159.9","0.2","123.1","0.4","123.1","0.4","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Gd(cdm)4(H2O)4][K(18c6)(H2O)2].H2O","","","- C28 H46 Gd K N12 O17 -","- C28 H46 Gd K N12 O17 -","- C112 H184 Gd4 K4 N48 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","","0.7107","MoKα","","0.0398","0.0292","","","0.0593","0.0644","","","","","","1.044","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214083","13.2831","0.0006","24.0971","0.0012","13.996","0.0006","90","","112.895","0.001","90","","4127","0.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Dy(cdm)4(H2O)4][K(18c6)(H2O)2].H2O","","","- C28 H46 Dy K N12 O17 -","- C28 H46 Dy K N12 O17 -","- C112 H184 Dy4 K4 N48 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","","0.71073","MoKα","","0.0309","0.0257","","","0.0547","0.057","","","","","","1.04","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214084","13.2705","0.0008","24.0464","0.0014","13.9735","0.0008","90","","112.89","0.002","90","","4107.9","0.4","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Er(cdm)4(H2O)4][K(18c6)(H2O)2].H2O","","","- C28 H46 Er K N12 O17 -","- C28 H46 Er K N12 O17 -","- C112 H184 Er4 K4 N48 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","","0.71073","MoKα","","0.0317","0.0267","","","0.057","0.059","","","","","","1.028","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214085","13.2276","0.0005","24.22","0.0008","14.1006","0.0005","90","","112.907","0.004","90","","4161.2","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NH4[Dy(cdm)4(H2O)4].18c6.3H2O","","","- C28 H50 Dy N13 O17 -","- C28 H50 Dy N13 O17 -","- C112 H200 Dy4 N52 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","neutron","","neutron","","0.106","0.075","","","0.2014","0.215","","","","","","1.675","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214086","13.2831","0.0006","24.0971","0.0012","13.996","0.0006","90","","112.895","0.001","90","","4127","0.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[K(18c6)(H2O)2][Dy(cdm)4(H2O)4].H2O","","","- C28 H46 Dy K N12 O17 -","- C28 H46 Dy K N12 O17 -","- C112 H184 Dy4 K4 N48 O68 -","4","1","","Emerson, Adrian J.; Edwards, Alison J.; Batten, Stuart R.; Turner, David R.","A neutron diffraction study of hydrogen bonding in isostructural potassium and ammonium lanthanoidates","CrystEngComm","2014","16","9","1625","","10.1039/c3ce42031k","","neutron","","neutron","","0.127","0.0929","","","0.2469","0.2604","","","","","","2.002","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214087","21.54","0.02","25.71","0.015","31.95","0.01","90.92","0.04","88.87","0.02","74.53","0.02","17045","2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C336 H508 N4 O28 -","- C336 H508 N4 O28 -","- C672 H1016 N8 O56 -","2","1","","Brancatelli, Giovanna; Pappalardo, Sebastiano; Gattuso, Giuseppe; Notti, Anna; Pisagatti, Ilenia; Parisi, Melchiorre F.; Geremia, Silvano","Hydrogen bond-assisted solid-state formation of a salt-bridged calix[5]arene pseudo-dimer","CrystEngComm","2014","16","1","89","","10.1039/c3ce41667d","","","0.77491","","","0.1352","0.1276","","","0.3302","0.3342","","","","","","1.047","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214088","12.4824","0.0012","7.3041","0.0007","15.4872","0.0016","90","","97.536","0.003","90","","1399.8","0.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","TW-6-27 pyridine N-oxide, 1,3,5-F3-2,4,6-I3-benzene","","- C11 H5 F3 I3 N O -","- C11 H5 F3 I3 N O -","- C44 H20 F12 I12 N4 O4 -","4","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Constructing molecular polygons using halogen bonding and bifurcated N-oxides","CrystEngComm","2014","16","1","28","","10.1039/c3ce41887a","","","0.71073","MoKα","","0.0267","0.0249","","","0.0578","0.0586","","","","","","1.21","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214089","7.94","0.0005","8.5688","0.0006","11.5503","0.0008","89.243","0.002","83.738","0.002","65.57","0.002","710.77","0.08","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","TW-6-33 4-methylpyridine-N-oxide, 1,2-diiodotetrafluorobenzene","","- C12 H7 F4 I2 N O -","- C12 H7 F4 I2 N O -","- C24 H14 F8 I4 N2 O2 -","2","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Constructing molecular polygons using halogen bonding and bifurcated N-oxides","CrystEngComm","2014","16","1","28","","10.1039/c3ce41887a","","","0.71073","MoKα","","0.0307","0.0288","","","0.0753","0.0768","","","","","","1.089","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214090","7.8713","0.0009","23.203","0.003","7.8169","0.0009","90","","92.019","0.004","90","","1426.8","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","TW-6-37 3-methylpyridine-N-oxide, 1,2-diiodotetrafluorobenzene","","- C12 H7 F4 I2 N O -","- C12 H7 F4 I2 N O -","- C48 H28 F16 I8 N4 O4 -","4","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Constructing molecular polygons using halogen bonding and bifurcated N-oxides","CrystEngComm","2014","16","1","28","","10.1039/c3ce41887a","","","0.71073","MoKα","","0.0235","0.0221","","","0.0499","0.0505","","","","","","1.186","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214091","14.1359","0.0014","15.1116","0.0015","24.361","0.003","90","","105.927","0.003","90","","5004.1","0.9","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","TW-6-13 (2,3,5,6-Me4-pyrazine-1,4-dioxide)2, (1,2-I2-F4-benzene)4","","- C40 H24 F16 I8 N4 O4 -","- C40 H24 F16 I8 N4 O4 -","- C160 H96 F64 I32 N16 O16 -","4","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Constructing molecular polygons using halogen bonding and bifurcated N-oxides","CrystEngComm","2014","16","1","28","","10.1039/c3ce41887a","","","0.71073","MoKα","","0.0386","0.0341","","","0.0793","0.0816","","","","","","1.025","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214092","7.966","0.0006","9.2821","0.0007","10.1097","0.0008","100.812","0.003","106.262","0.002","95.408","0.003","696.29","0.09","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","TW-6-15 2,3,5,6-Me4-pyridine-1,4-dioxide, (1,3,5-F3-2,4,6-I3-benzene)2","","- C20 H12 F6 I6 N2 O2 -","- C20 H12 F6 I6 N2 O2 -","- C20 H12 F6 I6 N2 O2 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Constructing molecular polygons using halogen bonding and bifurcated N-oxides","CrystEngComm","2014","16","1","28","","10.1039/c3ce41887a","","","0.71073","MoKα","","0.022","0.0204","","","0.0522","0.053","","","","","","1.133","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214093","10.5781","0.0014","11.0107","0.0014","11.389","0.003","101.089","0.002","109.288","0.002","108.473","0.001","1120.3","0.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C8 H14 Ag8 Mo8 N16 O28 S4 -","- C8 H12 Ag8 Mo8 N16 O28 S4 -","- C8 H12 Ag8 Mo8 N16 O28 S4 -","1","0.5","","Xu, Xiao; Ju, Weiwei; Hou, Wentao; Zhu, Dunru; Xu, Yan","Two octamolybdate-based complexes: hydrothermal synthesis, structural characterization and properties","CrystEngComm","2014","16","1","82","","10.1039/c3ce41706a","","","0.71073","MoKα","","0.0424","0.0323","","","0.0714","0.075","","","","","","1.09","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214094","9.982","0.002","11.711","0.004","13.987","0.002","72.133","0.003","74.511","0.002","78.879","0.002","1488.7","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C2.77 H3.23 Ag0.31 Mo0.62 N1.38 O2 -","- C2.76923 H3.23077 Ag0.307692 Mo0.615385 N1.38462 O2 -","- C36 H42 Ag4 Mo8 N18 O26 -","13","6.5","","Xu, Xiao; Ju, Weiwei; Hou, Wentao; Zhu, Dunru; Xu, Yan","Two octamolybdate-based complexes: hydrothermal synthesis, structural characterization and properties","CrystEngComm","2014","16","1","82","","10.1039/c3ce41706a","","","0.71073","MoKα","","0.0718","0.0503","","","0.1457","0.1627","","","","","","1.089","","","","has coordinates,has disorder","180471","2020-10-21","18:00:00",""
"7214095","9.6707","0.0007","12.307","0.0007","14.5432","0.0012","85.266","0.002","74.549","0.005","82.829","0.006","1653.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H38 N6 O8 S -","- C31 H38 N6 O8 S -","- C62 H76 N12 O16 S2 -","2","1","","Žegarac, Miroslav; Lekšić, Edislav; Šket, Primož; Plavec, Janez; Devčić Bogdanović, Maja; Bučar, Dejan-Krešimir; Dumić, Miljenko; Meštrović, Ernest","A sildenafil cocrystal based on acetylsalicylic acid exhibits an enhanced intrinsic dissolution rate","CrystEngComm","2014","16","1","32","","10.1039/c3ce42013b","","","1.54184","CuKα","","0.187","0.1244","","","0.3147","0.3654","","","","","","1.12","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214096","17.0111","0.0011","17.6763","0.0012","20.7596","0.0015","70.129","0.001","70.393","0.001","89.545","0.001","5490.4","0.7","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H40 Cu1.5 N6 O33 S4 -","- C58 H40 Cu1.5 N6 O33 S4 -","- C116 H80 Cu3 N12 O66 S8 -","2","1","","Zheng, Guo-Li; Yang, Guo-Cheng; Song, Shu-Yan; Song, Xue-Zhi; Zhang, Hong-Jie","Constructing porous MOF based on the assembly of layer framework and p-sulfonatocalix[4]arene nanocapsule with proton-conductive property","CrystEngComm","2014","16","1","64","","10.1039/c2ce26075a","","","0.71073","MoKα","","0.1306","0.0929","","","0.2537","0.2774","","","","","","0.961","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214097","17.778","0.0013","17.778","0.0013","18.6529","0.0013","90","","90","","120","","5105.6","0.6","210","2","210","2","","","","","","","","5","R -3 :H","-R 3","148","","(2-methyl-imidazolate-4-amide-5-imidato)-cobalt(II) dimethylformamide solvate","","- C7.5 H9.5 Co N4.5 O2.5 -","- C6 H6 Co N4 O2 -","- C108 H108 Co18 N72 O36 -","18","1","","Mondal, Suvendu Sekhar; Bhunia, Asamanjoy; Demeshko, Serhiy; Kelling, Alexandra; Schilde, Uwe; Janiak, Christoph; Holdt, Hans-Jürgen","Synthesis of a Co(ii)‒imidazolate framework from an anionic linker precursor: gas-sorption and magnetic properties","CrystEngComm","2014","16","1","39","","10.1039/c3ce42040j","","","0.71073","MoKα","","0.0772","0.0482","","","0.1142","0.1245","","","","","","0.984","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214098","10.584","0.002","11.362","0.002","15.896","0.003","107.23","0.03","92.05","0.03","109.7","0.03","1699.3","0.8","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H60 Cd2 Cl4 N4 O8 -","- C80 H60 Cd2 Cl4 N4 O8 -","- C80 H60 Cd2 Cl4 N4 O8 -","1","0.5","","Liu, Dong; Lang, Jian-Ping","Regiospecific photodimerization reactions of an unsymmetrical alkene in two coordination compounds","CrystEngComm","2014","16","1","76","","10.1039/c3ce41609g","","","0.71073","MoKα","","0.0456","0.0371","","","0.0837","0.0868","","","","","","0.974","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214099","8.7925","0.0018","11.978","0.002","14.391","0.003","89.67","0.03","74.91","0.03","81.01","0.03","1444.4","0.5","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H46 Cd2 N6 O28 -","- C58 H46 Cd2 N6 O28 -","- C58 H46 Cd2 N6 O28 -","1","0.5","","Liu, Dong; Lang, Jian-Ping","Regiospecific photodimerization reactions of an unsymmetrical alkene in two coordination compounds","CrystEngComm","2014","16","1","76","","10.1039/c3ce41609g","","","0.71073","MoKα","","0.0316","0.0281","","","0.0647","0.0658","","","","","","0.99","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7214100","18.423","0.005","18.423","0.005","26.934","0.007","90","","90","","120","","7917","4","173","2","173","2","","","","","","","","6","P 63 2 2","P 6c 2c","182","","","","- C120 H180 Co6 N6 O50 Zr6 -","- C120 H180 Co6 N6 O50 Zr6 -","- C240 H360 Co12 N12 O100 Zr12 -","2","0.166667","","Malaestean, Iurie L.; Alıcı, Meliha Kutluca; Besson, Claire; Ellern, Arkady; Kögerler, Paul","Solid-state coexistence of {Zr12} and {Zr6} zirconium oxocarboxylate clusters","CrystEngComm","2014","16","1","43","","10.1039/c3ce41829d","","","0.71073","MoKα","","0.0855","0.085","","","0.2102","0.2106","","","","","","1.232","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214101","36.819","0.004","31.046","0.003","28.384","0.005","90","","123.688","0.001","90","","26997","6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C174 H287 Co8 N21 O119 Zr18 -","- C174 H287 Co8 N21 O119 Zr18 -","- C696 H1148 Co32 N84 O476 Zr72 -","4","0.5","","Malaestean, Iurie L.; Alıcı, Meliha Kutluca; Besson, Claire; Ellern, Arkady; Kögerler, Paul","Solid-state coexistence of {Zr12} and {Zr6} zirconium oxocarboxylate clusters","CrystEngComm","2014","16","1","43","","10.1039/c3ce41829d","","","0.71073","MoKα","","0.1198","0.0752","","","0.1916","0.2613","","","","","","1.1","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214102","19.098","0.004","19.098","0.004","16.333","0.003","90","","90","","120","","5159.1","1.8","150","2","150","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- C39 H74 N3 O16 P3 -","- C39 H69 N3 O16 P3 -","- C156 H276 N12 O64 P12 -","4","0.333333","","Kalita, Alok Ch.; Sharma, Kamna; Murugavel, Ramaswamy","Pseudopolymorphism leading and two different supramolecular aggregations in a phosphate monoester: role of a rare water-dimer","CrystEngComm","2014","16","1","51","","10.1039/c3ce40912k","","","0.71075","MoKα","","0.0645","0.0638","","","0.1783","0.179","","","","","","1.084","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214103","11.946","0.005","11.952","0.005","12.21","0.005","116.916","0.007","90.454","0.004","92.865","0.007","1551.6","1.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H24 N O5 P -","- C13 H24 N O5 P -","- C52 H96 N4 O20 P4 -","4","2","","Kalita, Alok Ch.; Sharma, Kamna; Murugavel, Ramaswamy","Pseudopolymorphism leading and two different supramolecular aggregations in a phosphate monoester: role of a rare water-dimer","CrystEngComm","2014","16","1","51","","10.1039/c3ce40912k","","","0.71075","MoKα","","0.0654","0.049","","","0.1051","0.1131","","","","","","1.058","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214104","19.394","0.016","35.68","0.03","15.18","0.011","90","","90.311","0.015","90","","10504","15","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H20.66667 N O4.33333 P -","- C12 H19 N O4.33333 P -","- C288 H456 N24 O104 P24 -","24","3","","Kalita, Alok Ch.; Sharma, Kamna; Murugavel, Ramaswamy","Pseudopolymorphism leading and two different supramolecular aggregations in a phosphate monoester: role of a rare water-dimer","CrystEngComm","2014","16","1","51","","10.1039/c3ce40912k","","","0.71075","MoKα","","0.1435","0.1331","","","0.2882","0.2947","","","","","","1.241","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214105","29.37","0.006","20.998","0.003","27.36","0.004","90","","90","","90","","16873","5","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C24 H12 Cd1.81 Na0.69 O12 -","- C24 H12 Cd1.84 Na0.66 O12 -","- C384 H192 Cd29.44 Na10.56 O192 -","16","1","","Luo, Yu-Hui; Yu, Xiao-Yang; Yang, Jia-Jun; Zhang, Hong","An eight-connected porous metal‒organic framework based on hetero pentanuclear clusters","CrystEngComm","2014","16","1","47","","10.1039/c3ce41785a","","","0.71073","MoKα","","0.1016","0.0746","","","0.1961","0.2174","","","","","","0.991","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214106","10.477","0.0004","23.0584","0.001","22.7761","0.0009","90","","99.028","0.002","90","","5434.2","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C62 H56 N6 Ni S2 -","- C62 H56 N6 Ni S2 -","- C248 H224 N24 Ni4 S8 -","4","1","","Lusi, Matteo; Barbour, Leonard J.","Temperature-dependent guest reorientation: a reversible order‒disorder transformation in a single crystal","CrystEngComm","2014","16","1","36","","10.1039/c3ce41572d","","","0.71073","MoKα","","0.082","0.0466","","","0.102","0.1159","","","","","","1.03","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214107","10.477","0.0004","23.0584","0.001","22.7761","0.0009","90","","99.028","0.002","90","","5434.2","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","173D","","","- C62 H56 N6 Ni S2 -","- C62 H56 N6 Ni S2 -","- C248 H224 N24 Ni4 S8 -","4","1","","Lusi, Matteo; Barbour, Leonard J.","Temperature-dependent guest reorientation: a reversible order‒disorder transformation in a single crystal","CrystEngComm","2014","16","1","36","","10.1039/c3ce41572d","","","0.71073","MoKα","","0.1131","0.0572","","","0.1402","0.1685","","","","","","0.965","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214108","10.5793","0.0002","23.1141","0.0004","22.866","0.0004","90","","99.516","0.001","90","","5514.5","0.17","243","2","243","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H56 N6 Ni S2 -","- C61.968 H55.96 N6 Ni S2 -","- C247.872 H223.84 N24 Ni4 S8 -","4","0.5","","Lusi, Matteo; Barbour, Leonard J.","Temperature-dependent guest reorientation: a reversible order‒disorder transformation in a single crystal","CrystEngComm","2014","16","1","36","","10.1039/c3ce41572d","","","0.71073","MoKα","","0.1116","0.0608","","","0.1572","0.1778","","","","","","0.912","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214109","10.6221","0.0007","23.1917","0.0016","23.0275","0.0015","90","","99.649","0.004","90","","5592.4","0.6","313","2","313","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C61.99 H55.99 N6 Ni S2 -","- C61.984 H55.98 N6 Ni S2 -","- C247.936 H223.92 N24 Ni4 S8 -","4","0.5","","Lusi, Matteo; Barbour, Leonard J.","Temperature-dependent guest reorientation: a reversible order‒disorder transformation in a single crystal","CrystEngComm","2014","16","1","36","","10.1039/c3ce41572d","","","0.71073","MoKα","","0.1347","0.058","","","0.1517","0.1847","","","","","","1.018","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214110","11.0368","0.0005","8.6083","0.0004","12.0762","0.0006","90","","109.049","0.005","90","","1084.51","0.09","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","Celecoxib-2-Pyrrolidinone","","","- C21 H21 F3 N4 O3 S -","- C21 H21 F3 N4 O3 S -","- C42 H42 F6 N8 O6 S2 -","2","1","","Bolla, Geetha; Mittapalli, Sudhir; Nangia, Ashwini","Celecoxib cocrystal polymorphs with cyclic amides: synthons of a sulfonamide drug with carboxamide coformers","CrystEngComm","2014","16","1","24","","10.1039/c3ce41885e","","","0.71073","MoKα","","0.0509","0.0435","","","0.1047","0.1109","","","","","","1.037","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214111","8.0409","0.0005","27.2426","0.0018","11.7927","0.0008","90","","105.806","0.007","90","","2485.6","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Celecoxib-Aza-2-cyclooctanone","","","- C24 H27 F3 N4 O3 S -","- C24 H27 F3 N4 O3 S -","- C96 H108 F12 N16 O12 S4 -","4","1","","Bolla, Geetha; Mittapalli, Sudhir; Nangia, Ashwini","Celecoxib cocrystal polymorphs with cyclic amides: synthons of a sulfonamide drug with carboxamide coformers","CrystEngComm","2014","16","1","24","","10.1039/c3ce41885e","","","0.71073","MoKα","","0.1211","0.076","","","0.2099","0.2281","","","","","","1.031","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214112","11.7189","0.0011","8.7409","0.0006","12.0503","0.001","90","","103.353","0.01","90","","1200.99","0.18","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","Celecoxib-Caprolactam","","","- C23 H25 F3 N4 O3 S -","- C23 H25 F3 N4 O3 S -","- C46 H50 F6 N8 O6 S2 -","2","1","","Bolla, Geetha; Mittapalli, Sudhir; Nangia, Ashwini","Celecoxib cocrystal polymorphs with cyclic amides: synthons of a sulfonamide drug with carboxamide coformers","CrystEngComm","2014","16","1","24","","10.1039/c3ce41885e","","","0.71073","MoKα","","0.0595","0.0544","","","0.1495","0.1559","","","","","","1.017","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214113","8.7346","0.0006","11.2689","0.001","12.2391","0.0009","81.622","0.007","87.56","0.006","73.363","0.007","1141.94","0.16","298","2","298","2","","","","","","","","6","P -1","-P 1","2","Celecoxib-Valerolactam-Form-I","","","- C22 H23 F3 N4 O3 S -","- C22 H23 F3 N4 O3 S -","- C44 H46 F6 N8 O6 S2 -","2","1","","Bolla, Geetha; Mittapalli, Sudhir; Nangia, Ashwini","Celecoxib cocrystal polymorphs with cyclic amides: synthons of a sulfonamide drug with carboxamide coformers","CrystEngComm","2014","16","1","24","","10.1039/c3ce41885e","","","0.71073","MoKα","","0.1207","0.0577","","","0.1078","0.1374","","","","","","0.953","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214114","22.591","0.002","8.6211","0.0008","23.814","0.002","90","","102.163","0.001","90","","4533.9","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Celecoxib-Valerolactam-Form-II","","","- C22 H23 F3 N4 O3 S -","- C22 H23 F3 N4 O3 S -","- C176 H184 F24 N32 O24 S8 -","8","2","","Bolla, Geetha; Mittapalli, Sudhir; Nangia, Ashwini","Celecoxib cocrystal polymorphs with cyclic amides: synthons of a sulfonamide drug with carboxamide coformers","CrystEngComm","2014","16","1","24","","10.1039/c3ce41885e","","","0.71073","MoKα","","0.0762","0.0618","","","0.1728","0.1878","","","","","","1.027","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214115","14.8501","0.0018","8.419","0.0011","17.761","0.002","90","","93.901","0.002","90","","2215.4","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Celecoxib-Valerolactam-Form-III","","","- C22 H23 F3 N4 O3 S -","- C22 H23 F3 N4 O3 S -","- C88 H92 F12 N16 O12 S4 -","4","1","","Bolla, Geetha; Mittapalli, Sudhir; Nangia, Ashwini","Celecoxib cocrystal polymorphs with cyclic amides: synthons of a sulfonamide drug with carboxamide coformers","CrystEngComm","2014","16","1","24","","10.1039/c3ce41885e","","","0.71073","MoKα","","0.0998","0.085","","","0.1802","0.1881","","","","","","1.234","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214137","13.2539","0.0016","4.4978","0.0005","15.1638","0.0018","90","","113.097","0.001","90","","831.51","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 N3 O2 -","- C8 H7 N3 O2 -","- C32 H28 N12 O8 -","4","1","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0581","0.0409","","","0.1062","0.1181","","","","","","1.045","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214138","7.5226","0.0005","8.9711","0.0006","9.9836","0.0006","108.789","0.001","96.883","0.001","96.573","0.001","624.8","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H32 Co N6 O14 -","- C16 H32 Co N6 O14 -","- C16 H32 Co N6 O14 -","1","0.5","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0381","0.0377","","","0.1135","0.1139","","","","","","1.236","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214139","7.6133","0.0007","9.0446","0.0009","9.8805","0.0009","109.078","0.001","97.01","0.001","96.388","0.001","629.85","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H32 N6 Ni O14 -","- C16 H32 N6 Ni O14 -","- C16 H32 N6 Ni O14 -","1","0.5","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0398","0.0354","","","0.1003","0.1043","","","","","","1.083","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214140","9.726","0.012","10.303","0.013","13.774","0.017","82.146","0.018","71.384","0.018","83.78","0.02","1293","3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H44 Cu2 N18 O14 -","- C48 H44 Cu2 N18 O14 -","- C48 H44 Cu2 N18 O14 -","1","0.5","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.1468","0.0571","","","0.0846","0.107","","","","","","1.009","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214141","6.9803","0.0001","8.0918","0.0001","9.3207","0.0001","70.662","0.001","74.329","0.001","74.113","0.001","468.351","0.011","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H8 Ag N3 O3 -","- C8 H8 Ag N3 O3 -","- C16 H16 Ag2 N6 O6 -","2","1","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0272","0.0245","","","0.059","0.061","","","","","","1.052","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214142","13.3029","0.001","15.8363","0.0012","8.052","0.0006","90","","93.003","0.001","90","","1694","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 N6 O5 Zn -","- C16 H14 N6 O5 Zn -","- C64 H56 N24 O20 Zn4 -","4","0.5","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0236","0.0219","","","0.0614","0.0625","","","","","","1.054","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214143","13.7012","0.0009","16.2853","0.001","7.9527","0.0005","90","","95.641","0.001","90","","1765.88","0.19","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 Cd N6 O5 -","- C16 H14 Cd N6 O5 -","- C64 H56 Cd4 N24 O20 -","4","0.5","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0179","0.0168","","","0.0461","0.047","","","","","","1.023","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214144","9.485","0.0009","10.5635","0.001","15.7452","0.0016","98.015","0.001","91.021","0.001","114.802","0.001","1413","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H21 Cu2 N9 O8 -","- C24 H21 Cu2 N9 O8 -","- C48 H42 Cu4 N18 O16 -","2","1","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0596","0.0457","","","0.1355","0.1465","","","","","","1.046","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214145","16.2735","0.0018","7.0113","0.0008","7.9722","0.0009","90","","90.037","0.001","90","","909.61","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Mn N6 O6 -","- C16 H16 Mn N6 O6 -","- C32 H32 Mn2 N12 O12 -","2","0.5","","Wang, Jin-Hua; Tang, Gui-Mei; Wang, Yong-Tao; Qin, Ting-Xiao; Ng, Seik Weng","Metal-directed assembly of coordination polymers with the versatile ligand 2-(1H-benzotriazol-1-yl) acetic acid: from discrete structures to two-dimensional networks","CrystEngComm","2014","16","13","2660","","10.1039/c3ce42099j","","","0.71073","MoKα","","0.0402","0.0312","","","0.0752","0.0866","","","","","","1.105","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214146","8.697","0.004","18.417","0.003","19.169","0.004","90","","107.498","0.013","90","","2928.3","1.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H13 N5 -","- C18 H13 N5 -","- C144 H104 N40 -","8","2","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.0763","0.0426","","","0.089","0.0997","","","","","","0.905","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214147","7.548","0.004","10.06","0.005","30.328","0.003","85.046","0.004","87.38","0.002","77.318","0.001","2237.5","1.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H45 N12 O15.5 Zn -","- C36 H30 N12 O15.5 Zn -","- C72 H60 N24 O31 Zn2 -","2","1","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.1422","0.1039","","","0.2595","0.2826","","","","","","1.102","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214148","11.642","0.003","10.284","0.005","19.916","0.003","90","","114.706","0.016","90","","2166.2","1.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C40 H46 N10 O11 Zn -","- C40 H36 N10 O11 Zn -","- C80 H72 N20 O22 Zn2 -","2","0.5","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.126","0.0553","","","0.1135","0.1351","","","","","","0.869","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214149","12.036","0.003","10.259","0.003","17.392","0.004","90","","103.406","0.004","90","","2089","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H44 Cd N12 O15 -","- C36 H26 Cd N12 O15 -","- C72 H52 Cd2 N24 O30 -","2","0.5","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.151","0.0965","","","0.265","0.293","","","","","","0.994","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214150","10.395","0.003","11.295","0.004","17.949","0.002","74.14","0.004","84.051","0.004","77.807","0.003","1979.1","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H40 Cd N10 O7 -","- C40 H31 Cd N10 O7 -","- C80 H62 Cd2 N20 O14 -","2","1","","Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min","A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties","CrystEngComm","2014","16","13","2754","","10.1039/c3ce41841c","","","0.71069","MoKα","","0.0996","0.0501","","","0.0971","0.1099","","","","","","0.853","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214151","9.1893","0.0003","26.0295","0.0008","12.8033","0.0004","90","","93.311","0.001","90","","3057.35","0.17","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Co3 N3 O17 -","- C25 H27 Co3 N3 O17 -","- C100 H108 Co12 N12 O68 -","4","1","","Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Su, Chong-Cheng; Hsu, Hui-Huan; Yang, Chen-I; Lu, Kuang-Lieh","An unusual cobalt(ii)-based single-walled metal‒organic nanotube","CrystEngComm","2014","16","13","2626","","10.1039/c3ce41952e","","","0.71073","MoKα","","0.0334","0.0271","","","0.0661","0.079","","","","","","1.105","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214152","19.0317","0.0008","7.4124","0.0004","26.3256","0.0012","90","","90.092","0.002","90","","3713.8","0.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 Co4 N4 O26 -","- C28 H32 Co4 N4 O26 -","- C112 H128 Co16 N16 O104 -","4","1","","Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Su, Chong-Cheng; Hsu, Hui-Huan; Yang, Chen-I; Lu, Kuang-Lieh","An unusual cobalt(ii)-based single-walled metal‒organic nanotube","CrystEngComm","2014","16","13","2626","","10.1039/c3ce41952e","","","0.71073","MoKα","","0.0283","0.0272","","","0.0671","0.068","","","","","","1.037","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214153","16.4253","0.0004","15.1866","0.0004","12.6499","0.0003","90","","101.602","0.001","90","","3090.98","0.13","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Co2 N6 O14 -","- C28 H34 Co2 N6 O14 -","- C112 H136 Co8 N24 O56 -","4","0.5","","Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Su, Chong-Cheng; Hsu, Hui-Huan; Yang, Chen-I; Lu, Kuang-Lieh","An unusual cobalt(ii)-based single-walled metal‒organic nanotube","CrystEngComm","2014","16","13","2626","","10.1039/c3ce41952e","","","0.71073","MoKα","","0.0399","0.0361","","","0.0908","0.0935","","","","","","0.997","","","","has coordinates,has disorder","180472","2020-10-21","18:00:00",""
"7214154","14.437","0.009","17.293","0.011","5.604","0.004","90","","90.202","0.008","90","","1399.1","1.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H18 N2 O8 P2 -","- C11 H18 N2 O8 P2 -","- C44 H72 N8 O32 P8 -","4","1","","Tian, Di; Xiong, Juan; Liang, Xi-chao; Deng, Jing; Yuan, Liang-jie; Chen, Shuo-ping","(AEDPH3)·(8-OQH)·(H2O): a yellow supramolecular plaster with ammonia adsorption and ammonia-induced discoloration properties","CrystEngComm","2014","16","13","2732","","10.1039/c3ce41940a","","","0.71073","MoKα","","0.1246","0.1117","","","0.3106","0.3306","","","","","","1.378","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214155","16.654","0.003","20.426","0.004","21.802","0.007","90","","128.991","0.018","90","","5764","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H49 Co3 N3 O23 S3 -","- C48 H38 Co3 N2 O22 S3 -","- C192 H152 Co12 N8 O88 S12 -","4","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.1238","0.0939","","","0.2407","0.2602","","","","","","1.118","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214156","25.087","0.004","25.087","0.004","15.026","0.003","90","","90","","90","","9457","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H15 Co2 N3 O9 S -","- C16 H10 Co2 N3 O8 S -","- C256 H160 Co32 N48 O128 S16 -","16","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0468","0.041","","","0.1055","0.1095","","","","","","1.119","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214157","25.37","0.01","25.37","0.01","15.204","0.003","90","","90","","90","","9786","6","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H16 Co2 N4 O9 S -","- C16 H11 Co2 N4 O8 S -","- C256 H176 Co32 N64 O128 S16 -","16","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.1506","0.1078","","","0.2408","0.2701","","","","","","1.149","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214158","23.564","0.005","7.1412","0.0014","32.254","0.007","90","","105.5","0.03","90","","5230","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H19 Co N3 O8.5 S2 -","- C24 H16 Co N3 O7 S2 -","- C192 H128 Co8 N24 O56 S16 -","8","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0825","0.0623","","","0.1252","0.1351","","","","","","1.142","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214159","12.248","0.002","22.262","0.005","7.1435","0.0014","90","","124.47","0.03","90","","1605.8","0.8","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C14 H13 Cu O8.5 S -","- C14 H8 Cu O7 S -","- C56 H32 Cu4 O28 S4 -","4","0.5","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0468","0.0409","","","0.095","0.0987","","","","","","1.07","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214160","24.344","0.003","24.344","0.003","15.067","0.003","90","","90","","90","","8929","2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H15 Cu2 N3 O9 S -","- C16 H10 Cu2 N3 O8 S -","- C256 H160 Cu32 N48 O128 S16 -","16","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0814","0.0722","","","0.1833","0.1913","","","","","","1.039","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214161","30.671","0.006","16.577","0.003","9.851","0.002","90","","90","","90","","5008.6","1.7","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C18 H15 N8 O6.5 S Zn2 -","- C18 H14 N8 O6 S Zn2 -","- C144 H112 N64 O48 S8 Zn16 -","8","1","","Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers","CrystEngComm","2014","16","13","2615","","10.1039/c3ce42366b","","","0.71073","MoKα","","0.0755","0.0505","","","0.1138","0.1252","","","","","","1.023","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214162","22.9377","0.0004","11.6666","0.0002","23.2743","0.0003","90","","110.939","0.001","90","","5817.01","0.17","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H24 Co2 N4 O4 -","- C36 H24 Co2 N4 O4 -","- C288 H192 Co16 N32 O32 -","8","1","","Zhang, Xiao-min; Li, Jian-qiang; Liu, Shu-juan; Luo, Ming-biao; Xu, Wen-yuan; Luo, Feng","Modulation of experimental conditions towards generation of a heterometallic Na2Co4 cluster or a homometallic Co4 cluster and ligand formed in situ","CrystEngComm","2014","16","13","2570","","10.1039/c3ce42466a","","","0.71073","MoKα","","0.04","0.0292","","","0.0723","0.0791","","","","","","1.047","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214163","13.2745","0.0008","13.8673","0.0007","14.0374","0.0008","68.967","0.003","62.873","0.004","68.017","0.003","2076.4","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C98 H68 Co4 N10 Na2 O10 -","- C98 H68 Co4 N10 Na2 O10 -","- C98 H68 Co4 N10 Na2 O10 -","1","0.5","","Zhang, Xiao-min; Li, Jian-qiang; Liu, Shu-juan; Luo, Ming-biao; Xu, Wen-yuan; Luo, Feng","Modulation of experimental conditions towards generation of a heterometallic Na2Co4 cluster or a homometallic Co4 cluster and ligand formed in situ","CrystEngComm","2014","16","13","2570","","10.1039/c3ce42466a","","","0.71073","MoKα","","0.0827","0.0441","","","0.0975","0.1171","","","","","","0.995","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7214164","8.792","0.004","11.024","0.005","16.479","0.007","84.58","0.007","85.459","0.007","78.893","0.007","1557.2","1.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H74 Mn4 N4 O26 -","- C58 H72 Mn4 N4 O25 -","- C58 H72 Mn4 N4 O25 -","1","0.5","","Liu, Fuling; Zhang, Liangliang; Wang, Rongming; Sun, Jie; Yang, Jie; Chen, Zhen; Wang, Xingpo; Sun, Daofeng","Five MOFs with different topologies based on anthracene functionalized tetracarboxylic acid: syntheses, structures, and properties","CrystEngComm","2014","16","14","2917","","10.1039/c3ce42152j","","","0.71073","MoKα","","0.1019","0.0659","","","0.1601","0.1833","","","","","","1.029","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214165","11.08","0.003","16.583","0.004","16.6","0.004","68.533","0.005","89.208","0.004","89.167","0.004","2838.1","1.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H42 N0 Ni2 O22 -","- C34 H30 Ni2 O16 -","- C68 H60 Ni4 O32 -","2","1","","Liu, Fuling; Zhang, Liangliang; Wang, Rongming; Sun, Jie; Yang, Jie; Chen, Zhen; Wang, Xingpo; Sun, Daofeng","Five MOFs with different topologies based on anthracene functionalized tetracarboxylic acid: syntheses, structures, and properties","CrystEngComm","2014","16","14","2917","","10.1039/c3ce42152j","","","0.71073","MoKα","","0.0844","0.0555","","","0.1564","0.1662","","","","","","0.956","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214166","15.4676","0.0017","13.1962","0.0015","26.497","0.003","90","","98.729","0.002","90","","5345.8","1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H66 Cd2 N4 O19 -","- C39 H35 Cd2 N O15 -","- C156 H140 Cd8 N4 O60 -","4","1","","Liu, Fuling; Zhang, Liangliang; Wang, Rongming; Sun, Jie; Yang, Jie; Chen, Zhen; Wang, Xingpo; Sun, Daofeng","Five MOFs with different topologies based on anthracene functionalized tetracarboxylic acid: syntheses, structures, and properties","CrystEngComm","2014","16","14","2917","","10.1039/c3ce42152j","","","0.71073","MoKα","","0.0551","0.0412","","","0.1128","0.1197","","","","","","1.033","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214167","10.168","0.003","18.035","0.005","27.054","0.008","90","","99.321","0.005","90","","4896","2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H57 Co2 N3 O19 -","- C34 H27 Co2 O14 -","- C136 H108 Co8 O56 -","4","1","","Liu, Fuling; Zhang, Liangliang; Wang, Rongming; Sun, Jie; Yang, Jie; Chen, Zhen; Wang, Xingpo; Sun, Daofeng","Five MOFs with different topologies based on anthracene functionalized tetracarboxylic acid: syntheses, structures, and properties","CrystEngComm","2014","16","14","2917","","10.1039/c3ce42152j","","","0.71073","MoKα","","0.0659","0.0525","","","0.1531","0.1599","","","","","","1.069","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214168","10.107","0.004","18.338","0.007","27.084","0.011","90","","99.285","0.008","90","","4954","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H56 N2 O20 Zn2 -","- C34 H26 O14 Zn2 -","- C136 H104 O56 Zn8 -","4","1","","Liu, Fuling; Zhang, Liangliang; Wang, Rongming; Sun, Jie; Yang, Jie; Chen, Zhen; Wang, Xingpo; Sun, Daofeng","Five MOFs with different topologies based on anthracene functionalized tetracarboxylic acid: syntheses, structures, and properties","CrystEngComm","2014","16","14","2917","","10.1039/c3ce42152j","","","0.71073","MoKα","","0.0896","0.0492","","","0.1216","0.1326","","","","","","0.86","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214169","8.047","0.002","8.016","0.002","12.733","0.004","90","","95.38","0.004","90","","817.7","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Ag N3 O4 -","- C6 H6 Ag N3 O4 -","- C24 H24 Ag4 N12 O16 -","4","1","","Zhao, Ya-Qin; Fang, Ming-Xiang; Xu, Zheng-Hu; Wang, Xing-Po; Wang, Su-Na; Han, Lu-Lu; Li, Xiao-Yu; Sun, Di","Construction of a crystalline Ag(i) coordination polymer based on a new ligand generated from unusual in situ aza-Michael addition reaction","CrystEngComm","2014","16","14","3015","","10.1039/c4ce00087k","","","0.71073","MoKα","","0.0285","0.026","","","0.0592","0.0604","","","","","","1.088","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214170","3.9061","0.0001","20.4757","0.0003","10.6097","0.0002","90","","98.436","0.001","90","","839.38","0.03","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 N4 S -","- C8 H6 N4 S -","- C32 H24 N16 S4 -","4","1","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.0589","0.0405","","","0.1071","0.1178","","","","","","1.091","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214171","19.181","0.004","11.579","0.003","12.642","0.003","90","","90","","90","","2807.7","1.1","293","2","293","2","","","","","","","","7","I m m a","-I 2b 2","74","","","","- C16 H12 Ag3 Cl3 N8 O12 S2 -","- C16 H12 Ag3 Cl3 N8 O12 S2 -","- C64 H48 Ag12 Cl12 N32 O48 S8 -","4","0.25","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.0676","0.0401","","","0.0929","0.1087","","","","","","1.05","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214172","22.2549","0.0004","9.4868","0.0002","15.7184","0.0003","90","","91.476","0.001","90","","3317.49","0.11","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C19 H12 Ag3 F9 N8 O9 S5 -","- C19 H12 Ag3 F9 N8 O9 S5 -","- C76 H48 Ag12 F36 N32 O36 S20 -","4","0.5","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.0396","0.0356","","","0.0964","0.0992","","","","","","1.063","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214173","11.135","0.005","12.38","0.006","14.607","0.007","84.662","0.012","89.537","0.011","67.261","0.01","1848.2","1.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H16 Ag3 F9 N8 O12 S5 -","- C19 H16 Ag3 F9 N8 O12 S5 -","- C38 H32 Ag6 F18 N16 O24 S10 -","2","1","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.1144","0.0588","","","0.1317","0.1583","","","","","","1.019","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214174","8.9469","0.0002","23.6973","0.0006","7.3859","0.0002","90","","108.4","0.002","90","","1485.88","0.07","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C8 H8 Ag2 N6 O7 S -","- C8 H8 Ag2 N6 O7 S -","- C32 H32 Ag8 N24 O28 S4 -","4","1","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.0325","0.028","","","0.061","0.064","","","","","","1.03","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214175","8.5705","0.0007","15.3195","0.0013","8.431","0.0006","90","","90","","90","","1106.95","0.15","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C8 H6 Ag N5 O2 S -","- C8 H6 Ag N5 O2 S -","- C32 H24 Ag4 N20 O8 S4 -","4","0.5","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.0263","0.0231","","","0.0564","0.0591","","","","","","1.051","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214176","18.4365","0.0017","10.2983","0.0009","15.905","0.003","90","","118.923","0.003","90","","2643.1","0.6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H6 Ag2 N6 O4 S -","- C8 H6 Ag2 N6 O4 S -","- C64 H48 Ag16 N48 O32 S8 -","8","1","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.0332","0.0306","","","0.0695","0.0711","","","","","","1.036","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214177","18.7675","0.0004","22.308","0.0004","13.9336","0.0005","90","","128.147","0.001","90","","4587.6","0.2","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C14 H6 Ag2 F10 N4 O4 S -","- C14 H6 Ag2 F10 N4 O4 S -","- C112 H48 Ag16 F80 N32 O32 S8 -","8","1","","Wan, Chong-Qing; Zhang, Ya; Sun, Xin-Zhan; Yan, Hao-Jie","A series of 2-D and 3-D silver(i) coordination polymers constructed from a new angular-shaped di-2-pyrazinylsulfide: role of anions in molecular construction","CrystEngComm","2014","16","14","2959","","10.1039/c3ce42404a","","","0.71073","MoKα","","0.1198","0.0574","","","0.1534","0.1868","","","","","","1.042","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214178","10.1484","0.0014","21.509","0.003","25.374","0.003","90","","99.561","0.002","90","","5461.7","1.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H26 Gd N3 O13 S2 -","- C21 H18 Gd N3 O13 S2 -","- C168 H144 Gd8 N24 O104 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0651","0.0487","","","0.1428","0.1587","","","","","","1.039","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214179","20.199","0.004","18.625","0.003","13.918","0.003","90","","117.069","0.002","90","","4662.5","1.6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 N3 Nd O9 S2 -","- C22 H13 N3 Nd O9 S2 -","- C176 H104 N24 Nd8 O72 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.1163","0.0554","","","0.1062","0.1211","","","","","","0.998","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214180","20.1864","0.0016","18.5532","0.0015","13.8708","0.0011","90","","117.337","0.001","90","","4614.8","0.6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 Eu N3 O9 S2 -","- C22 H13 Eu N3 O9 S2 -","- C176 H104 Eu8 N24 O72 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0467","0.0353","","","0.101","0.1093","","","","","","1.001","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214181","20.084","0.004","18.534","0.004","13.831","0.004","90","","117.639","0.002","90","","4560.9","1.9","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 N3 O9 S2 Tb -","- C22 H15 N3 O9 S2 Tb -","- C176 H120 N24 O72 S16 Tb8 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.1069","0.0555","","","0.1259","0.1529","","","","","","1.008","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214182","20.01","0.003","18.516","0.002","13.7905","0.0018","90","","117.896","0.002","90","","4515.7","1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H14 Er N3 O9 S2 -","- C22 H13 Er N3 O8.5 S2 -","- C176 H104 Er8 N24 O68 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0961","0.0544","","","0.1156","0.1336","","","","","","1.091","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214183","19.952","0.007","18.5","0.006","13.756","0.005","90","","117.935","0.004","90","","4486","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 N3 O9 S2 Yb -","- C22 H15 N3 O9 S2 Yb -","- C176 H120 N24 O72 S16 Yb8 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0776","0.0473","","","0.1028","0.1197","","","","","","1.029","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214184","19.858","0.003","18.452","0.002","13.7432","0.0018","90","","118.078","0.002","90","","4443.1","1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 Lu N3 O9 S2 -","- C22 H13 Lu N3 O9 S2 -","- C176 H104 Lu8 N24 O72 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0797","0.0467","","","0.0949","0.1115","","","","","","1.015","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214185","8.9698","0.0006","21.7582","0.0015","13.4973","0.001","90","","92.164","0.001","90","","2632.3","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 N3 O13 S2 Yb -","- C22 H23 N3 O13 S2 Yb -","- C88 H92 N12 O52 S8 Yb4 -","4","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0375","0.0302","","","0.0757","0.0792","","","","","","1.036","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214186","8.983","0.002","21.722","0.005","13.532","0.003","90","","92.122","0.003","90","","2638.7","1","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 Lu N3 O13 S2 -","- C22 H23 Lu N3 O13 S2 -","- C88 H92 Lu4 N12 O52 S8 -","4","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0878","0.0528","","","0.1211","0.1391","","","","","","0.982","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214187","19.408","0.006","13.692","0.004","23.83","0.007","90","","90.937","0.004","90","","6332","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C1.2 H1.4 N0.14 O0.72 S0.1 Yb0.05 -","- C1.20482 H0.915663 N0.144578 O0.722892 S0.0963855 Yb0.0481928 -","- C200 H152 N24 O120 S16 Yb8 -","166","20.75","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0752","0.0473","","","0.1113","0.1245","","","","","","1.094","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214188","19.4274","0.0014","13.6955","0.001","23.855","0.0017","90","","91.004","0.001","90","","6346.1","0.8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H29 Lu N3 O15 S2 -","- C25 H19 Lu N3 O15 S2 -","- C200 H152 Lu8 N24 O120 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0557","0.0376","","","0.0919","0.1017","","","","","","1.026","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214189","10.744","0.003","11.964","0.003","12.004","0.006","109.647","0.004","103.175","0.004","109.375","0.003","1266.9","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H19 Dy N3 O10 S2 -","- C25 H19 Dy N3 O10 S2 -","- C50 H38 Dy2 N6 O20 S4 -","2","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0552","0.0459","","","0.1136","0.1222","","","","","","1.009","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214190","10.7213","0.001","11.9418","0.0011","11.9667","0.0011","109.74","0.001","103.138","0.001","109.217","0.001","1259.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H19 Er N3 O10 S2 -","- C25 H19 Er N3 O10 S2 -","- C50 H38 Er2 N6 O20 S4 -","2","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang","Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics","CrystEngComm","2014","16","14","2898","","10.1039/c3ce42091d","","","0.71073","MoKα","","0.0409","0.0346","","","0.0786","0.0824","","","","","","1.049","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214191","11.0387","0.0002","11.0387","0.0002","6.6318","0.0005","90","","90","","90","","808.1","0.06","293","2","293","2","","","","","","","","6","P 4/n :2","-P 4a","85","","","","- C12 H12 B Br Cd N8 -","- C12 H12 B Br Cd N8 -","- C24 H24 B2 Br2 Cd2 N16 -","2","0.25","","Yang, E.; Wang, Lin; Zhang, Jian","A luminescent neutral cadmium(ii)‒boron(iii)‒imidazolate framework with sql net","CrystEngComm","2014","16","14","2889","","10.1039/c3ce42604a","","","0.71073","MoKα","","0.0725","0.0626","","","0.1614","0.1706","","","","","","1.049","","","","has coordinates","180472","2020-10-21","18:00:00",""
"7214219","8.2063","0.0005","8.2062","0.0005","9.3823","0.001","90","","90","","90","","631.83","0.09","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C4 H6 Mn O5 -","- C4 H6 Mn O5 -","- C16 H24 Mn4 O20 -","4","1","","Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing","CrystEngComm","2014","16","13","2766","","10.1039/c3ce42086h","","x-ray","0.71073","MoKα","","0.0312","0.0244","","","0.0438","0.0456","","","","","","1.108","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214220","13.5402","0.0004","13.5402","0.0004","17.444","0.0009","90","","90","","90","","3198.1","0.2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C5 H8 Mn O5 -","- C5 H8 Mn O5 -","- C80 H128 Mn16 O80 -","16","1","","Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing","CrystEngComm","2014","16","13","2766","","10.1039/c3ce42086h","","x-ray","1.54184","CuKα","","0.0271","0.0255","","","0.0658","0.067","","","","","","1.083","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214221","24.711","0.002","6.8871","0.0004","10.9942","0.0006","90","","90","","90","","1871.1","0.2","293","2","293","2","","","","","","","","4","C m c a","-C 2ac 2","64","","","","- C7 H12 Mn O5 -","- C7 H12 Mn O5 -","- C56 H96 Mn8 O40 -","8","","","Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing","CrystEngComm","2014","16","13","2766","","10.1039/c3ce42086h","","x-ray","0.71073","MoKα","","0.0435","0.0349","","","0.0806","0.0867","","","","","","1.091","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214222","7.9692","0.0009","9.1132","0.0008","12.9102","0.0011","90","","102.204","0.007","90","","916.41","0.15","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C7 H12 Mn O5 -","- C7 H12 Mn O5 -","- C28 H48 Mn4 O20 -","4","1","","Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing","CrystEngComm","2014","16","13","2766","","10.1039/c3ce42086h","","x-ray","0.71073","MoKα","","0.0961","0.0473","","","0.0757","0.0867","","","","","","1.019","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214223","9.2037","0.0003","7.9073","0.0002","29.7366","0.0013","90","","90","","90","","2164.12","0.13","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H10 Mn O5 -","- C10 H10 Mn O5 -","- C80 H80 Mn8 O40 -","8","1","","Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing","CrystEngComm","2014","16","13","2766","","10.1039/c3ce42086h","","x-ray","1.54184","CuKα","","0.05","0.0321","","","0.065","0.0718","","","","","","1.014","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214224","22.0703","0.0008","22.0703","0.0008","12.6143","0.0009","90","","90","","90","","6144.4","0.5","293","2","293","2","","","","","","","","4","P 42/n c m :2","-P 4ac 2ac","138","","","","- Ba18 F18 In8 S21 -","- Ba18 F18 In8 S21 -","- Ba72 F72 In32 S84 -","4","0.25","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","Ba18F18In8S21 and Ba9F10In4S10: new kind of mixed anion compounds with the novel low-dimensional structure","CrystEngComm","2014","16","13","2788","","10.1039/c3ce41954a","","","0.71073","MoKα","","0.0474","0.0443","","","0.1426","0.1454","","","","","","1.166","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214225","12.5686","0.0008","19.2822","0.0012","12.5835","0.0009","90","","90","","90","","3049.6","0.3","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Ba9 F10 In4 S10 -","- Ba9 F10 In4 S10 -","- Ba36 F40 In16 S40 -","4","0.5","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","Ba18F18In8S21 and Ba9F10In4S10: new kind of mixed anion compounds with the novel low-dimensional structure","CrystEngComm","2014","16","13","2788","","10.1039/c3ce41954a","","","0.71073","MoKα","","0.0586","0.0523","","","0.1418","0.1477","","","","","","1.049","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214226","7.6058","0.0006","10.2154","0.0007","12.2851","0.0012","102.799","0.005","97.934","0.005","98.974","0.005","904.52","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H24 N14 O10 Zn5 -","- C36 H24 N14 O10 Zn5 -","- C36 H24 N14 O10 Zn5 -","1","0.5","","Wang, Yan-Ning; Li, Guang-Hua; Yang, Qing-Feng; Yu, Jie-Hui; Xu, Ji-Qing","New Zn2+ coordination polymers with mixed triazolate/tetrazolate and acylhydrazidate as linkers","CrystEngComm","2014","16","13","2692","","10.1039/c3ce42426j","","","0.71073","MoKα","","0.0395","0.0373","","","0.1299","0.131","","","","","","1.183","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214227","13.7823","0.0007","9.7678","0.0007","20.5058","0.0017","90","","96.553","0.004","90","","2742.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N14 O6 Zn3 -","- C20 H18 N14 O6 Zn3 -","- C80 H72 N56 O24 Zn12 -","4","0.5","","Wang, Yan-Ning; Li, Guang-Hua; Yang, Qing-Feng; Yu, Jie-Hui; Xu, Ji-Qing","New Zn2+ coordination polymers with mixed triazolate/tetrazolate and acylhydrazidate as linkers","CrystEngComm","2014","16","13","2692","","10.1039/c3ce42426j","","","0.71073","MoKα","","0.0332","0.0297","","","0.0793","0.0816","","","","","","1.05","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214228","12.354","0.003","12.473","0.003","10.449","0.002","90","","116.92","0.03","90","","1435.6","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 N12 O2 Zn2 -","- C10 H8 N12 O2 Zn2 -","- C40 H32 N48 O8 Zn8 -","4","0.5","","Wang, Yan-Ning; Li, Guang-Hua; Yang, Qing-Feng; Yu, Jie-Hui; Xu, Ji-Qing","New Zn2+ coordination polymers with mixed triazolate/tetrazolate and acylhydrazidate as linkers","CrystEngComm","2014","16","13","2692","","10.1039/c3ce42426j","","","0.71073","MoKα","","0.0227","0.0209","","","0.0534","0.0542","","","","","","1.07","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214229","18.923","0.004","11.121","0.002","15.759","0.003","90","","102.62","0.03","90","","3236.2","1.2","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C22 H18 N16 O10 Zn5 -","- C22 H18 N16 O10 Zn5 -","- C88 H72 N64 O40 Zn20 -","4","0.5","","Wang, Yan-Ning; Li, Guang-Hua; Yang, Qing-Feng; Yu, Jie-Hui; Xu, Ji-Qing","New Zn2+ coordination polymers with mixed triazolate/tetrazolate and acylhydrazidate as linkers","CrystEngComm","2014","16","13","2692","","10.1039/c3ce42426j","","","0.71073","MoKα","","0.0505","0.0431","","","0.107","0.1105","","","","","","1.077","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214230","9.9688","0.0005","12.4158","0.0006","17.4099","0.001","86.1612","0.0015","79.7348","0.0018","80.1653","0.0015","2087.7","0.19","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H36 I4 O4 S4 -","- C36 H36 I4 O4 S4 -","- C72 H72 I8 O8 S8 -","2","1","","Yamada, Manabu; Kanazawa, Ryo; Hamada, Fumio","Halogen‒halogen interactions and halogen bonding in thiacalixarene systems","CrystEngComm","2014","16","13","2605","","10.1039/c3ce42535e","","","0.71075","MoKα","","","0.0287","","","","0.0788","","","","","","1.097","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214231","18.4313","0.0009","14.2656","0.0005","17.855","0.0006","90","","92.4043","0.001","90","","4690.5","0.3","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H48 I4 O5 S4 -","- C42 H48 I4 O5 S4 -","- C168 H192 I16 O20 S16 -","4","1","","Yamada, Manabu; Kanazawa, Ryo; Hamada, Fumio","Halogen‒halogen interactions and halogen bonding in thiacalixarene systems","CrystEngComm","2014","16","13","2605","","10.1039/c3ce42535e","","","0.71075","MoKα","","","0.0351","","","","0.086","","","","","","1.036","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214232","6.4633","0.0015","17.072","0.004","23.816","0.006","90","","90.602","0.003","90","","2627.7","1.1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 Eu N3 O9 -","- C23 H28 Eu N3 O9 -","- C92 H112 Eu4 N12 O36 -","4","1","","Liu, Xiaolan; Wang, Xin; Gao, Ting; Xu, Yan; Shen, Xuan; Zhu, Dunru","Three 3D lanthanide‒organic frameworks with sra topology: syntheses, structures, luminescence and magnetic properties","CrystEngComm","2014","16","13","2779","","10.1039/c3ce42553c","","","0.71073","MoKα","","0.0721","0.052","","","0.1269","0.1345","","","","","","1.079","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214233","6.4399","0.0007","17.023","0.002","23.833","0.003","90","","90.792","0.002","90","","2612.5","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 Gd N3 O9 -","- C23 H28 Gd N3 O9 -","- C92 H112 Gd4 N12 O36 -","4","1","","Liu, Xiaolan; Wang, Xin; Gao, Ting; Xu, Yan; Shen, Xuan; Zhu, Dunru","Three 3D lanthanide‒organic frameworks with sra topology: syntheses, structures, luminescence and magnetic properties","CrystEngComm","2014","16","13","2779","","10.1039/c3ce42553c","","","0.71073","MoKα","","0.0925","0.0564","","","0.1395","0.1526","","","","","","1.012","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214234","6.3462","0.0011","16.58","0.003","24.018","0.004","90","","90.683","0.002","90","","2527","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 Dy N3 O9 -","- C23 H28 Dy N3 O9 -","- C92 H112 Dy4 N12 O36 -","4","1","","Liu, Xiaolan; Wang, Xin; Gao, Ting; Xu, Yan; Shen, Xuan; Zhu, Dunru","Three 3D lanthanide‒organic frameworks with sra topology: syntheses, structures, luminescence and magnetic properties","CrystEngComm","2014","16","13","2779","","10.1039/c3ce42553c","","","0.71073","MoKα","","0.0714","0.0599","","","0.1512","0.1566","","","","","","1.094","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214235","11.2908","0.0003","12.2293","0.0003","14.9933","0.0004","90","","91.389","0.002","90","","2069.65","0.09","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 N2 O4 -","- C24 H26 N2 O4 -","- C96 H104 N8 O16 -","4","1","","Prado, Livia Deris; Rocha, Helvécio Vinícius Antunes; Resende, Jackson Antônio Lamounier Camargos; Ferreira, Glaucio Braga; de Figuereido Teixeira, Ana Maria Rangel","An insight into carvedilol solid forms: effect of supramolecular interactions on the dissolution profiles","CrystEngComm","2014","16","15","3168","","10.1039/c3ce42403k","","x-ray","0.71073","MoKα","","0.0502","0.0416","","","0.1022","0.1086","","","","","","1.052","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214236","13.477","0.003","16.515","0.003","19.139","0.004","90","","94.16","0.03","90","","4248.6","1.5","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 N4 O9 -","- C48 H54 N4 O9 -","- C192 H216 N16 O36 -","4","1","","Prado, Livia Deris; Rocha, Helvécio Vinícius Antunes; Resende, Jackson Antônio Lamounier Camargos; Ferreira, Glaucio Braga; de Figuereido Teixeira, Ana Maria Rangel","An insight into carvedilol solid forms: effect of supramolecular interactions on the dissolution profiles","CrystEngComm","2014","16","15","3168","","10.1039/c3ce42403k","","","0.71073","MoKα","","0.05","0.0399","","","0.1019","0.1066","","","","","","1.048","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214237","37.1672","0.0011","3.83724","0.0001","30.9227","0.0008","90","","130.277","0.0013","90","","3364.66","0.17","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 N2 O2 S2 -","- C21 H14 N2 O2 S2 -","- C168 H112 N16 O16 S16 -","8","1","","Sakai, Ken-ichi; Kawamura, Hiroshi; Kobayashi, Noriyuki; Ishikawa, Takaaki; Ikeda, Chiori; Kikuchi, Takemitsu; Akutagawa, Tomoyuki","Highly efficient solid-state red fluorophores using ESIPT: crystal packing and fluorescence properties of alkoxy-substituted dibenzothiazolylphenols","CrystEngComm","2014","16","15","3180","","10.1039/c3ce42109k","","","1.54187","CuKα","","","0.107","","","","0.2371","","","","","","1.039","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214238","11.7301","0.0002","22.2883","0.0004","7.47946","0.0001","90","","100.438","","90","","1923.1","0.05","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 N2 O2 S2 -","- C23 H18 N2 O2 S2 -","- C92 H72 N8 O8 S8 -","4","1","","Sakai, Ken-ichi; Kawamura, Hiroshi; Kobayashi, Noriyuki; Ishikawa, Takaaki; Ikeda, Chiori; Kikuchi, Takemitsu; Akutagawa, Tomoyuki","Highly efficient solid-state red fluorophores using ESIPT: crystal packing and fluorescence properties of alkoxy-substituted dibenzothiazolylphenols","CrystEngComm","2014","16","15","3180","","10.1039/c3ce42109k","","","1.54187","CuKα","","","0.0731","","","","0.1563","","","","","","1.094","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214239","29.401","0.003","13.3519","0.0011","15.8465","0.0013","90","","90.878","0.002","90","","6220","1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H44 Cd3 N8 O12 -","- C46 H44 Cd3 N8 O12 -","- C184 H176 Cd12 N32 O48 -","4","0.5","","Shi, Jing-Tao; Yue, Ke-Fen; Liu, Bo; Zhou, Chun-sheng; Liu, Yong-Liang; Fang, Zhi-Guo; Wang, Yao-Yu","Two porous metal‒organic frameworks (MOFs) based on mixed ligands: synthesis, structure and selective gas adsorption","CrystEngComm","2014","16","15","3097","","10.1039/c3ce41557k","","","0.71073","MoKα","","0.0795","0.0642","","","0.1888","0.2003","","","","","","1.048","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214240","13.9345","0.0014","26.096","0.003","19.2265","0.0019","90","","90","","90","","6991.4","1.3","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C53 H40 Co3 N4 O12 -","- C53 H40 Co3 N4 O12 -","- C212 H160 Co12 N16 O48 -","4","0.5","","Shi, Jing-Tao; Yue, Ke-Fen; Liu, Bo; Zhou, Chun-sheng; Liu, Yong-Liang; Fang, Zhi-Guo; Wang, Yao-Yu","Two porous metal‒organic frameworks (MOFs) based on mixed ligands: synthesis, structure and selective gas adsorption","CrystEngComm","2014","16","15","3097","","10.1039/c3ce41557k","","","0.71073","MoKα","","0.118","0.0752","","","0.216","0.2365","","","","","","0.962","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214241","20.897","0.007","16.915","0.003","21.778","0.005","90","","106.437","0.011","90","","7383","3","108","2","108","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C80.64 H69.28 Au2 Cl5.28 N2 O8 P4 -","- C80.642 H69.284 Au2 Cl5.284 N2 O8 P4 -","- C322.568 H277.136 Au8 Cl21.136 N8 O32 P16 -","4","0.5","","Jobbágy, Csaba; Molnár, Miklós; Baranyai, Péter; Hamza, Andrea; Pálinkás, Gábor; Deák, Andrea","A stimuli-responsive double-stranded digold(i) helicate","CrystEngComm","2014","16","15","3192","","10.1039/c3ce42474j","","","0.71073","MoKα","","0.043","0.0384","","","0.097","0.0998","","","","","","1.036","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214242","28.247","0.005","18.297","0.004","18.992","0.004","90","","121.566","0.008","90","","8363","3","113","2","113","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C82.69 H73.38 Au2 Cl9.38 N2 O8 P4 -","- C82.692 H73.384 Au2 Cl9.384 N2 O8 P4 -","- C330.768 H293.536 Au8 Cl37.536 N8 O32 P16 -","4","0.5","","Jobbágy, Csaba; Molnár, Miklós; Baranyai, Péter; Hamza, Andrea; Pálinkás, Gábor; Deák, Andrea","A stimuli-responsive double-stranded digold(i) helicate","CrystEngComm","2014","16","15","3192","","10.1039/c3ce42474j","","","0.71073","MoKα","","0.0702","0.0403","","","0.0617","0.079","","","","","","0.718","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214243","11.7728","0.0001","33.8466","0.0003","18.4668","0.0002","90","","96.231","0.001","90","","7314.98","0.12","93","2","93","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C79.9 H68.97 Au2 Cl3.8 N2 O8.59 P4 -","- C79.9 H68.974 Au2 Cl3.8 N2 O8.587 P4 -","- C319.6 H275.896 Au8 Cl15.2 N8 O34.348 P16 -","4","1","","Jobbágy, Csaba; Molnár, Miklós; Baranyai, Péter; Hamza, Andrea; Pálinkás, Gábor; Deák, Andrea","A stimuli-responsive double-stranded digold(i) helicate","CrystEngComm","2014","16","15","3192","","10.1039/c3ce42474j","","","0.71073","MoKα","","0.0433","0.0375","","","0.0941","0.0971","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214244","21.374","0.005","16.82","0.005","22.25","0.005","90","","107.595","0.005","90","","7625","3","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C80.26 H68.53 Au2 Cl4.53 N2 O8 P4 -","- C80.264 H68.528 Au2 Cl4.528 N2 O8 P4 -","- C321.056 H274.112 Au8 Cl18.112 N8 O32 P16 -","4","0.5","","Jobbágy, Csaba; Molnár, Miklós; Baranyai, Péter; Hamza, Andrea; Pálinkás, Gábor; Deák, Andrea","A stimuli-responsive double-stranded digold(i) helicate","CrystEngComm","2014","16","15","3192","","10.1039/c3ce42474j","","","0.71073","MoKα","","0.0539","0.0393","","","0.0603","0.0687","","","","","","0.872","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214245","23.423","0.004","11.2363","0.0019","22.563","0.004","90","","90","","90","","5938.3","1.8","298","2","298","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C27 H29.5 N2 Ni O9.75 -","- C27 H28.5 N2 Ni O9.75 -","- C216 H228 N16 Ni8 O78 -","8","1","","Liu, Jian-Qiang; Wu, Jian; Wang, Yao-Yu; Lin, Jian-Tao; Sakiyama, Hiroshi","Different interpenetrated coordination polymers based on flexible dicarboxylate ligands: topological diversity and magnetism","CrystEngComm","2014","16","15","3103","","10.1039/c3ce42338g","","","0.71073","MoKα","","0.1228","0.0589","","","0.1516","0.1673","","","","","","1.046","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214246","14.079","0.005","14.669","0.005","19.559","0.006","108.878","0.005","92.031","0.007","116.314","0.005","3349","2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H56.58 Co2 N12 O14.29 S3 -","- C70 H52 Co2 N12 O14.29 S3 -","- C140 H104 Co4 N24 O28.58 S6 -","2","1","","Liu, Jian-Qiang; Wu, Jian; Wang, Yao-Yu; Lin, Jian-Tao; Sakiyama, Hiroshi","Different interpenetrated coordination polymers based on flexible dicarboxylate ligands: topological diversity and magnetism","CrystEngComm","2014","16","15","3103","","10.1039/c3ce42338g","","","0.71073","MoKα","","0.2876","0.0594","","","0.0645","0.0823","","","","","","0.64","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214247","9.6092","0.0009","10.695","0.0011","13.436","0.0014","70.763","0.002","87.595","0.002","72.381","0.002","1240","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H26 Co N2 O8 -","- C27 H26 Co N2 O8 -","- C54 H52 Co2 N4 O16 -","2","1","","Liu, Jian-Qiang; Wu, Jian; Wang, Yao-Yu; Lin, Jian-Tao; Sakiyama, Hiroshi","Different interpenetrated coordination polymers based on flexible dicarboxylate ligands: topological diversity and magnetism","CrystEngComm","2014","16","15","3103","","10.1039/c3ce42338g","","","0.71073","MoKα","","0.0702","0.0447","","","0.1104","0.1165","","","","","","0.956","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214248","13.0721","0.0008","8.1857","0.0004","21.867","0.003","90","","107.835","0.008","90","","2227.4","0.4","119.6","0.9","119.6","0.9","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H44 Co2 N2 O12 -","- C48 H44 Co2 N2 O12 -","- C96 H88 Co4 N4 O24 -","2","0.5","","Liu, Jian-Qiang; Wu, Jian; Wang, Yao-Yu; Lin, Jian-Tao; Sakiyama, Hiroshi","Different interpenetrated coordination polymers based on flexible dicarboxylate ligands: topological diversity and magnetism","CrystEngComm","2014","16","15","3103","","10.1039/c3ce42338g","","","0.71073","MoKα","","0.1537","0.0747","","","0.1255","0.1658","","","","","","1.032","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214249","13.5187","0.0007","7.2436","0.0004","26.014","0.003","90","","90","","90","","2547.4","0.4","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H10 N2 O4 -","- C15 H10 N2 O4 -","- C120 H80 N16 O32 -","8","1","","Wu, Jing-Yun; Yuan, Pin-Ting; Hsiao, Cheng-Chu","Positional isomerism of unsymmetrical semirigid ligands toward the construction of discrete and infinite coordination architectures of zinc(ii) and cadmium(ii) complexes","CrystEngComm","2014","16","15","3128","","10.1039/c3ce42398k","","","0.71073","MoKα","","0.1201","0.0779","","","0.1443","0.1613","","","","","","1.091","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214250","22.3598","0.0007","15.1429","0.0004","23.0395","0.0007","90","","110.657","0.004","90","","7299.5","0.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H24.5 N4 O9.25 Zn -","- C32 H22 N4 O8.5 Zn -","- C256 H176 N32 O68 Zn8 -","8","1","","Wu, Jing-Yun; Yuan, Pin-Ting; Hsiao, Cheng-Chu","Positional isomerism of unsymmetrical semirigid ligands toward the construction of discrete and infinite coordination architectures of zinc(ii) and cadmium(ii) complexes","CrystEngComm","2014","16","15","3128","","10.1039/c3ce42398k","","","0.71073","MoKα","","0.0744","0.0578","","","0.1737","0.1867","","","","","","1.072","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214251","9.151","0.0003","12.4798","0.0004","12.9559","0.0003","107.884","0.002","90.393","0.002","95.349","0.002","1400.99","0.07","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H38 Cl2 N8 O16 Zn2 -","- C60 H38 Cl2 N8 O16 Zn2 -","- C60 H38 Cl2 N8 O16 Zn2 -","1","0.5","","Wu, Jing-Yun; Yuan, Pin-Ting; Hsiao, Cheng-Chu","Positional isomerism of unsymmetrical semirigid ligands toward the construction of discrete and infinite coordination architectures of zinc(ii) and cadmium(ii) complexes","CrystEngComm","2014","16","15","3128","","10.1039/c3ce42398k","","","0.71073","MoKα","","0.0673","0.0426","","","0.1003","0.1332","","","","","","1.074","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214252","19.2567","0.0015","18.6939","0.0015","7.902","0.0006","90","","98.917","0.003","90","","2810.2","0.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H19 N4 O8.5 Zn -","- C30 H18 N4 O8.5 Zn -","- C120 H72 N16 O34 Zn4 -","4","0.5","","Wu, Jing-Yun; Yuan, Pin-Ting; Hsiao, Cheng-Chu","Positional isomerism of unsymmetrical semirigid ligands toward the construction of discrete and infinite coordination architectures of zinc(ii) and cadmium(ii) complexes","CrystEngComm","2014","16","15","3128","","10.1039/c3ce42398k","","","0.71073","MoKα","","0.0523","0.046","","","0.1316","0.1369","","","","","","1.186","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214253","15.146","0.003","13.695","0.003","6.9265","0.0014","90","","91.28","0.03","90","","1436.4","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H9 Cd Cl N2 O4 -","- C15 H9 Cd Cl N2 O4 -","- C60 H36 Cd4 Cl4 N8 O16 -","4","1","","Wu, Jing-Yun; Yuan, Pin-Ting; Hsiao, Cheng-Chu","Positional isomerism of unsymmetrical semirigid ligands toward the construction of discrete and infinite coordination architectures of zinc(ii) and cadmium(ii) complexes","CrystEngComm","2014","16","15","3128","","10.1039/c3ce42398k","","","0.71073","MoKα","","0.076","0.0621","","","0.1969","0.2167","","","","","","1.182","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214254","6.7987","0.0008","24.5045","0.0019","8.2871","0.001","90","","91.514","0.011","90","","1380.1","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 Cd N4 O10 -","- C30 H22 Cd N4 O10 -","- C60 H44 Cd2 N8 O20 -","2","0.5","","Wu, Jing-Yun; Yuan, Pin-Ting; Hsiao, Cheng-Chu","Positional isomerism of unsymmetrical semirigid ligands toward the construction of discrete and infinite coordination architectures of zinc(ii) and cadmium(ii) complexes","CrystEngComm","2014","16","15","3128","","10.1039/c3ce42398k","","","0.71073","MoKα","","0.0734","0.0595","","","0.0942","0.098","","","","","","1.33","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214255","3.694","0.004","8.184","0.009","23.62","0.03","90","","94.49","","90","","711.9","1.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cd Cl2 N10 O0 -","- C10 H10 Cd Cl2 N10 -","- C20 H20 Cd2 Cl4 N20 -","2","0.5","","Song, Yuna; Yin, Xinbo; Tu, Binbin; Pang, Qingqing; Li, Haiwei; Ren, Xiaoqian; Wang, Bo; Li, Qiaowei","Metal‒organic frameworks constructed from mixed infinite inorganic units and adenine","CrystEngComm","2014","16","15","3082","","10.1039/c3ce42556h","","","0.71073","MoKα","","0.2346","0.1511","","","0.4242","0.4467","","","","","","1.057","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214256","9.156","0.0012","12.1449","0.0016","14.1202","0.0019","90","","95.271","0.002","90","","1563.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 Cd3 N10 O10 -","- C22 H32 Cd3 N10 O10 -","- C44 H64 Cd6 N20 O20 -","2","0.5","","Song, Yuna; Yin, Xinbo; Tu, Binbin; Pang, Qingqing; Li, Haiwei; Ren, Xiaoqian; Wang, Bo; Li, Qiaowei","Metal‒organic frameworks constructed from mixed infinite inorganic units and adenine","CrystEngComm","2014","16","15","3082","","10.1039/c3ce42556h","","","0.71073","MoKα","","0.0467","0.0294","","","0.0726","0.0817","","","","","","0.487","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214257","14.857","0.005","23.615","0.009","3.7317","0.0013","90","","90","","90","","1309.3","0.8","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C10 H8 Cd4 Cl7 N10 -","- C10 H8 Cd4 Cl7 N10 -","- C20 H16 Cd8 Cl14 N20 -","2","0.25","","Song, Yuna; Yin, Xinbo; Tu, Binbin; Pang, Qingqing; Li, Haiwei; Ren, Xiaoqian; Wang, Bo; Li, Qiaowei","Metal‒organic frameworks constructed from mixed infinite inorganic units and adenine","CrystEngComm","2014","16","15","3082","","10.1039/c3ce42556h","","","0.71073","MoKα","","0.1518","0.0918","","","0.2457","0.2693","","","","","","0.854","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214258","13.4907","0.0014","13.505","0.0014","13.7924","0.0014","102.084","0.002","97.561","0.002","116.001","0.002","2136","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H76 N20 Ni3 O18 -","- C90 H76 N20 Ni3 O18 -","- C90 H76 N20 Ni3 O18 -","1","0.5","","Zhang, Xiutang; Fan, Liming; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and magnetic properties of five coordination polymers constructed from biphenyl-3,4′,5-tricarboxylic acid and (bis)imidazole linkers","CrystEngComm","2014","16","15","3203","","10.1039/c3ce42565g","","","0.71073","MoKα","","0.0582","0.0464","","","0.1283","0.1381","","","","","","1.003","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214259","12.337","0.002","11.051","0.002","21.819","0.004","90","","100.761","0.004","90","","2922.4","0.9","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H24 Co2 N4 O8 -","- C29 H24 Co2 N4 O8 -","- C116 H96 Co8 N16 O32 -","4","1","","Zhang, Xiutang; Fan, Liming; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and magnetic properties of five coordination polymers constructed from biphenyl-3,4′,5-tricarboxylic acid and (bis)imidazole linkers","CrystEngComm","2014","16","15","3203","","10.1039/c3ce42565g","","","0.71073","MoKα","","0.0811","0.047","","","0.0971","0.1138","","","","","","1.001","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214260","8.9151","0.001","12.3303","0.0013","13.3052","0.0014","108.564","0.002","107.76","0.002","99.002","0.002","1267.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H24 N4 O7 Zn -","- C29 H22 N4 O7 Zn -","- C58 H44 N8 O14 Zn2 -","2","1","","Zhang, Xiutang; Fan, Liming; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and magnetic properties of five coordination polymers constructed from biphenyl-3,4′,5-tricarboxylic acid and (bis)imidazole linkers","CrystEngComm","2014","16","15","3203","","10.1039/c3ce42565g","","","0.71073","MoKα","","0.0574","0.045","","","0.1228","0.1378","","","","","","0.997","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214261","11.7332","0.0004","15.2259","0.0006","16.1433","0.0006","90","","102.497","0.001","90","","2815.65","0.18","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C67 H49 Co2 N8 O14 -","- C67 H49 Co2 N8 O14 -","- C134 H98 Co4 N16 O28 -","2","1","","Zhang, Xiutang; Fan, Liming; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and magnetic properties of five coordination polymers constructed from biphenyl-3,4′,5-tricarboxylic acid and (bis)imidazole linkers","CrystEngComm","2014","16","15","3203","","10.1039/c3ce42565g","","","0.71073","MoKα","","0.0519","0.0452","","","0.1183","0.1237","","","","","","1.002","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214262","12.15","0.003","13.422","0.003","17.825","0.004","77.205","0.004","70.985","0.004","83.344","0.004","2677","1.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C120 H88 Mn5 N20 O22 S2 -","- C120 H88 Mn5 N20 O22 S2 -","- C120 H88 Mn5 N20 O22 S2 -","1","0.5","","Zhang, Xiutang; Fan, Liming; Zhang, Wei; Fan, Weiliu; Sun, Liming; Zhao, Xian","Syntheses, structures, and magnetic properties of five coordination polymers constructed from biphenyl-3,4′,5-tricarboxylic acid and (bis)imidazole linkers","CrystEngComm","2014","16","15","3203","","10.1039/c3ce42565g","","","0.71073","MoKα","","0.1185","0.069","","","0.1102","0.1581","","","","","","1","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214263","38.1168","0.0009","38.1168","0.0009","11.6852","0.0003","90","","90","","120","","14702.8","0.6","123","2","123","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C171 H154 Br12 Cl12 N18 O13 Zn6 -","- C171 H137.94 Br12 Cl12.06 N18 O12.96 Zn6 -","- C513 H413.82 Br36 Cl36.18 N54 O38.88 Zn18 -","3","0.166667","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture","CrystEngComm","2014","16","3","328","","10.1039/c3ce42012d","","","0.71073","MoKα","","0.0454","0.0333","","","0.0902","0.102","","","","","","1.115","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214264","38.975","0.002","38.975","0.002","11.4827","0.0008","90","","90","","120","","15105.9","1.5","123","2","123","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C189 H159 Br12 Cl9 N18 O15 Zn6 -","- C189 H129 Br12 Cl9 N18 O15 Zn6 -","- C567 H387 Br36 Cl27 N54 O45 Zn18 -","3","0.166667","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture","CrystEngComm","2014","16","3","328","","10.1039/c3ce42012d","","","0.71073","MoKα","","0.0703","0.0425","","","0.1267","0.1717","","","","","","1.111","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214265","38.4322","0.0016","38.4322","0.0016","22.545","0.001","90","","90","","120","","28838","2","123","2","123","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C438 H308 Cl24 N36 O22 Zn12 -","- C437.94 H275.76 Cl24 N36 O21.9 Zn12 -","- C1313.82 H827.28 Cl72 N108 O65.7 Zn36 -","3","0.166667","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture","CrystEngComm","2014","16","3","328","","10.1039/c3ce42012d","","","0.71073","MoKα","","0.086","0.0638","","","0.1735","0.2072","","","","","","1.115","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214266","37.998","0.004","37.998","0.004","11.3178","0.0011","90","","90","","120","","14152","3","123","2","123","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C168 H111 Cl21 F30 N18 O9 Zn6 -","- C168 H99 Cl21 F30 N18 O9 Zn6 -","- C504 H297 Cl63 F90 N54 O27 Zn18 -","3","0.166667","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture","CrystEngComm","2014","16","3","328","","10.1039/c3ce42012d","","","1.54178","CuKα","","0.0626","0.0613","","","0.181","0.1826","","","","","","1.051","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214267","9.2722","0.0004","35.4234","0.0015","30.2123","0.0012","90","","95.305","0.002","90","","9880.8","0.7","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C162 H84 Cl12 F30 N18 Zn6 -","- C162 H84 Cl12 F30 N18 Zn6 -","- C324 H168 Cl24 F60 N36 Zn12 -","2","0.5","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture","CrystEngComm","2014","16","3","328","","10.1039/c3ce42012d","","","1.54178","CuKα","","0.124","0.1069","","","0.3013","0.3169","","","","","","1.089","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214268","38.394","0.004","38.394","0.004","11.5576","0.0015","90","","90","","120","","14755","3","123","2","123","2","","","","","","","","6","R -3","-R 3","148","","","","- C162 H84 Br12 F30 N18 Zn6 -","- C162 H84 Br12 F30 N18 Zn6 -","- C486 H252 Br36 F90 N54 Zn18 -","3","","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture","CrystEngComm","2014","16","3","328","","10.1039/c3ce42012d","","","1.54178","CuKα","","0.1008","0.0769","","","0.1903","0.2024","","","","","","1.116","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214269","8.2122","0.0007","9.0548","0.0005","11.4228","0.0007","93.672","0.005","110.255","0.007","108.406","0.006","741.63","0.1","148","2","148","2","","","","","","","","3","P -1","-P 1","2","MBDA-Form-I","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.7107","MoKα","","0.0568","0.0435","","","0.1032","0.1123","","","","","","1.027","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214270","8.2145","0.0007","9.0601","0.0006","11.4225","0.0008","93.69","0.006","110.215","0.007","108.361","0.007","742.68","0.11","178","2","178","2","","","","","","","","3","P -1","-P 1","2","MBDA-Form-I","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.7107","MoKα","","0.0615","0.045","","","0.1076","0.1174","","","","","","1.052","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214271","8.2268","0.0007","9.0703","0.0006","11.4426","0.0008","93.691","0.005","110.218","0.007","108.335","0.006","746.06","0.11","208","2","208","2","","","","","","","","3","P -1","-P 1","2","MBDA-Form-I","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.7107","MoKα","","0.0645","0.0461","","","0.1105","0.1221","","","","","","1.032","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214272","8.2384","0.0008","9.095","0.0006","11.46","0.0008","93.7","0.006","110.161","0.008","108.267","0.007","750.96","0.12","238","2","238","2","","","","","","","","3","P -1","-P 1","2","MBDA-Form-I","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.7107","MoKα","","0.0709","0.0483","","","0.1131","0.1282","","","","","","1.023","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214273","8.2565","0.0008","9.1147","0.0006","11.4695","0.0008","93.722","0.005","110.153","0.008","108.221","0.007","755.1","0.12","268","2","268","2","","","","","","","","3","P -1","-P 1","2","MBDA-Form-I","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.7107","MoKα","","0.0746","0.0488","","","0.1156","0.1322","","","","","","1.031","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214274","8.2504","0.0009","9.1159","0.0007","11.4622","0.0009","93.8","0.007","110.087","0.009","108.151","0.009","754.71","0.14","298","2","298","2","","","","","","","","3","P -1","-P 1","2","MBDA-Form-I","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.7107","MoKα","","0.0799","0.0516","","","0.1228","0.142","","","","","","1.042","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214275","17.967","0.0012","7.9756","0.0006","14.0251","0.0008","90","","133.571","0.004","90","","1456.12","0.19","148","2","148","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","MBDA-Form-II","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.71073","MoKα","","0.0616","0.0426","","","0.1009","0.1115","","","","","","1.041","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214276","17.9037","0.0014","8.0121","0.0008","14.0696","0.0009","90","","133.44","0.004","90","","1465.4","0.2","178","2","178","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","MBDA-Form-II","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.71073","MoKα","","0.0755","0.0497","","","0.1302","0.1451","","","","","","1.051","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214277","17.8536","0.0016","8.07","0.0006","14.1329","0.0011","90","","133.271","0.005","90","","1482.6","0.2","208","2","208","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","MBDA-Form-II","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.71073","MoKα","","0.0859","0.053","","","0.1222","0.1393","","","","","","1.035","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214278","17.7463","0.0014","8.093","0.0007","14.1825","0.0009","90","","133.117","0.004","90","","1486.9","0.2","238","2","238","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","MBDA-Form-II","","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.71073","MoKα","","0.1075","0.0584","","","0.1361","0.1662","","","","","","1.021","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214279","17.6512","0.0018","8.1468","0.0005","14.2338","0.001","90","","132.931","0.006","90","","1498.6","0.3","268","2","268","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","MBDA-Form-II","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.71073","MoKα","","0.111","0.0544","","","0.1109","0.1361","","","","","","1.014","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214280","17.5602","0.0017","8.1816","0.0006","14.282","0.001","90","","132.8","0.005","90","","1505.5","0.2","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","MBDA-Form-II","4,4'-Methylene-bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Steric guided anomalous thermal expansion in a dimorphic organic system","CrystEngComm","2014","16","12","2340","","10.1039/c3ce41869c","","","0.71073","MoKα","","0.1104","0.0563","","","0.1335","0.1663","","","","","","1.019","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214281","17.416","0.004","11.358","0.002","13.74","0.003","90","","92.41","0.03","90","","2715.5","1","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Di-ethylammonium-1,1'-binaphthyl-2,2'-dicarboxylate","","- C30 H36 N2 O4 -","- C30 H36 N2 O4 -","- C120 H144 N8 O16 -","4","0.5","","Jacobs, Ayesha; Báthori, Nikoletta B.; Kabwit, Rodriguez Y.; Weber, Edwin","Salts of the scissor-shaped racemic host 1,1′-binaphthyl-2,2′-dicarboxylic acid with amines: structure and thermal stability","CrystEngComm","2014","16","12","2462","","10.1039/c3ce42215a","","","0.71073","MoKα","","0.0508","0.0401","","","0.0969","0.1041","","","","","","1.036","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214282","9.5427","0.0019","12.417","0.003","15.396","0.003","81.62","0.03","79.45","0.03","75.37","0.03","1725.8","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Di-n-butylammonium-1,1'-binaphthyl-2,2'-dicarboxylate","","- C38 H52 N2 O4 -","- C38 H52 N2 O4 -","- C76 H104 N4 O8 -","2","1","","Jacobs, Ayesha; Báthori, Nikoletta B.; Kabwit, Rodriguez Y.; Weber, Edwin","Salts of the scissor-shaped racemic host 1,1′-binaphthyl-2,2′-dicarboxylic acid with amines: structure and thermal stability","CrystEngComm","2014","16","12","2462","","10.1039/c3ce42215a","","","0.71073","MoKα","","0.0661","0.0449","","","0.1107","0.124","","","","","","1.042","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214283","11.8142","0.0013","12.3251","0.0014","13.3363","0.0015","64.614","0.002","86.613","0.002","83.622","0.002","1743.4","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Di-n-butylammonium-1,1'-binaphthyl-2,2'-dicarboxylate","","- C38 H52 N2 O4 -","- C38 H52 N2 O4 -","- C76 H104 N4 O8 -","2","1","","Jacobs, Ayesha; Báthori, Nikoletta B.; Kabwit, Rodriguez Y.; Weber, Edwin","Salts of the scissor-shaped racemic host 1,1′-binaphthyl-2,2′-dicarboxylic acid with amines: structure and thermal stability","CrystEngComm","2014","16","12","2462","","10.1039/c3ce42215a","","","0.71073","MoKα","","0.0864","0.0499","","","0.1206","0.1395","","","","","","1.012","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214284","14.254","0.003","14.9","0.003","15.067","0.003","100.82","0.03","117.76","0.03","104.12","0.03","2571.3","1.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H81 N5 O7 -","- C53 H81 N5 O7 -","- C106 H162 N10 O14 -","2","1","","Jacobs, Ayesha; Báthori, Nikoletta B.; Kabwit, Rodriguez Y.; Weber, Edwin","Salts of the scissor-shaped racemic host 1,1′-binaphthyl-2,2′-dicarboxylic acid with amines: structure and thermal stability","CrystEngComm","2014","16","12","2462","","10.1039/c3ce42215a","","","0.71073","MoKα","","0.0787","0.0605","","","0.1684","0.1829","","","","","","1.037","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214285","13.97","0.003","19.964","0.004","15.127","0.003","90","","97.88","0.03","90","","4179","1.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","dicyclohexylammonium-1,1'-binaphthyl-2,2'-dicarboxylate methanol hydrate","","- C47 H66 N2 O6 -","- C47 H66 N2 O6 -","- C188 H264 N8 O24 -","4","1","","Jacobs, Ayesha; Báthori, Nikoletta B.; Kabwit, Rodriguez Y.; Weber, Edwin","Salts of the scissor-shaped racemic host 1,1′-binaphthyl-2,2′-dicarboxylic acid with amines: structure and thermal stability","CrystEngComm","2014","16","12","2462","","10.1039/c3ce42215a","","","0.71073","MoKα","","0.0731","0.044","","","0.1108","0.1259","","","","","","1.028","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214286","11.2481","0.0012","13.1877","0.0014","18.235","0.002","90","","105.738","0.002","90","","2603.5","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15.1 H33.38 Al4 Na3 O15.1 -","- C15.095 H33.38 Al4 Na3 O15.095 -","- C60.38 H133.52 Al16 Na12 O60.38 -","4","1","","Li, Xiansen; Michaelis, Vladimir K.; Ong, Ta-Chung; Smith, Stacey J.; McKay, Ian; Müller, Peter; Griffin, Robert G.; Wang, Evelyn N.","One-pot Solvothermal Synthesis of Well-ordered Layered Sodium Aluminoalcoholate Complex: A Useful Precursor for the Preparation of Porous Al2O3 Particles.","CrystEngComm / RSC","2014","16","14","2950","2958","10.1039/C3CE42616E","","","0.71073","MoKα","","0.0633","0.0405","","","0.0994","0.111","","","","","","1.046","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214287","7.114","0.005","17.602","0.013","8.188","0.006","90","","110.666","0.012","90","","959.3","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 Br N2 O2 -","- C7 H11 Br N2 O2 -","- C28 H44 Br4 N8 O8 -","4","1","","Xuan, Xiao-Peng; Chang, Liang-Liang; Zhang, Heng; Wang, Na; Zhao, Yang","Hydrogen bonds in the crystal structure of hydrophobic and hydrophilic COOH-functionalized imidazolium ionic liquids","CrystEngComm","2014","16","14","3040","","10.1039/c3ce42492h","","","0.71073","MoKα","","0.0642","0.0436","","","0.1042","0.1134","","","","","","1.009","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214288","7.092","0.002","11.93","0.003","14.419","0.004","90","","109.603","0.012","90","","1149.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 F6 N2 O2 P -","- C7 H11 F6 N2 O2 P -","- C28 H44 F24 N8 O8 P4 -","4","1","","Xuan, Xiao-Peng; Chang, Liang-Liang; Zhang, Heng; Wang, Na; Zhao, Yang","Hydrogen bonds in the crystal structure of hydrophobic and hydrophilic COOH-functionalized imidazolium ionic liquids","CrystEngComm","2014","16","14","3040","","10.1039/c3ce42492h","","","0.71073","MoKα","","0.0672","0.0412","","","0.0869","0.0992","","","","","","1.007","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214289","8.264","0.005","15.703","0.01","21.517","0.011","90","","111.29","0.019","90","","2602","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 F6 N2 O2 P -","- C8 H13 F6 N2 O2 P -","- C64 H104 F48 N16 O16 P8 -","8","2","","Xuan, Xiao-Peng; Chang, Liang-Liang; Zhang, Heng; Wang, Na; Zhao, Yang","Hydrogen bonds in the crystal structure of hydrophobic and hydrophilic COOH-functionalized imidazolium ionic liquids","CrystEngComm","2014","16","14","3040","","10.1039/c3ce42492h","","","0.71073","MoKα","","0.2021","0.1652","","","0.3331","0.3456","","","","","","1.088","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214290","9.898","0.005","16.937","0.008","12.581","0.005","90","","127.51","0.03","90","","1673","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H11 F6 N3 O6 S2 -","- C9 H11 F6 N3 O6 S2 -","- C36 H44 F24 N12 O24 S8 -","4","1","","Xuan, Xiao-Peng; Chang, Liang-Liang; Zhang, Heng; Wang, Na; Zhao, Yang","Hydrogen bonds in the crystal structure of hydrophobic and hydrophilic COOH-functionalized imidazolium ionic liquids","CrystEngComm","2014","16","14","3040","","10.1039/c3ce42492h","","","0.71073","MoKα","","0.0579","0.0447","","","0.106","0.1143","","","","","","1.004","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214291","7.836","0.003","4.821","0.0018","28.599","0.011","90","","100.732","0.01","90","","1061.5","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 Br N2 O2 -","- C8 H13 Br N2 O2 -","- C32 H52 Br4 N8 O8 -","4","1","","Xuan, Xiao-Peng; Chang, Liang-Liang; Zhang, Heng; Wang, Na; Zhao, Yang","Hydrogen bonds in the crystal structure of hydrophobic and hydrophilic COOH-functionalized imidazolium ionic liquids","CrystEngComm","2014","16","14","3040","","10.1039/c3ce42492h","","","0.71073","MoKα","","0.0425","0.0336","","","0.0838","0.088","","","","","","1.017","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214292","13.445","0.006","6.382","0.003","9.727","0.005","90","","90","","90","","834.6","0.7","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C6 H9 Cl N2 O2 -","- C6 H9 Cl N2 O2 -","- C24 H36 Cl4 N8 O8 -","4","1","","Xuan, Xiao-Peng; Chang, Liang-Liang; Zhang, Heng; Wang, Na; Zhao, Yang","Hydrogen bonds in the crystal structure of hydrophobic and hydrophilic COOH-functionalized imidazolium ionic liquids","CrystEngComm","2014","16","14","3040","","10.1039/c3ce42492h","","","0.71073","MoKα","","0.0348","0.0287","","","0.068","0.0713","","","","","","1.012","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214293","15.4579","0.0016","19.1439","0.0017","17.109","0.001","90","","105.241","0.006","90","","4884.9","0.7","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H58 O29 U4 -","- C30 H51 O29 U4 -","- C120 H204 O116 U16 -","4","2","","Thuéry, Pierre; Harrowfield, Jack","Chiral one- to three-dimensional uranyl‒organic assemblies from (1R,3S)-(+)-camphoric acid","CrystEngComm","2014","16","14","2996","","10.1039/c3ce42613k","","","0.71073","MoKα","","0.1108","0.0714","","","0.1705","0.1863","","","","","","1.022","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214294","21.3657","0.0007","21.3657","0.0007","38.4108","0.0014","90","","90","","120","","15185.1","0.9","150","2","150","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C120 H194 K8 O77 U8 -","- C120 H168 K8.01 O77 U8 -","- C360 H504 K24.03 O231 U24 -","3","0.333333","","Thuéry, Pierre; Harrowfield, Jack","Chiral one- to three-dimensional uranyl‒organic assemblies from (1R,3S)-(+)-camphoric acid","CrystEngComm","2014","16","14","2996","","10.1039/c3ce42613k","","","0.71073","MoKα","","0.0961","0.063","","","0.1569","0.1692","","","","","","1.052","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214295","9.2051","0.0002","19.3999","0.0003","10.3663","0.0002","90","","97.9411","0.0007","90","","1833.44","0.06","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H23 N O7 U -","- C15 H23 N O7 U -","- C60 H92 N4 O28 U4 -","4","2","","Thuéry, Pierre; Harrowfield, Jack","Chiral one- to three-dimensional uranyl‒organic assemblies from (1R,3S)-(+)-camphoric acid","CrystEngComm","2014","16","14","2996","","10.1039/c3ce42613k","","","0.71073","MoKα","","0.0408","0.0379","","","0.0992","0.1009","","","","","","1.039","","","","has coordinates,has disorder","180473","2020-10-21","18:00:00",""
"7214296","19.5109","0.0015","18.82","0.001","13.9091","0.0011","90","","109.813","0.004","90","","4805","0.6","150","2","150","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C40 H60 Cu N2 O18 U2 -","- C40 H60 Cu N2 O18 U2 -","- C160 H240 Cu4 N8 O72 U8 -","4","1","","Thuéry, Pierre; Harrowfield, Jack","Chiral one- to three-dimensional uranyl‒organic assemblies from (1R,3S)-(+)-camphoric acid","CrystEngComm","2014","16","14","2996","","10.1039/c3ce42613k","","","0.71073","MoKα","","0.1013","0.0678","","","0.1787","0.1941","","","","","","1.039","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214297","7.3053","0.0007","17.5056","0.0014","12.6731","0.0012","90","","90","","90","","1620.7","0.3","143","1","143","1","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C19 H17 O5 S Zn -","- C19 H17 O5 S Zn -","- C76 H68 O20 S4 Zn4 -","4","0.5","","Kojtari, Arben; Carroll, Patrick J.; Ji, Hai-Feng","Metal organic framework (MOF) micro/nanopillars","CrystEngComm","2014","16","14","2885","","10.1039/c4ce00172a","","","0.71073","MoKα","","0.0578","0.0366","","","0.0894","0.0996","","","","","","1.09","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214298","6.7778","0.0007","18.8206","0.0018","8.5384","0.0008","90","","92.471","0.004","90","","1088.16","0.18","143","1","143","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Cu O9 -","- C9 H10 Cu O9 -","- C36 H40 Cu4 O36 -","4","1","","Kojtari, Arben; Carroll, Patrick J.; Ji, Hai-Feng","Metal organic framework (MOF) micro/nanopillars","CrystEngComm","2014","16","14","2885","","10.1039/c4ce00172a","","","0.71073","MoKα","","0.0196","0.0194","","","0.0526","0.0526","","","","","","1.112","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214299","22.463","0.004","10.3101","0.0019","17.114","0.003","90","","90.427","0.002","90","","3963.4","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H40 Cu2 N10 O4 Zn -","- C42 H40 Cu2 N10 O4 Zn -","- C168 H160 Cu8 N40 O16 Zn4 -","4","0.5","","Das, Lakshmi Kanta; Kirillov, Alexander M.; Ghosh, Ashutosh","Discrete 0D and polymeric 2D and 3D derivatives assembled from [(CuL)2Zn]2+ and dicyanamide blocks (H2L = salen type Schiff bases): Genuine supramolecular isomers with distinct topologies","CrystEngComm","2014","16","14","3029","","10.1039/c3ce42027b","","","0.71073","MoKα","","0.052","0.0328","","","0.0724","0.0803","","","","","","1.017","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7214300","16.3579","0.0015","10.7877","0.001","21.928","0.002","90","","107.132","0.001","90","","3697.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H32 Cu2 N10 O4 Zn -","- C38 H32 Cu2 N10 O4 Zn -","- C152 H128 Cu8 N40 O16 Zn4 -","4","1","","Das, Lakshmi Kanta; Kirillov, Alexander M.; Ghosh, Ashutosh","Discrete 0D and polymeric 2D and 3D derivatives assembled from [(CuL)2Zn]2+ and dicyanamide blocks (H2L = salen type Schiff bases): Genuine supramolecular isomers with distinct topologies","CrystEngComm","2014","16","14","3029","","10.1039/c3ce42027b","","","0.71073","MoKα","","0.0737","0.0379","","","0.0699","0.0814","","","","","","1.008","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214301","11.44","0.002","11.44","0.002","24.485","0.004","90","","90","","120","","2775.1","0.8","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C38 H32 Cu2 N10 O4 Zn -","- C38 H32 Cu2 N10 O4 Zn -","- C114 H96 Cu6 N30 O12 Zn3 -","3","0.5","","Das, Lakshmi Kanta; Kirillov, Alexander M.; Ghosh, Ashutosh","Discrete 0D and polymeric 2D and 3D derivatives assembled from [(CuL)2Zn]2+ and dicyanamide blocks (H2L = salen type Schiff bases): Genuine supramolecular isomers with distinct topologies","CrystEngComm","2014","16","14","3029","","10.1039/c3ce42027b","","","0.71073","MoKα","","0.0484","0.0368","","","0.0832","0.0911","","","","","","0.945","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214302","13.585","0.004","12.926","0.004","16.012","0.005","90","","90","","90","","2811.7","1.5","291","2","291","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H15 Cl3 N2 O8 -","- C7 H15 Cl3 N2 O8 -","- C56 H120 Cl24 N16 O64 -","8","1","","Chen, Li-Zhuang; Huang, Deng-Deng; Ge, Jia-Zhen; Wang, Fang-Ming","Temperature-induced reversible structural phase transition of 1-(chloromethyl)-1,4-diazoniabicyclo[2.2.2]octane bis(perchlorate)","CrystEngComm","2014","16","14","2944","","10.1039/c3ce42190b","","","0.71073","MoKα","","0.077","0.069","","","0.1744","0.1833","","","","","","0.956","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214303","12.659","0.004","16.121","0.005","13.197","0.004","90","","91.231","0.004","90","","2692.6","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H15 Cl3 N2 O8 -","- C7 H15 Cl3 N2 O8 -","- C56 H120 Cl24 N16 O64 -","8","2","","Chen, Li-Zhuang; Huang, Deng-Deng; Ge, Jia-Zhen; Wang, Fang-Ming","Temperature-induced reversible structural phase transition of 1-(chloromethyl)-1,4-diazoniabicyclo[2.2.2]octane bis(perchlorate)","CrystEngComm","2014","16","14","2944","","10.1039/c3ce42190b","","","0.71073","MoKα","","0.0969","0.0883","","","0.2124","0.2178","","","","","","1.061","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214304","13.3098","0.0012","12.7949","0.0012","16.0119","0.0015","90","","90","","90","","2726.8","0.4","170","2","170","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H15 Cl3 N2 O8 -","- C7 H15 Cl3 N2 O8 -","- C56 H120 Cl24 N16 O64 -","8","1","","Chen, Li-Zhuang; Huang, Deng-Deng; Ge, Jia-Zhen; Wang, Fang-Ming","Temperature-induced reversible structural phase transition of 1-(chloromethyl)-1,4-diazoniabicyclo[2.2.2]octane bis(perchlorate)","CrystEngComm","2014","16","14","2944","","10.1039/c3ce42190b","","","0.71073","MoKα","","0.0615","0.056","","","0.1493","0.1537","","","","","","1.243","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214312","39.4134","0.0004","39.4134","0.0004","10.4024","0.0002","90","","90","","120","","13994.3","0.3","93","2","93","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C32 H30 N2 O8 -","- C32 H30 N2 O8 -","- C576 H540 N36 O144 -","18","1","","Gruber, Tobias; Eißmann, Frank; Gruner, Margit; Heinz, Luisa G.; Seichter, Wilhelm; Weber, Edwin","Simple dinitro substituted calix[4]arene forming a honeycomb-like architecture with hydrophobic channels","CrystEngComm","2014","16","18","3730","","10.1039/c3ce41819g","","","0.71073","MoKα","","0.0666","0.0496","","","0.1357","0.1517","","","","","","0.995","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214313","39.3244","0.0003","39.3244","0.0003","10.4186","0.0002","90","","90","","120","","13952.9","0.3","103","2","103","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C33 H32 N2 O8.34 -","- C33 H30 N2 O8.34 -","- C594 H540 N36 O150.12 -","18","1","","Gruber, Tobias; Eißmann, Frank; Gruner, Margit; Heinz, Luisa G.; Seichter, Wilhelm; Weber, Edwin","Simple dinitro substituted calix[4]arene forming a honeycomb-like architecture with hydrophobic channels","CrystEngComm","2014","16","18","3730","","10.1039/c3ce41819g","","","0.71073","MoKα","","0.093","0.0531","","","0.1258","0.1462","","","","","","1.041","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214314","16.1514","0.0005","16.4165","0.0005","24.4814","0.0008","90","","90","","90","","6491.2","0.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C33 H31 Cl3 N2 O8 -","- C33 H31 Cl3 N2 O8 -","- C264 H248 Cl24 N16 O64 -","8","1","","Gruber, Tobias; Eißmann, Frank; Gruner, Margit; Heinz, Luisa G.; Seichter, Wilhelm; Weber, Edwin","Simple dinitro substituted calix[4]arene forming a honeycomb-like architecture with hydrophobic channels","CrystEngComm","2014","16","18","3730","","10.1039/c3ce41819g","","","0.71073","MoKα","","0.0837","0.0678","","","0.196","0.215","","","","","","1.284","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214315","14.8361","0.0005","36.0691","0.0012","23.6851","0.0009","90","","101.903","0.001","90","","12402","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C84 H95 Ce3 N5 O89 S8 -","- C84 H95 Ce3 N5 O89 S8 -","- C336 H380 Ce12 N20 O356 S32 -","4","1","","Husain, Ahmad; Oliver, Clive L.","A C-shaped p-sulfonatocalix[4]arene-based supermolecule exhibiting mutual-inclusion and bilayer insertion of dipicolinate","CrystEngComm","2014","16","18","3749","","10.1039/c3ce42358a","","","0.71073","MoKα","","0.0689","0.0496","","","0.1181","0.1282","","","","","","1.028","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214316","14.6699","0.0008","13.9019","0.0008","27.0087","0.0015","90","","102.838","0.003","90","","5370.4","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H67 Cl4 N5 O4 -","- C51 H55 Cl4 N5 O4 -","- C204 H220 Cl16 N20 O16 -","4","1","","Engle, Jeffrey M.; Singh, Pushpinder S.; Vonnegut, Chris L.; Zakharov, Lev N.; Johnson, Darren W.; Haley, Michael M.","Synthesis and solid-state structures of a macrocyclic receptor based on the 2,6-bis(2-anilinoethynyl)pyridine scaffold","CrystEngComm","2014","16","18","3703","","10.1039/c3ce42307g","","","1.54178","CuKα","","0.1023","0.0891","","","0.2627","0.2771","","","","","","1.059","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214317","24.0752","0.0018","9.9609","0.0007","45.509","0.003","90","","90","","90","","10913.5","1.3","193","2","193","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C53 H62 N5 O5 -","- C50 H55 N5 O5 -","- C400 H440 N40 O40 -","8","1","","Engle, Jeffrey M.; Singh, Pushpinder S.; Vonnegut, Chris L.; Zakharov, Lev N.; Johnson, Darren W.; Haley, Michael M.","Synthesis and solid-state structures of a macrocyclic receptor based on the 2,6-bis(2-anilinoethynyl)pyridine scaffold","CrystEngComm","2014","16","18","3703","","10.1039/c3ce42307g","","","0.71073","MoKα","","0.1058","0.0636","","","0.1759","0.2","","","","","","1.01","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214318","10.899","0.003","10.055","0.003","27.255","0.007","90","","90","","90","","2986.9","1.4","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C36 H36 N4 O4 -","- C36 H36 N4 O4 -","- C144 H144 N16 O16 -","4","0.5","","Tedesco, Consiglia; Erra, Loredana; Izzo, Irene; De Riccardis, Francesco","Solid state assembly of cyclic α-peptoids","CrystEngComm","2014","16","18","3667","","10.1039/c3ce42456a","","","1.54178","CuKα","","0.073","0.0586","","","0.172","0.2208","","","","","","1.029","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214319","11.612","0.0002","14.5363","0.0002","27.401","0.0004","90","","101.019","0.0014","90","","4539.9","0.12","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C49 H74 N2 O9 -","- C49 H74 N2 O9 -","- C196 H296 N8 O36 -","4","1","","Beyeh, N. Kodiah; Valkonen, Arto; Rissanen, Kari","Deprotonation of resorcinarenes by mono- and diamine bases: complexation and intermolecular interactions in the solid state","CrystEngComm","2014","16","18","3758","","10.1039/c3ce42291g","","","1.54184","CuKα","","0.0451","0.0383","","","0.098","0.1033","","","","","","1.03","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214320","11.0544","0.0005","11.9545","0.0005","17.4371","0.0009","109.915","0.004","100.321","0.004","97.585","0.004","2084.53","0.19","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H61 N3 O8 -","- C45 H61 N3 O8 -","- C90 H122 N6 O16 -","2","1","","Beyeh, N. Kodiah; Valkonen, Arto; Rissanen, Kari","Deprotonation of resorcinarenes by mono- and diamine bases: complexation and intermolecular interactions in the solid state","CrystEngComm","2014","16","18","3758","","10.1039/c3ce42291g","","","1.54184","CuKα","","0.066","0.0502","","","0.1449","0.1581","","","","","","1.05","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214321","11.7076","0.0005","14.7176","0.0006","15.4943","0.0006","107.092","0.002","94.407","0.002","110.946","0.002","2333.23","0.17","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H73 N3 O9 -","- C50 H73 N3 O9 -","- C100 H146 N6 O18 -","2","1","","Beyeh, N. Kodiah; Valkonen, Arto; Rissanen, Kari","Deprotonation of resorcinarenes by mono- and diamine bases: complexation and intermolecular interactions in the solid state","CrystEngComm","2014","16","18","3758","","10.1039/c3ce42291g","","","0.71073","MoKα","","0.1043","0.0707","","","0.1485","0.166","","","","","","1.091","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214322","8.1302","0.0002","11.0677","0.0004","17.3238","0.0007","90","","95.2468","0.0012","90","","1552.31","0.09","150","","150","","","","","","","","synthesized","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H36 Br2 Cl2 N4 O2 -","- C28 H36 Br2 Cl2 N4 O2 -","- C56 H72 Br4 Cl4 N8 O4 -","2","0.5","","White, Nicholas G.; Caballero, Antonio; Beer, Paul D.","Observation of strong halogen bonds in the solid state structures of bis-haloimidazolium macrocycles","CrystEngComm","2014","16","18","3722","","10.1039/c3ce41944d","","","0.71073","MoKα","","0.047","0.0379","","0.0863","0.0809","0.0863","","","","","","0.9195","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214323","8.709","0.0001","8.9799","0.0001","26.0376","0.0003","89.5146","0.0004","84.863","0.0004","85.5213","0.0005","2021.92","0.04","150","","150","","","","","","","","synthesized","7","P -1","-P 1","2","","","","- C32 H46 Br2 I2 N4 O3 S3 -","- C32 H46 Br2 I2 N4 O3 S3 -","- C64 H92 Br4 I4 N8 O6 S6 -","2","1","","White, Nicholas G.; Caballero, Antonio; Beer, Paul D.","Observation of strong halogen bonds in the solid state structures of bis-haloimidazolium macrocycles","CrystEngComm","2014","16","18","3722","","10.1039/c3ce41944d","","","0.71073","MoKα","","0.0529","0.0427","","0.1121","0.1023","0.1121","","","","","","0.9631","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214324","8.7552","0.0002","9.1778","0.0002","19.3962","0.0005","100.835","0.001","95.9931","0.001","95.4914","0.0011","1511.75","0.06","150","","150","","","","","","","","synthesized","5","P -1","-P 1","2","","","","- C26 H31 Br2 N6 O7.5 -","- C26 H31 Br2 N6 O7.5 -","- C52 H62 Br4 N12 O15 -","2","1","","White, Nicholas G.; Caballero, Antonio; Beer, Paul D.","Observation of strong halogen bonds in the solid state structures of bis-haloimidazolium macrocycles","CrystEngComm","2014","16","18","3722","","10.1039/c3ce41944d","","","0.71073","MoKα","","0.0994","0.0658","","0.2173","0.1669","0.2173","","","","","","0.9691","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214325","27.1683","0.0011","15.3846","0.0005","19.2713","0.0009","90","","98.162","0.002","90","","7973.3","0.6","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C68 H72 Br2 Cd Cl12 N4 O4 S4 -","- C68 H70 Br2 Cd Cl12 N4 O4 S4 -","- C272 H280 Br8 Cd4 Cl48 N16 O16 S16 -","4","0.5","","Ovsyannikov, A.; Ferlay, S.; Solovieva, S. E.; Antipin, I. S.; Konovalov, A. I.; Kyritsakas, N.; Hosseini, M. W.","Molecular tectonics: generation of grid and porous diamondoid coordination networks by calixarene based tectons","CrystEngComm","2014","16","18","3765","","10.1039/c3ce42305k","","","0.71073","MoKα","","0.1103","0.0811","","","0.2313","0.2548","","","","","","1.051","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214326","13.9112","0.0002","14.48","0.0003","20.85","0.0004","74.732","0.001","82.404","0.001","66.777","0.001","3721.48","0.12","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H70 Br2 Cd Cl6 N4 S8 -","- C66 H70 Br2 Cd Cl6 N4 S8 -","- C132 H140 Br4 Cd2 Cl12 N8 S16 -","2","1","","Ovsyannikov, A.; Ferlay, S.; Solovieva, S. E.; Antipin, I. S.; Konovalov, A. I.; Kyritsakas, N.; Hosseini, M. W.","Molecular tectonics: generation of grid and porous diamondoid coordination networks by calixarene based tectons","CrystEngComm","2014","16","18","3765","","10.1039/c3ce42305k","","","0.71073","MoKα","","0.0847","0.0432","","","0.1015","0.1181","","","","","","1.004","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214327","28.197","0.0008","15.6401","0.0004","15.4989","0.0004","90","","100.242","0.002","90","","6726.2","0.3","173","2","173","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C130 H146 Br2 Co N8 O3 S16 -","- C130 H144 Br2 Co N8 O3 S16 -","- C260 H288 Br4 Co2 N16 O6 S32 -","2","0.5","","Ovsyannikov, A.; Ferlay, S.; Solovieva, S. E.; Antipin, I. S.; Konovalov, A. I.; Kyritsakas, N.; Hosseini, M. W.","Molecular tectonics: generation of grid and porous diamondoid coordination networks by calixarene based tectons","CrystEngComm","2014","16","18","3765","","10.1039/c3ce42305k","","","0.71073","MoKα","","0.1023","0.0604","","","0.1504","0.1736","","","","","","1.033","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214328","11.4791","0.0004","14.2338","0.0004","21.6211","0.0005","87.817","0.001","81.183","0.001","66.381","0.001","3197.45","0.16","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C129 H140 Cl4 Fe2 N8 O S16 -","- C129 H140 Cl4 Fe2 N8 O S16 -","- C129 H140 Cl4 Fe2 N8 O S16 -","1","0.5","","Ovsyannikov, A.; Ferlay, S.; Solovieva, S. E.; Antipin, I. S.; Konovalov, A. I.; Kyritsakas, N.; Hosseini, M. W.","Molecular tectonics: generation of grid and porous diamondoid coordination networks by calixarene based tectons","CrystEngComm","2014","16","18","3765","","10.1039/c3ce42305k","","","0.71073","MoKα","","0.0607","0.0486","","","0.1368","0.148","","","","","","1.033","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214329","9.4199","0.0003","12.6344","0.0004","20.5258","0.0005","90","","90","","90","","2442.87","0.12","200","2","200","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C15 H9 N13 O12 Pb2 -","- C15 H9 N13 O12 Pb2 -","- C60 H36 N52 O48 Pb8 -","4","0.5","","Safin, Damir A.; Burgess, Kevin M. N.; Korobkov, Ilia; Bryce, David L.; Murugesu, Muralee","Renaissance of the coordination chemistry of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (TPymT). Part II: new insights into the reaction of TPymT with Pb(NO3)2","CrystEngComm","2014","16","17","3466","","10.1039/c4ce00009a","","","0.71073","MoKα","","0.0326","0.0267","","","0.0665","0.0698","","","","","","1.037","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214330","10.4811","0.0004","14.5008","0.0005","21.9334","0.0008","90","","90","","90","","3333.5","0.2","100","2","100","2","","","","","","","","6","P m m n :2","-P 2ab 2a","59","","","","- C36 H84 Cl4 Mg2 N24 O36 -","- C36 H36 Cl4 Mg2 N24 O35.6636 -","- C72 H72 Cl8 Mg4 N48 O71.3272 -","2","0.25","","Danylyuk, Oksana; Fedin, Vladimir P.","Unexpected crystallization of the metastable tubular coordination polymer of cucurbit[6]uril with magnesium ions which spontaneously transforms into a discrete coordination complex","CrystEngComm","2014","16","18","3699","","10.1039/c3ce42287a","","","1.5418","CuKα","","0.1037","0.0878","","","0.2471","0.2644","","","","","","1.03","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214331","10.915","0.0002","12.4577","0.0002","13.8264","0.0002","106.243","0.001","94.7355","0.001","113.72","0.001","1611.32","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H80 Cl4 Mg2 N24 O34 -","- C36 H62 Cl4 Mg2 N24 O34 -","- C36 H62 Cl4 Mg2 N24 O34 -","1","0.5","","Danylyuk, Oksana; Fedin, Vladimir P.","Unexpected crystallization of the metastable tubular coordination polymer of cucurbit[6]uril with magnesium ions which spontaneously transforms into a discrete coordination complex","CrystEngComm","2014","16","18","3699","","10.1039/c3ce42287a","","","0.71073","MoKα","","0.0472","0.0433","","","0.1118","0.1145","","","","","","1.047","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214332","12.4536","0.0002","12.4913","0.0002","13.0575","0.0002","110.575","0.001","102.185","0.001","98.7109","0.001","1801.45","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H86 Cl8 Mg4 N24 O37 -","- C36 H76.048 Cl8 Mg4 N24 O37 -","- C36 H76.048 Cl8 Mg4 N24 O37 -","1","0.5","","Danylyuk, Oksana; Fedin, Vladimir P.","Unexpected crystallization of the metastable tubular coordination polymer of cucurbit[6]uril with magnesium ions which spontaneously transforms into a discrete coordination complex","CrystEngComm","2014","16","18","3699","","10.1039/c3ce42287a","","","0.71073","MoKα","","0.0516","0.0435","","","0.0958","0.1026","","","","","","1.05","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214333","12.2773","0.0009","28.901","0.002","15.635","0.0012","90","","93.101","0.002","90","","5539.6","0.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5","","","- C58.5 H66 N8 O14.5 -","- C58.5 H65.5 N8 O14.5 -","- C234 H262 N32 O58 -","4","1","","Kennedy, Stuart; Beavers, Christine M.; Teat, Simon J.; Dalgarno, Scott J.","Salt formation affects the conformational and assembly properties of p-carboxylatocalix[4]arenes","CrystEngComm","2014","16","18","3712","","10.1039/c3ce42523a","","","0.7749","Synchrotron","","0.0763","0.0505","","","0.1342","0.1524","","","","","","0.976","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214334","16.5671","0.0014","19.7029","0.0017","20.3946","0.0018","87.763","0.004","84.24","0.004","77.864","0.003","6474.5","1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","methanolpropoxy","","","- C130.65 H167.3 N16 O34 -","- C130.65 H150 N16 O33.5 -","- C261.3 H300 N32 O67 -","2","1","","Kennedy, Stuart; Beavers, Christine M.; Teat, Simon J.; Dalgarno, Scott J.","Salt formation affects the conformational and assembly properties of p-carboxylatocalix[4]arenes","CrystEngComm","2014","16","18","3712","","10.1039/c3ce42523a","","","0.71073","MoKα","","0.1023","0.0809","","","0.2388","0.2542","","","","","","1.893","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214335","13.1086","0.0004","38.2571","0.0017","12.9509","0.0006","90","","99.22","0.002","90","","6410.9","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","methanolbutoxy","","","- C68 H80 N8 O12 -","- C68 H80 N8 O12 -","- C272 H320 N32 O48 -","4","0.5","","Kennedy, Stuart; Beavers, Christine M.; Teat, Simon J.; Dalgarno, Scott J.","Salt formation affects the conformational and assembly properties of p-carboxylatocalix[4]arenes","CrystEngComm","2014","16","18","3712","","10.1039/c3ce42523a","","","0.7749","synchrotron","","0.2628","0.1289","","","0.2471","0.3001","","","","","","1.389","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214336","16.3018","0.0005","8.6598","0.0002","13.566","0.0004","90","","112.177","0.004","90","","1773.44","0.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H26 Cl2 N6 Ni O8 -","- C10 H26 Cl2 N6 Ni O8 -","- C40 H104 Cl8 N24 Ni4 O32 -","4","1","","Tsymbal, Lyudmila V.; Lampeka, Yaroslaw D.; Boyko, Vyacheslaw I.; Kalchenko, Vitaly I.; Shishkina, Svitlana V.; Shishkin, Oleg V.","A ladder-type coordination polymer constructed from two macrocyclic units ‒ calix[4]arene tetracarboxylate and azamacrocyclic nickel(ii) complex","CrystEngComm","2014","16","18","3707","","10.1039/c3ce42279h","","","0.71073","MoKα","","0.0513","0.0362","","","0.0887","0.0957","","","","","","0.992","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214337","12.9588","0.0004","15.3239","0.0005","24.3358","0.0009","78.225","0.003","84.909","0.003","70.031","0.003","4445.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C161 H265 N27 Ni3 O34 -","- C161 H265 N27 Ni3 O34 -","- C161 H265 N27 Ni3 O34 -","1","0.5","","Tsymbal, Lyudmila V.; Lampeka, Yaroslaw D.; Boyko, Vyacheslaw I.; Kalchenko, Vitaly I.; Shishkina, Svitlana V.; Shishkin, Oleg V.","A ladder-type coordination polymer constructed from two macrocyclic units ‒ calix[4]arene tetracarboxylate and azamacrocyclic nickel(ii) complex","CrystEngComm","2014","16","18","3707","","10.1039/c3ce42279h","","","0.71073","MoKα","","0.1063","0.0766","","","0.2038","0.2337","","","","","","0.999","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214338","13.344","0.0008","11.0423","0.0007","14.6607","0.0009","90","","90.571","0.003","90","","2160.1","0.2","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H56 N6 O2 -","- C52 H56 N6 O2 -","- C104 H112 N12 O4 -","2","0.5","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","2D →2D Parallel interpenetration of (4,4) sheets constructed from a ditopic bis(4,2′:6′,4′′-terpyridine)","CrystEngComm","2014","16","17","3494","","10.1039/c4ce00324a","","","1.54178","CuKα","","0.0447","0.0393","","","0.1046","0.1096","","","","","","1.034","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214339","20.6102","0.0011","11.5999","0.0006","23.8198","0.0012","90","","90.978","0.003","90","","5693.9","0.5","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H64 Cl4 N6 O6 Zn2 -","- C52 H56 Cl4 N6 O6 Zn2 -","- C208 H224 Cl16 N24 O24 Zn8 -","4","0.5","","Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A.","2D →2D Parallel interpenetration of (4,4) sheets constructed from a ditopic bis(4,2′:6′,4′′-terpyridine)","CrystEngComm","2014","16","17","3494","","10.1039/c4ce00324a","","","1.54178","CuKα","","0.0616","0.0591","","","0.1643","0.1659","","","","","","1.192","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214340","44.86","0.004","15.1635","0.0014","15.6748","0.0014","90","","97.55","0.004","90","","10570.1","1.7","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Dinitro{(±)-2,7,12-Trimethoxy-3,8,13-tris(2-N-oxide-pyridylmethoxy)-10,15-dihydro-5H- tribenzo[a,d,g]cyclononatriene}]gadolinium(III) dimethylformamide","","- C45 H46 Gd N7 O19 -","- C45 H46 Gd N7 O19 -","- C360 H368 Gd8 N56 O152 -","8","1","","Henkelis, James J.; Ronson, Tanya K.; Hardie, Michaele J.","Lanthanide coordination polymers with pyridyl-N-oxide or carboxylate functionalised host ligands","CrystEngComm","2014","16","18","3688","","10.1039/c3ce40776d","","","0.71073","MoKα","","0.1437","0.0698","","","0.1808","0.2194","","","","","","1.005","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214341","12.7326","0.0012","16.1047","0.0013","19.7002","0.0017","103.648","0.002","91.582","0.003","94.159","0.003","3911","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","[Chlorotrisdimethylformamide{(±)-2,7,12-trimethoxy- 3,8,13-tris(4-N-oxide-pyridyloxy)-10,15-dihydro-5H- tribenzo[a,d,g]cyclononatriene}samarium(III) pentachlorodimethylformamidesamariumate(III) dimethylformamide","","- C61.5 H78.5 Cl6 N9.5 O18.5 Sm2 -","- C61.5 H78.5 Cl6 N9.5 O18.5 Sm2 -","- C123 H157 Cl12 N19 O37 Sm4 -","2","1","","Henkelis, James J.; Ronson, Tanya K.; Hardie, Michaele J.","Lanthanide coordination polymers with pyridyl-N-oxide or carboxylate functionalised host ligands","CrystEngComm","2014","16","18","3688","","10.1039/c3ce40776d","","","0.71073","MoKα","","0.0773","0.0504","","","0.1334","0.1494","","","","","","1.034","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214342","14.2284","0.001","14.7501","0.0011","16.4083","0.0012","76.082","0.004","70.013","0.003","61.718","0.003","2837","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","[Aquodimethylformamide{(±)-2,7,12-Trimethoxy-3,8,13-tris(4- phenylcarboxylic acid methoxy)-10,15-dihydro-5H- tribenzo[a,d,g] cyclononatriene}europium(III) dimethylformamide hydrate","","- C55.5 H60.5 Eu N2.5 O16.5 -","- C55.5 H56.5 Eu N2.5 O16.5 -","- C111 H113 Eu2 N5 O33 -","2","1","","Henkelis, James J.; Ronson, Tanya K.; Hardie, Michaele J.","Lanthanide coordination polymers with pyridyl-N-oxide or carboxylate functionalised host ligands","CrystEngComm","2014","16","18","3688","","10.1039/c3ce40776d","","","0.71073","MoKα","","0.073","0.0701","","","0.1929","0.1947","","","","","","1.166","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214343","9.1779","0.0004","23.8787","0.0013","7.9118","0.0004","90","","91.095","0.002","90","","1733.6","0.15","123","2","120.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 N8 -","- C40 H40 N8 -","- C80 H80 N16 -","2","0.5","","Hawes, Chris S.; Batten, Stuart R.; Turner, David R.","Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands","CrystEngComm","2014","16","18","3737","","10.1039/c3ce42141d","","","0.71073","MoKα","","0.0869","0.0538","","","0.1085","0.1228","","","","","","1.036","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214344","21.933","0.004","8.719","0.0017","20.64","0.004","90","","101.83","0.03","90","","3863.2","1.3","100","2","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H50 Cl2 N4 O10 -","- C40 H50 Cl2 N4 O10 -","- C160 H200 Cl8 N16 O40 -","4","0.5","","Hawes, Chris S.; Batten, Stuart R.; Turner, David R.","Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands","CrystEngComm","2014","16","18","3737","","10.1039/c3ce42141d","","","0.7108","Synchrotron","","0.056","0.0532","","","0.1346","0.1374","","","","","","1.07","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214345","9.362","0.0019","15.871","0.003","25.586","0.005","90","","96.64","0.03","90","","3776.2","1.3","100","2","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C80 H80 Ag2 Cl2 N16 O8 -","- C80 H80 Ag2 Cl2 N16 O8 -","- C160 H160 Ag4 Cl4 N32 O16 -","2","0.5","","Hawes, Chris S.; Batten, Stuart R.; Turner, David R.","Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands","CrystEngComm","2014","16","18","3737","","10.1039/c3ce42141d","","","0.7108","Synchrotron","","0.0476","0.0403","","","0.1088","0.1136","","","","","","1.032","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214346","16.298","0.002","16.298","0.002","30.945","0.006","90","","90","","90","","8220","2","100","2","100","","","","","","","","","6","I 41/a","-I 4ad","88","","","","- C80 H88 Cl6 N8 Ni3 O16 -","- C80 H88 Cl6 N8 Ni3 O16 -","- C320 H352 Cl24 N32 Ni12 O64 -","4","","","Hawes, Chris S.; Batten, Stuart R.; Turner, David R.","Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands","CrystEngComm","2014","16","18","3737","","10.1039/c3ce42141d","","","0.7108","Synchrotron","","0.073","0.0651","","","0.1798","0.1867","","","","","","1.11","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214347","16.353","0.002","16.353","0.002","30.894","0.006","90","","90","","90","","8262","2","100","2","100","","","","","","","","","6","I 41/a","-I 4ad","88","","","","- C80 H88 Cl6 Co3 N8 O16 -","- C80 H88 Cl6 Co3 N8 O16 -","- C320 H352 Cl24 Co12 N32 O64 -","4","","","Hawes, Chris S.; Batten, Stuart R.; Turner, David R.","Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands","CrystEngComm","2014","16","18","3737","","10.1039/c3ce42141d","","","0.7108","Synchrotron","","0.0876","0.0782","","","0.2101","0.2185","","","","","","1.07","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214348","35.258","0.005","8.7597","0.0015","29.409","0.004","90","","90","","90","","9083","2","123","2","123","","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C84 H106 Cl6 Cu5 N8 O23 -","- C84 H96 Cl6 Cu5 N8 O22.96 -","- C336 H384 Cl24 Cu20 N32 O91.84 -","4","0.25","","Hawes, Chris S.; Batten, Stuart R.; Turner, David R.","Self-assembly of discrete and polymeric metallosupramolecular architectures from cyclen-derived ligands","CrystEngComm","2014","16","18","3737","","10.1039/c3ce42141d","","","0.71073","MoKα","","0.1302","0.0754","","","0.1963","0.2311","","","","","","1.032","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214349","7.4198","0.0001","9.8609","0.0001","14.6526","0.0002","90","","90.3167","0.0005","90","","1072.05","0.02","150","","150","","","","","","","","synthesized","4","P 1 21/m 1","-P 2yb","11","","","","- C13 H12 Fe N2 -","- C13 H12 Fe N2 -","- C52 H48 Fe4 N8 -","4","1","","Caballero, Antonio; White, Nicholas G.; Beer, Paul D.","A ferrocene imidazolium-based macrocycle as an electrochemical chemosensor for halide anions","CrystEngComm","2014","16","18","3694","","10.1039/c3ce41851k","","","0.71073","MoKα","","0.0656","0.0358","","0.1085","0.0792","0.1085","","","","","","1.0157","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214350","12.2315","0.0001","12.4402","0.0002","14.9115","0.0002","95.1399","0.0005","101.642","0.0006","117.665","0.0007","1923.8","0.05","150","","150","","","","","","","","synthesized","6","P -1","-P 1","2","","","","- C43 H42 Fe2 I2 N4 O -","- C43 H42 Fe2 I2 N4 O -","- C86 H84 Fe4 I4 N8 O2 -","2","1","","Caballero, Antonio; White, Nicholas G.; Beer, Paul D.","A ferrocene imidazolium-based macrocycle as an electrochemical chemosensor for halide anions","CrystEngComm","2014","16","18","3694","","10.1039/c3ce41851k","","","0.71073","MoKα","","0.036","0.0267","","0.075","0.0656","0.075","","","","","","0.8707","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214351","14.943","0.0006","17.0436","0.0007","26.1853","0.0011","101.948","0.002","97.566","0.002","111.014","0.002","5933.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","CVT-53-B2 bromo pentyl ethylene cavitand","","- C122 H151 Br8 N5 O16 -","- C122 H151 Br8 N5 O16 -","- C244 H302 Br16 N10 O32 -","2","1","","Aakeröy, Christer B.; Chopade, Prashant D.; Quinn, Colette F.; Desper, John","Structure and thermodynamics of a multimeric cavitand assembly","CrystEngComm","2014","16","18","3796","","10.1039/c3ce42447b","","","0.71073","MoKα","","0.0487","0.0337","","","0.0843","0.0906","","","","","","0.989","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214352","12.7536","0.0006","13.7525","0.0007","24.5901","0.0012","105.279","0.002","95.784","0.002","102.12","0.002","4011.7","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","CJ-1 ethano 3-pyridyl CVT, (ethanol)9","","- C170 H222 N8 O25 -","- C170 H222 N8 O25 -","- C170 H222 N8 O25 -","1","0.5","","Aakeröy, Christer B.; Chopade, Prashant D.; Quinn, Colette F.; Desper, John","Structure and thermodynamics of a multimeric cavitand assembly","CrystEngComm","2014","16","18","3796","","10.1039/c3ce42447b","","","0.71073","MoKα","","0.1515","0.0963","","","0.2796","0.3349","","","","","","1.038","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214353","13.321","0.0009","52.697","0.004","16.3401","0.0011","90","","109.773","0.003","90","","10794.1","1.3","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","P-1-5 [tetra(3-pyridyl) CVT]2, (4-NO2-PhCOOH)8 (PhNO2)5 (H2 O)2","","- C238 H237 N21 O60 -","- C238 H237 N21 O60 -","- C476 H474 N42 O120 -","2","0.5","","Aakeröy, Christer B.; Chopade, Prashant D.; Quinn, Colette F.; Desper, John","Structure and thermodynamics of a multimeric cavitand assembly","CrystEngComm","2014","16","18","3796","","10.1039/c3ce42447b","","","1.54178","CuKα","","0.0755","0.0629","","","0.1685","0.1806","","","","","","1.056","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214354","15.7322","0.0004","24.0717","0.0007","41.3778","0.0012","90","","90","","90","","15669.8","0.8","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C148.7 H226.7 N8.7 O42.1 -","- C149.17 H225.31 N8.68 O42.27 -","- C596.68 H901.24 N34.72 O169.08 -","4","1","","Wierzbicki, Michał; Gilski, Mirosław; Rissanen, Kari; Jaskólski, Mariusz; Szumna, Agnieszka","Experiences with applications of macromolecular tools in supramolecular crystallography","CrystEngComm","2014","16","18","3773","","10.1039/c3ce42288g","","","1.54178","CuKα","","0.1037","0.0995","","","0.2487","0.2519","","","","","","1.161","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214355","15.7322","0.0004","24.0717","0.0007","41.3778","0.0012","90","","90","","90","","15669.8","0.8","148","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C133.5 H197 N8 O37.5 -","- C133.5 H197 N8 O37.5 -","- C534 H788 N32 O150 -","4","1","","Wierzbicki, Michał; Gilski, Mirosław; Rissanen, Kari; Jaskólski, Mariusz; Szumna, Agnieszka","Experiences with applications of macromolecular tools in supramolecular crystallography","CrystEngComm","2014","16","18","3773","","10.1039/c3ce42288g","","","1.54178","CuKα","","0.0815","0.0757","","","0.1964","0.201","","","","","","1.055","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214356","22.0457","0.0007","22.4594","0.0007","23.5621","0.0008","65.687","0.002","82.024","0.002","74.965","0.002","10261","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C436 H556 Cu24 O96 -","- C384 H477 Cu24 O105.5 -","- C384 H477 Cu24 O105.5 -","1","0.5","","Kumari, Harshita; Mossine, Andrew V.; Schuster, Nathaniel J.; Barnes, Charles L.; Deakyne, Carol A.; Atwood, Jerry L.","Packing arrangements of copper-seamed C-alkylpyrogallol[4]arene nanocapsules with varying chain lengths","CrystEngComm","2014","16","18","3718","","10.1039/c3ce42412j","","","1.54178","CuKα","","0.1057","0.0903","","","0.2578","0.2783","","","","","","1.016","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214357","13.595","0.005","3.71","0.002","24.063","0.009","90","","100.08","0.018","90","","1194.9","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1:1 pico:sal","","","- C13 H12 N2 O4 -","- C13 H12 N2 O4 -","- C52 H48 N8 O16 -","4","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0612","0.0573","","","0.1221","0.1265","","","","","","1.201","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214358","32.561","0.01","5.078","0.002","20.831","0.006","90","","105.811","0.013","90","","3314","1.9","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2:1 pico:succ","","","- C16 H18 N4 O6 -","- C16 H18 N4 O6 -","- C128 H144 N32 O48 -","8","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0471","0.0422","","","0.096","0.1006","","","","","","0.92","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214359","8.479","0.003","4.979","0.002","19.167","0.007","90","","90.083","0.018","90","","809.2","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2:1 pico:fum","","","- C8 H8 N2 O3 -","- C8 H8 N2 O3 -","- C32 H32 N8 O12 -","4","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.051","0.0465","","","0.1055","0.1093","","","","","","1.2","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214360","7.546","0.002","11.745","0.003","10.595","0.003","90","","90.21","0.013","90","","939","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2:1 pico:adi","","","- C9 H11 N2 O3 -","- C9 H11 N2 O3 -","- C36 H44 N8 O12 -","4","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0342","0.031","","","0.0824","0.0855","","","","","","1.092","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214361","7.006","0.002","20.51","0.006","9.125","0.003","90","","106.06","0.02","90","","1260","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1:1 pico:adi","","","- C12 H16 N2 O5 -","- C12 H16 N2 O5 -","- C48 H64 N8 O20 -","4","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0419","0.0334","","","0.0946","0.1083","","","","","","0.498","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214362","21.95","0.02","5.22","0.007","17.26","0.019","90","","118.86","0.05","90","","1732","3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2:1 pico:glu","","","- C8.5 H10 N2 O3 -","- C8.5 H10 N2 O3 -","- C68 H80 N16 O24 -","8","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0838","0.0692","","","0.1777","0.1953","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214363","5.287","0.001","11.163","0.002","19.899","0.004","90","","96.704","0.009","90","","1166.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","pico form I","","","- C6 H6 N2 O -","- C6 H6 N2 O -","- C48 H48 N16 O8 -","8","2","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0455","0.0391","","","0.0987","0.1031","","","","","","1.084","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214364","5.39","0.002","9.897","0.003","24.214","0.006","90","","90.699","0.013","90","","1291.6","0.7","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","1:1 pico:man","","","- C14 H14 N2 O4 -","- C14 H14 N2 O4 -","- C56 H56 N8 O16 -","4","2","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0287","0.0271","","","0.0695","0.0708","","","","","","1.066","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214365","5.166","0.001","7.666","0.002","13.086","0.003","74.73","0.011","81.423","0.012","77.409","0.013","485.6","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","1:1 pico:mal","","","- C9 H10 N2 O5 -","- C9 H10 N2 O5 -","- C18 H20 N4 O10 -","2","1","","Chan, H. C. Stephen; Woollam, Grahame R.; Wagner, Trixie; Schmidt, Martin U.; Lewis, Richard A.","Can picolinamide be a promising cocrystal former?","CrystEngComm","2014","16","21","4365","","10.1039/c4ce00265b","","","1.54178","CuKα","","0.0335","0.0315","","","0.0859","0.088","","","","","","1.052","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214372","19.2271","0.0004","19.2271","0.0004","10.2751","0.0002","90","","90","","120","","3289.61","0.12","298","2","296","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C24 H30 N4 O3 -","- C24 H30 N4 O3 -","- C144 H180 N24 O18 -","6","0.333333","","Hoque, Md. Najbul; Das, Gopal","Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide‒water [Br5‒(H2O)6]5− and iodide‒water [I2‒(H2O)4]2− clusters in cationic tripodal receptor","CrystEngComm","2014","16","21","4447","","10.1039/c4ce00149d","","","0.71073","MoKα","","0.0379","0.0349","","","0.1059","0.1095","","","","","","0.906","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214373","23.2013","0.0012","11.1503","0.0004","24.7773","0.001","90","","114.561","0.006","90","","5829.9","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H44 F4 N4 O8 -","- C24 H44 F4 N4 O8 -","- C192 H352 F32 N32 O64 -","8","1","","Hoque, Md. Najbul; Das, Gopal","Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide‒water [Br5‒(H2O)6]5− and iodide‒water [I2‒(H2O)4]2− clusters in cationic tripodal receptor","CrystEngComm","2014","16","21","4447","","10.1039/c4ce00149d","","","0.71073","MoKα","","0.1039","0.078","","","0.2311","0.2563","","","","","","0.98","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214374","12.7399","0.0008","12.7399","0.0008","62.039","0.005","90","","90","","120","","8720.2","1","298","2","298","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C24 H34 Cl4 N4 O3 -","- C24 H34 Cl4 N4 O3 -","- C288 H408 Cl48 N48 O36 -","12","0.333333","","Hoque, Md. Najbul; Das, Gopal","Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide‒water [Br5‒(H2O)6]5− and iodide‒water [I2‒(H2O)4]2− clusters in cationic tripodal receptor","CrystEngComm","2014","16","21","4447","","10.1039/c4ce00149d","","","0.71073","MoKα","","0.0715","0.0478","","","0.1313","0.1497","","","","","","1.004","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214375","11.4963","0.0006","12.2339","0.0006","13.0811","0.0008","111.373","0.005","113.194","0.005","94.457","0.004","1521.27","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H39 Cl4 N4 O5.5 -","- C24 H38 Cl4 N4 O5.5 -","- C48 H76 Cl8 N8 O11 -","2","1","","Hoque, Md. Najbul; Das, Gopal","Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide‒water [Br5‒(H2O)6]5− and iodide‒water [I2‒(H2O)4]2− clusters in cationic tripodal receptor","CrystEngComm","2014","16","21","4447","","10.1039/c4ce00149d","","","0.71073","MoKα","","0.0682","0.0492","","","0.1656","0.2006","","","","","","0.69","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7214376","12.6464","0.0004","11.5355","0.0004","24.2735","0.0008","90","","104.935","0.002","90","","3421.5","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H44 Br4 N4 O8 -","- C24 H43 Br4 N4 O8 -","- C96 H172 Br16 N16 O32 -","4","1","","Hoque, Md. Najbul; Das, Gopal","Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide‒water [Br5‒(H2O)6]5− and iodide‒water [I2‒(H2O)4]2− clusters in cationic tripodal receptor","CrystEngComm","2014","16","21","4447","","10.1039/c4ce00149d","","","0.71073","MoKα","","0.0545","0.0353","","","0.1029","0.1205","","","","","","0.887","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214377","12.6814","0.0006","13.0383","0.0006","20.9938","0.001","75.377","0.002","87.245","0.002","88.453","0.002","3354.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H37.5 I4 N4 O4.75 -","- C24 H36 I4 N4 O4.75 -","- C96 H144 I16 N16 O19 -","4","2","","Hoque, Md. Najbul; Das, Gopal","Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide‒water [Br5‒(H2O)6]5− and iodide‒water [I2‒(H2O)4]2− clusters in cationic tripodal receptor","CrystEngComm","2014","16","21","4447","","10.1039/c4ce00149d","","","0.71073","MoKα","","0.0965","0.0677","","","0.1751","0.1946","","","","","","1.112","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7214378","13.656","0.007","23.854","0.014","35.19","0.02","107.825","0.009","90.226","0.012","96.903","0.004","10824","10","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","","","","- C176 H231 N16 O85.5 P12 Zn18 -","- C176 H180 N16 O85.5 P12 Zn18 -","- C352 H360 N32 O171 P24 Zn36 -","2","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","New 2D zinc phosphonates with heptanuclear units, reversible dehydration‒hydration and bright luminescence","CrystEngComm","2014","16","24","5387","","10.1039/c4ce00322e","","","0.71073","MoKα","","0.1026","0.0811","","","0.19","0.2047","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214379","14.909","0.005","18.496","0.006","21.715","0.007","90","","99.53","0.005","90","","5905","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C92 H124 N12 O40 P6 Zn9 -","- C92 H104 N12 O40 P6 Zn9 -","- C184 H208 N24 O80 P12 Zn18 -","2","0.5","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","New 2D zinc phosphonates with heptanuclear units, reversible dehydration‒hydration and bright luminescence","CrystEngComm","2014","16","24","5387","","10.1039/c4ce00322e","","","0.71073","MoKα","","0.0513","0.044","","","0.127","0.1351","","","","","","1.133","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214380","8.0715","0.0007","16","0.0015","3.5454","0.0003","90","","101.255","0.001","90","","449.06","0.07","296","2","296","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Ca4.01 O10 Tb0.99 -","- B3 Ca3.954 O10 Tb1.046 -","- B6 Ca7.908 O20 Tb2.092 -","2","0.5","","Yuan, Dongsheng; Jia, Zhitai; Wang, Jian; Gao, Zeliang; Zhang, Junjie; Fu, Xiuwei; Shu, Jun; Yin, Yanru; Hu, Qiangqiang; Tao, Xutang","Bulk growth, structure, and characterization of the new monoclinic TbCa4O(BO3)3 crystal","CrystEngComm","2014","16","19","4008","","10.1039/c4ce00051j","","","0.71073","MoKα","","0.0327","0.0305","","","0.0838","0.0792","","","","","","1.468","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214381","8.8213","0.0018","9.1383","0.0018","13.398","0.003","86.62","0.03","89.74","0.03","74.37","0.03","1038.2","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H14 Cd N2 O13 S Sm -","- C15 H12 Cd N2 O13 S Sm -","- C30 H24 Cd2 N4 O26 S2 Sm2 -","2","1","","Sun, Yan-Qiong; Liu, Qi; Zhou, Liang-Liang; Chen, Yi-Ping","Ln‒Cd heterometal organic‒inorganic hybrid materials based on diverse Ln‒Cd oxo-cluster chains: syntheses, structures and visible luminescence","CrystEngComm","2014","16","19","3986","","10.1039/c3ce42278j","","","0.71073","MoKα","","0.0677","0.066","","","0.182","0.1845","","","","","","1.097","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214382","8.6945","0.0017","8.9967","0.0018","13.246","0.003","86.66","0.03","89.75","0.03","74.51","0.03","996.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H14 Cd Eu N2 O13 S -","- C15 H14 Cd Eu N2 O13 S -","- C30 H28 Cd2 Eu2 N4 O26 S2 -","2","1","","Sun, Yan-Qiong; Liu, Qi; Zhou, Liang-Liang; Chen, Yi-Ping","Ln‒Cd heterometal organic‒inorganic hybrid materials based on diverse Ln‒Cd oxo-cluster chains: syntheses, structures and visible luminescence","CrystEngComm","2014","16","19","3986","","10.1039/c3ce42278j","","","0.71073","MoKα","","0.0571","0.0471","","","0.1224","0.1345","","","","","","1.101","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214383","9.6399","0.0019","9.924","0.002","22.078","0.004","90","","91.64","0.03","90","","2111.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 Cd2 Eu N4 O13 -","- C14 H13 Cd2 Eu N4 O13 -","- C56 H52 Cd8 Eu4 N16 O52 -","4","1","","Sun, Yan-Qiong; Liu, Qi; Zhou, Liang-Liang; Chen, Yi-Ping","Ln‒Cd heterometal organic‒inorganic hybrid materials based on diverse Ln‒Cd oxo-cluster chains: syntheses, structures and visible luminescence","CrystEngComm","2014","16","19","3986","","10.1039/c3ce42278j","","","0.71073","MoKα","","0.0366","0.0298","","","0.069","0.072","","","","","","0.997","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214384","6.052","0.006","4.919","0.005","36.98","0.03","90","","94.115","0.004","90","","1098","1.8","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 N3 O -","- C14 H9 N3 O -","- C56 H36 N12 O4 -","4","1","","Mutai, Toshiki; Shono, Hideaki; Shigemitsu, Yasuhiro; Araki, Koji","Three-color polymorph-dependent luminescence: crystallographic analysis and theoretical study on excited-state intramolecular proton transfer (ESIPT) luminescence of cyano-substituted imidazo[1,2-a]pyridine","CrystEngComm","2014","16","19","3890","","10.1039/c3ce42627k","","","0.7107","MoKα","","0.1193","0.0754","","","0.191","0.2201","","","","","","0.938","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214385","13.654","0.006","7.343","0.003","14.2","0.006","90","","130.054","0.002","90","","1089.8","0.8","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 N3 O -","- C14 H9 N3 O -","- C56 H36 N12 O4 -","4","1","","Mutai, Toshiki; Shono, Hideaki; Shigemitsu, Yasuhiro; Araki, Koji","Three-color polymorph-dependent luminescence: crystallographic analysis and theoretical study on excited-state intramolecular proton transfer (ESIPT) luminescence of cyano-substituted imidazo[1,2-a]pyridine","CrystEngComm","2014","16","19","3890","","10.1039/c3ce42627k","","","0.7107","MoKα","","0.0416","0.0334","","","0.0922","0.0963","","","","","","1.097","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214386","3.8196","0.001","11.356","0.003","25.246","0.007","90","","93.196","0.001","90","","1093.4","0.5","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 N3 O -","- C14 H9 N3 O -","- C56 H36 N12 O4 -","4","1","","Mutai, Toshiki; Shono, Hideaki; Shigemitsu, Yasuhiro; Araki, Koji","Three-color polymorph-dependent luminescence: crystallographic analysis and theoretical study on excited-state intramolecular proton transfer (ESIPT) luminescence of cyano-substituted imidazo[1,2-a]pyridine","CrystEngComm","2014","16","19","3890","","10.1039/c3ce42627k","","","0.7107","MoKα","","0.0706","0.0591","","","0.1298","0.1328","","","","","","0.929","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214387","6.9166","0.0001","8.1526","0.0005","19.4288","0.0011","83.25","0.005","84.511","0.003","71.107","0.003","1027.41","0.09","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H32 As F6 S16 -","- C28 H32 As F6 S16 -","- C28 H32 As F6 S16 -","1","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0588","0.0418","","","0.0941","0.1021","","","","","","1.078","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214388","6.9129","0.0005","8.1497","0.0003","19.4274","0.0009","83.261","0.005","84.544","0.005","71.107","0.004","1026.48","0.1","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H32 As F6 S16 -","- C28 H32 As F6 S16 -","- C28 H32 As F6 S16 -","1","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0468","0.0376","","","0.0912","0.0962","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214389","6.8912","0.0003","8.1537","0.0004","19.392","0.0006","83.68","0.003","84.452","0.004","70.835","0.003","1020.84","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H32 As F6 S16 -","- C28 H32 As F6 S16 -","- C28 H32 As F6 S16 -","1","0.5","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0529","0.0389","","","0.0951","0.1013","","","","","","1.03","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214390","6.8834","0.0005","8.2494","0.0004","19.4622","0.0013","84.137","0.006","84.642","0.006","71.382","0.005","1039.66","0.12","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H32 F6 S16 Sb -","- C28 H32 F6 S16 Sb -","- C28 H32 F6 S16 Sb -","1","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0502","0.039","","","0.0894","0.0948","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214391","6.8792","0.0002","8.2487","0.0004","19.453","0.0012","84.123","0.004","84.581","0.005","71.299","0.003","1037.85","0.09","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H32 F6 S16 Sb -","- C28 H32 F6 S16 Sb -","- C28 H32 F6 S16 Sb -","1","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0378","0.0332","","","0.0851","0.088","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214392","6.872","0.0006","8.2521","0.0004","19.4369","0.0012","84.441","0.004","84.474","0.005","71.056","0.005","1035.17","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H32 F6 S16 Sb -","- C28 H32 F6 S16 Sb -","- C28 H32 F6 S16 Sb -","1","0.5","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.04","0.033","","","0.0875","0.0909","","","","","","1.08","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214393","6.4428","0.0003","13.612","0.002","11.8759","0.0012","90","","91.722","0.005","90","","1041.04","0.19","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","(R)-TMBEDT axial","","","- C14 H16 S8 -","- C14 H16 S8 -","- C28 H32 S16 -","2","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0733","0.0405","","","0.0926","0.1077","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214394","7.3179","0.0005","7.7876","0.0007","26.499","0.002","85.239","0.003","84.402","0.003","68.304","0.004","1394.67","0.19","150","2","150","2","","","","","","","","4","P 1","P 1","1","","S,S,S,S-TMET.TCNQ (from 1,1,2-trichloroethane)","","- C26 H20 N4 S8 -","- C26 H20 N4 S8 -","- C52 H40 N8 S16 -","2","2","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0541","0.0494","","","0.125","0.1287","","","","","","1.063","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214395","7.318","0.0001","7.8325","0.0001","28.2325","0.0006","94.287","0.001","95.535","0.001","110.993","0.001","1493.34","0.04","120","2","120","2","","","","","","","","5","P 1","P 1","1","","S,S,S,S-TMET.TCNQ.0.5THF","","- C56 H48 N8 O S16 -","- C56 H48 N8 O S16 -","- C56 H48 N8 O S16 -","1","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0493","0.0403","","","0.0834","0.0882","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214396","8.4889","0.0002","13.7156","0.0002","14.0914","0.0003","110.844","0.001","100.807","0.001","107.048","0.001","1385.53","0.05","120","2","120","2","","","","","","","","5","P 1","P 1","1","","S,S,S,S -Tetramethyl-BEDT-TTF.TCNQ-F4 complex","","- C26 H16 F4 N4 S8 -","- C26 H16 F4 N4 S8 -","- C52 H32 F8 N8 S16 -","2","2","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0429","0.0367","","","0.0823","0.087","","","","","","1.02","","","","has coordinates","180474","2020-10-21","18:00:00",""
"7214397","13.4068","0.0004","5.1484","0.0001","22.4161","0.0006","90","","101.16","0.001","90","","1517.98","0.07","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","S,S,S,S Bis(pentane-2,4-dithio)TTF.tetrafluoro-TCNQ","","- C28 H20 F4 N4 S8 -","- C28 H20 F4 N4 S8 -","- C56 H40 F8 N8 S16 -","2","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0486","0.0412","","","0.0962","0.1003","","","","","","1.036","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214398","5.6084","0.0004","8.6087","0.0007","27.868","0.002","90","","90.489","0.004","90","","1345.45","0.17","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(ethylenedithio)(2S,4S-pentane-2,4-dithio)TTF. tetrafluoro-TCNQ molecular complex","","- C25 H14 F4 N4 S8 -","- C25 H14 F4 N4 S8 -","- C50 H28 F8 N8 S16 -","2","1","","Yang, Songjie; Pop, Flavia; Melan, Caroline; Brooks, Andrew C.; Martin, Lee; Horton, Peter; Auban-Senzier, Pascale; Rikken, Geert L. J. A.; Avarvari, Narcis; Wallis, John D.","Charge transfer complexes and radical cation salts of chiral methylated organosulfur donors","CrystEngComm","2014","16","19","3906","","10.1039/c3ce42539h","","","0.71073","MoKα","","0.0726","0.0504","","","0.1136","0.1254","","","","","","1.058","","","","has coordinates,has disorder","180474","2020-10-21","18:00:00",""
"7214399","16.397","0.003","18.642","0.003","7.9656","0.0013","90","","90","","90","","2434.9","0.7","291","2","291","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C35 H36 N4 O12 Zn2 -","- C35 H36 N4 O12 Zn2 -","- C70 H72 N8 O24 Zn4 -","2","0.5","","Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen","Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane","CrystEngComm","2014","16","19","3917","","10.1039/c3ce42477d","","","0.71073","MoKα","","0.0564","0.0528","","","0.1338","0.1366","","","","","","1.044","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7214400","15.4019","0.001","15.4019","0.001","8.4768","0.0011","90","","90","","90","","2010.9","0.3","293","2","293","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C37 H48 Cu2 N4 O16 -","- C37 H48 Cu2 N4 O16 -","- C74 H96 Cu4 N8 O32 -","2","0.25","","Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen","Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane","CrystEngComm","2014","16","19","3917","","10.1039/c3ce42477d","","","0.71073","MoKα","","0.0941","0.0748","","","0.1689","0.1792","","","","","","1.027","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7214401","32.119","0.003","12.8479","0.001","20.8244","0.0016","90","","90","","90","","8593.4","1.2","291","2","291","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C33 H34 N6 O14 Zn2 -","- C33 H34 N6 O14 Zn2 -","- C264 H272 N48 O112 Zn16 -","8","0.5","","Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen","Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane","CrystEngComm","2014","16","19","3917","","10.1039/c3ce42477d","","","0.71073","MoKα","","0.0612","0.056","","","0.1495","0.1509","","","","","","1.063","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7214402","17.334","0.002","9.2474","0.001","20.562","0.002","90","","108.815","0.004","90","","3119.9","0.6","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H32 N4 Ni O12 -","- C29 H32 N4 Ni O12 -","- C116 H128 N16 Ni4 O48 -","4","0.5","","Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen","Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane","CrystEngComm","2014","16","19","3917","","10.1039/c3ce42477d","","","0.71073","MoKα","","0.0453","0.0427","","","0.1205","0.1221","","","","","","1.123","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7214403","11.4622","0.0015","9.4091","0.0012","22.611","0.003","90","","91.698","0.002","90","","2437.5","0.6","291","2","291","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H60 Cd2 N4 O20 -","- C41 H60 Cd2 N4 O20 -","- C82 H120 Cd4 N8 O40 -","2","0.5","","Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen","Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane","CrystEngComm","2014","16","19","3917","","10.1039/c3ce42477d","","","0.71073","MoKα","","0.0554","0.0459","","","0.1212","0.1302","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214404","15.355","0.005","6.908","0.002","32.838","0.011","90","","99.157","0.005","90","","3438.8","1.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H27 Er N6 O6 -","- C42 H27 Er N6 O6 -","- C168 H108 Er4 N24 O24 -","4","1","","Li, Teng; Hong, Xu-Jia; Liu, Xiang; Chen, Rong; Zhan, Qing-Guang; Xu, Xuan; Cai, Yue-Peng","Construction of three pH-dependent luminescent metal‒organic frameworks with 3-(4-carboxyphen-yl)-1,3-benzoimidazole","CrystEngComm","2014","16","19","3883","","10.1039/c4ce00125g","","","0.71073","MoKα","","0.1102","0.066","","","0.1498","0.1704","","","","","","1.053","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214405","11.359","0.003","14.308","0.006","18.162","0.007","90","","127.87","0.02","90","","2330.1","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H18 N4 O4 Zn -","- C28 H18 N4 O4 Zn -","- C112 H72 N16 O16 Zn4 -","4","1","","Li, Teng; Hong, Xu-Jia; Liu, Xiang; Chen, Rong; Zhan, Qing-Guang; Xu, Xuan; Cai, Yue-Peng","Construction of three pH-dependent luminescent metal‒organic frameworks with 3-(4-carboxyphen-yl)-1,3-benzoimidazole","CrystEngComm","2014","16","19","3883","","10.1039/c4ce00125g","","","0.71073","MoKα","","0.1549","0.0573","","","0.0963","0.133","","","","","","1.05","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214406","18.884","0.0017","18.884","0.0017","22.448","0.003","90","","90","","90","","8005.1","1.5","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C56 H72 Cl6 Er4 N8 O44 Zn -","- C56 H64 Cl6 Er4 N8 O44 Zn -","- C224 H256 Cl24 Er16 N32 O176 Zn4 -","4","0.25","","Li, Teng; Hong, Xu-Jia; Liu, Xiang; Chen, Rong; Zhan, Qing-Guang; Xu, Xuan; Cai, Yue-Peng","Construction of three pH-dependent luminescent metal‒organic frameworks with 3-(4-carboxyphen-yl)-1,3-benzoimidazole","CrystEngComm","2014","16","19","3883","","10.1039/c4ce00125g","","","0.71073","MoKα","","0.1133","0.0613","","","0.1418","0.169","","","","","","1.138","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214407","5.116","0.0004","5.1957","0.0004","19.5042","0.0016","90.704","0.002","93.362","0.002","91.346","0.002","517.36","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF 312 (4-pyridyl)-CONH-(CH2)4-NHCO-(4-pyridyl), HOOC-(CH2)4-COOH","","- C22 H28 N4 O6 -","- C22 H28 N4 O6 -","- C22 H28 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0437","0.0375","","","0.1069","0.1132","","","","","","1.057","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214408","5.1221","0.0004","5.2045","0.0004","21.5019","0.0014","94.963","0.002","95.404","0.002","91.63","0.002","568.12","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF313 (4-pyridyl)-CONH-(CH2)4-NHCO-(4-pyridyl) HOOC-(CH2)6-COOH","","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0529","0.0429","","","0.1227","0.1303","","","","","","1.064","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214409","5.1072","0.0004","5.1171","0.0004","22.119","0.002","96.134","0.006","94.037","0.006","91.34","0.006","573.05","0.08","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF11 (4-pyridyl-CONH-(CH2)8-NHCO-(4-pyridyl), succinic acid","","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0597","0.0471","","","0.1143","0.123","","","","","","1.032","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214410","5.1403","0.0003","5.2489","0.0003","22.9829","0.0015","93.859","0.004","95.267","0.004","91.289","0.004","615.82","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","Adip+A44 4-pyridyl-CONH-(CH2)8-NHCO-4-pyridyl, HOOC-(CH2)8-COOH","","- C26 H36 N4 O6 -","- C26 H36 N4 O6 -","- C26 H36 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.057","0.0402","","","0.1061","0.1154","","","","","","1.045","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214411","5.142","0.0004","5.2541","0.0004","24.624","0.002","89.785","0.004","87.095","0.004","88.59","0.004","664.2","0.09","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","A44-Sub 4-pyridyl-CONH-(CH2)8-NHCO-4-pyridyl, HOOC-(CH2)6-COOH","","- C28 H40 N4 O6 -","- C28 H40 N4 O6 -","- C28 H40 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0706","0.0473","","","0.123","0.1384","","","","","","1.005","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214412","5.1264","0.0006","5.2432","0.0006","26.127","0.003","85.874","0.004","89.354","0.004","88.356","0.004","700.12","0.14","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF 305 (4-pyridyl)-CONH-(CH2)8-NHCO-(4-pyridyl), HOOC-(CH2)8-COOH","","- C30 H44 N4 O6 -","- C30 H44 N4 O6 -","- C30 H44 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0956","0.0614","","","0.1655","0.1827","","","","","","1.084","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214413","5.0275","0.0006","6.9253","0.0009","16.058","0.002","89.749","0.006","81.536","0.005","80.893","0.006","545.93","0.12","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","C44-Succ 4-pyridyl-CONH-(CH2)6-NHCO-4-pyridyl, succinic acid","","- C22 H28 N4 O6 -","- C22 H28 N4 O6 -","- C22 H28 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0533","0.0431","","","0.1222","0.1305","","","","","","1.041","","","","has coordinates,has disorder","180475","2020-10-21","18:00:00",""
"7214414","5.0282","0.0006","6.7877","0.0008","17.522","0.002","98.124","0.003","97.604","0.003","94.605","0.003","583.82","0.12","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF 300 (3-pyridyl)-COHN-(CH2)6-NHCO-(3-pyridyl), HOOC-(CH2)4-COOH","","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0688","0.0487","","","0.127","0.14","","","","","","1.084","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214415","5.1671","0.0013","11.646","0.003","11.779","0.004","67.873","0.011","80.585","0.012","79.827","0.012","642.6","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","SF 301 (3-pyridyl)-CONH-(CH2)-6-NHCO-(3-pyridyl), HOOC-(CH2)6-COOH","","- C26 H36 N4 O6 -","- C26 H36 N4 O6 -","- C26 H36 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.1002","0.0563","","","0.1407","0.1599","","","","","","1.07","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214416","4.9817","0.0004","6.8634","0.0006","20.0493","0.0016","93.097","0.004","90.233","0.004","98.285","0.004","677.32","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF 274 3-pyridyl-CONH-(CH2)6-NHCO-3-pyridyl, HOOC-(CH2)8-COOH","","- C28 H40 N4 O6 -","- C28 H40 N4 O6 -","- C28 H40 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0676","0.0517","","","0.1446","0.1571","","","","","","1.091","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214417","4.9821","0.0004","6.8797","0.0006","21.441","0.0017","87.936","0.006","86.223","0.006","81.469","0.005","724.93","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF10 3-pyridyl-CONH-(CH2)6-NHCO-3-pyridyl, HOOC-(CH2)10-COOH","","- C30 H44 N4 O6 -","- C30 H44 N4 O6 -","- C30 H44 N4 O6 -","1","0.5","","Aakeröy, Christer B.; Forbes, Safiyyah; Desper, John","Altering physical properties of pharmaceutical co-crystals in a systematic manner","CrystEngComm","2014","16","26","5870","","10.1039/c4ce00206g","","","0.71073","MoKα","","0.0854","0.051","","","0.1297","0.1478","","","","","","1.017","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214418","8.2633","0.0003","7.3098","0.0003","5.5317","0.0002","90","","99.088","0.003","90","","329.94","0.02","180","","180","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","ethylamine","","- C2 H7 N -","- C2 H7 N -","- C8 H28 N4 -","4","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.0424","0.0375","","0.0854","0.0834","0.0854","","","","","","0.925","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214419","8.9742","0.00018","5.21927","0.00008","7.40243","0.00016","90","","112.972","0.0013","90","","319.224","0.011","150","","150","","","","","","","","Aldrich","3","P 1 21/c 1","-P 2ybc","14","ethylamine","ethylamine","","- C2 H7 N -","- C2 H7 N -","- C8 H28 N4 -","4","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","powder diffraction","","1.5406","CuKα1","","","","","","","","","","","","","","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214420","23.287","0.0013","6.2354","0.0004","5.9794","0.0004","90","","90","","90","","868.23","0.09","150","","150","","","","","","","","Aldrich","3","P b c n","-P 2n 2ab","60","","propylamine","","- C3 H9 N -","- C3 H9 N -","- C24 H72 N8 -","8","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.0777","0.0598","","0.1494","0.1337","0.1494","","","","","","0.9898","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214421","26.7852","0.0008","6.8166","0.0002","5.6703","0.0002","90","","90","","90","","1035.31","0.06","150","","150","","","","","","","","Aldrich","3","P b c n","-P 2n 2ab","60","","Butylamine","","- C4 H11 N -","- C4 H11 N -","- C32 H88 N8 -","8","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.0562","0.0471","","0.1423","0.1219","0.1423","","","","","","1.105","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214422","33.546","0.004","6.4878","0.0008","5.7295","0.0007","90","","90","","90","","1247","0.3","150","","150","","","","","","","","Aldrich","3","P b c n","-P 2n 2ab","60","","pentylamine","","- C5 H13 N -","- C5 H13 N -","- C40 H104 N8 -","8","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.1555","0.0612","","0.1959","0.1373","0.1959","","","","","","0.9616","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214423","6.9725","0.0003","17.7977","0.0006","5.6105","0.0002","90","","90","","90","","696.23","0.05","150","","150","","","","","","","","Aldrich","3","P c a 21","P 2c -2ac","29","","hexylamine","","- C6 H15 N -","- C6 H15 N -","- C24 H60 N4 -","4","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.0504","0.0418","","0.1078","0.0969","0.1078","","","","","","1.0087","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214424","5.5669","0.0005","41.7","0.004","6.9982","0.0007","90","","90","","90","","1624.6","0.3","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","heptylamine","","- C7 H17 N -","- C7 H17 N -","- C56 H136 N8 -","8","2","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.1758","0.0745","","0.3126","0.2017","0.3126","","","","","","1.088","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214425","7.0309","0.0005","22.3077","0.0015","5.5826","0.0004","90","","90","","90","","875.59","0.11","150","","150","","","","","","","","Aldrich","3","P c a 21","P 2c -2ac","29","","octylamine","","- C8 H19 N -","- C8 H19 N -","- C32 H76 N4 -","4","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.055","0.0536","","0.1084","0.1062","0.1084","","","","","","1.0043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214426","5.5458","0.0002","50.6527","0.0017","7.0521","0.0002","90","","90.04","0.002","90","","1981","0.11","150","","150","","","","","","","","Aldrich","3","P 1 21/c 1","-P 2ybc","14","","nonylamine","","- C9 H21 N -","- C9 H21 N -","- C72 H168 N8 -","8","2","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.0924","0.0369","","0.1425","0.0946","0.1425","","","","","","0.8769","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214427","7.066","0.0004","26.8352","0.0015","5.573","0.0003","90","","90","","90","","1056.74","0.1","150","","150","","","","","","","","Aldrich","3","P c a 21","P 2c -2ac","29","","decylamine","","- C10 H23 N -","- C10 H23 N -","- C40 H92 N4 -","4","1","","Maloney, Andrew G. P.; Wood, Peter A.; Parsons, Simon","Competition between hydrogen bonding and dispersion interactions in the crystal structures of the primary amines","CrystEngComm","2014","16","19","3867","","10.1039/c3ce42639d","","","0.71073","MoKα","","0.0592","0.0536","","0.1229","0.1187","0.1229","","","","","","0.9762","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214428","6.065","0.003","4.463","0.002","11.55","0.006","90","","90.081","0.006","90","","312.6","0.3","293","2","293","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- B3 Be4 K O9 -","- B3 Be4 K O9 -","- B6 Be8 K2 O18 -","2","0.5","","Wang, Shichao; Ye, Ning; Zou, Guohong","A new alkaline beryllium borate KBe4B3O9 with ribbon alveolate [Be2BO5]∞layers and the structural evolution of ABe4B3O9(A = K, Rb and Cs)","CrystEngComm","2014","16","19","3971","","10.1039/c4ce00085d","","","0.71073","MoKα","","0.02","0.0194","","","0.0544","0.0548","","","","","","1.131","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214429","12.443","0.002","6.5577","0.0011","21.666","0.003","90","","93.151","0.002","90","","1765.2","0.5","293","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-bis((tert-butylsulfinyl)methyl)benzene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C64 H104 O8 S8 -","4","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.0813","0.0573","","","0.1502","0.1645","","","","","","1.062","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214430","8.2584","0.0014","10.6118","0.0018","11.751","0.002","67.631","0.002","72.609","0.002","69.331","0.002","874.8","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,2-bis((tert-butylthio)methyl)benzene","","- C16 H26 S2 -","- C16 H26 S2 -","- C32 H52 S4 -","2","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.0745","0.0453","","","0.1133","0.1319","","","","","","1.009","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214431","10.4014","0.0017","11.1506","0.0018","15.433","0.003","90","","90","","90","","1789.9","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,2-bis((tert-butylsulfinyl)methyl)benzene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C64 H104 O8 S8 -","4","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.1443","0.0547","","","0.0585","0.0721","","","","","","1.041","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214432","5.985","0.004","10.346","0.007","27.985","0.018","90","","90.592","0.009","90","","1733","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-bis((tert-butylsulfinyl)methyl)benzene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C64 H104 O8 S8 -","4","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.1749","0.1103","","","0.2965","0.3307","","","","","","1.025","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214433","6.171","0.005","12.078","0.005","12.267","0.005","76.243","0.005","80.572","0.005","77.97","0.005","862.3","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,4-bis((tert-butylthio)methyl)benzene","","- C16 H26 S2 -","- C16 H26 S2 -","- C32 H52 S4 -","2","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71069","MoKα","","0.1041","0.0732","","","0.2064","0.2324","","","","","","1.086","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214434","5.927","0.005","6.623","0.005","11.219","0.005","80.046","0.005","89.205","0.005","84.973","0.005","432.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,4-bis((tert-butylsulfinyl)methyl)benzene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","1","0.5","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71069","MoKα","","0.0638","0.0562","","","0.1662","0.1758","","","","","","1.034","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214435","6.3438","0.0018","10.203","0.003","14.767","0.004","108.771","0.004","97.042","0.004","93.17","0.004","893.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","alpha,alpha'-tert-butylsulfinyl-m-xylene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C32 H52 O4 S4 -","2","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.1101","0.0576","","","0.1395","0.1667","","","","","","1.043","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214436","12.418","0.005","6.541","0.002","21.609","0.008","90","","93.212","0.006","90","","1752.5","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","alpha,alpha'-tert-butylsulfinyl-m-xylene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C64 H104 O8 S8 -","4","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.1968","0.0841","","","0.222","0.2771","","","","","","0.963","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214437","11.94","0.007","19.051","0.01","9.493","0.005","90","","124.504","0.007","90","","1779.5","1.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-bis((tert-butylsulfinyl)methyl)benzene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C64 H104 O8 S8 -","4","0.5","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.1811","0.0586","","","0.1071","0.1419","","","","","","0.926","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214438","10.4267","0.0016","15.449","0.002","11.1546","0.0018","90","","90","","90","","1796.8","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R,S)-1,2-bis((tert-butylsulfinyl)methyl)benzene","","- C16 H26 O2 S2 -","- C16 H26 O2 S2 -","- C64 H104 O8 S8 -","4","1","","Xu, Zhiguang; Liu, Haiyang; Mahmood, Mian HR; Cai, Yuepeng; Xu, Xuan; Tang, Youwen","Spontaneous resolution of chiral bis-sulfoxides with asymmetric atropisomerism","CrystEngComm","2014","16","19","3839","","10.1039/c4ce00296b","","","0.71073","MoKα","","0.2124","0.0945","","","0.0813","0.1018","","","","","","1.003","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214439","25.3961","0.0009","25.3961","0.0009","25.3961","0.0009","90","","90","","90","","16379.5","1","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C32 H35 Cd N9 O6 -","- C27 H22 Cd N7 O -","- C432 H352 Cd16 N112 O16 -","16","0.333333","","Yuan, Shuai; Deng, Yong-Kai; Xuan, Wei-Min; Wang, Xing-Po; Wang, Su-Na; Dou, Jian-Min; Sun, Di","Spontaneous chiral resolution of a 3D (3,12)-connected MOF with an unprecedented ttt topology consisting of cubic [Cd4(μ3-OH)4] clusters and propeller-like ligands","CrystEngComm","2014","16","19","3829","","10.1039/c4ce00028e","","","0.71073","MoKα","","0.0955","0.0689","","","0.1884","0.2091","","","","","","0.809","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214440","25.704","0.003","25.704","0.003","25.704","0.003","90","","90","","90","","16983","3","120","2","120","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C32 H35 Cd N9 O6 -","- C27 H22 Cd N7 O -","- C432 H352 Cd16 N112 O16 -","16","0.333333","","Yuan, Shuai; Deng, Yong-Kai; Xuan, Wei-Min; Wang, Xing-Po; Wang, Su-Na; Dou, Jian-Min; Sun, Di","Spontaneous chiral resolution of a 3D (3,12)-connected MOF with an unprecedented ttt topology consisting of cubic [Cd4(μ3-OH)4] clusters and propeller-like ligands","CrystEngComm","2014","16","19","3829","","10.1039/c4ce00028e","","","0.71073","MoKα","","0.0811","0.0529","","","0.1259","0.1337","","","","","","0.836","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214441","3.7068","0.001","13.382","0.003","18.423","0.005","98.732","0.004","93.699","0.004","95.739","0.004","895.8","0.4","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2,2'-Bipyridinium picrate mono-acetonitrile solvate","","- C18 H14 N6 O7 -","- C18 H14 N6 O7 -","- C36 H28 N12 O14 -","2","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.0808","0.0584","","","0.1871","0.2008","","","","","","1.107","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214442","17.8023","0.001","15.2063","0.0009","20.3551","0.0012","90","","102.331","0.001","90","","5383.1","0.5","170","2","170","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Morpholinium picrate hemihydrate","","- C10 H13 N4 O8.5 -","- C10 H13 N4 O8.5 -","- C160 H208 N64 O136 -","16","2","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.088","0.0594","","","0.1472","0.1657","","","","","","1.013","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214443","13.509","0.005","7.028","0.003","18.804","0.007","90","","98.116","0.006","90","","1767.4","1.2","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolinium picrate","","- C18 H11 N5 O7 -","- C18 H11 N5 O7 -","- C72 H44 N20 O28 -","4","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.0863","0.0528","","","0.1297","0.1424","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214444","8.27","0.0005","10.6206","0.0006","11.4612","0.0007","82.126","0.001","86.883","0.001","71.856","0.001","947.52","0.1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2,2':6',2''-Terpyridinium picrate","","- C21 H14 N6 O7 -","- C21 H14 N6 O7 -","- C42 H28 N12 O14 -","2","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.074","0.0513","","","0.1302","0.1489","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214445","8.2754","0.0016","10.872","0.002","11.452","0.002","98.064","0.004","104.517","0.003","102.449","0.004","953.2","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2,9-Dimethyl-1,10-phenanthrolinium picrate","","- C20 H15 N5 O7 -","- C20 H15 N5 O7 -","- C40 H30 N10 O14 -","2","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.1046","0.0578","","","0.1408","0.1681","","","","","","0.998","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214446","6.5862","0.0005","16.8945","0.0013","17.1437","0.0014","90","","99.306","0.002","90","","1882.5","0.3","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Piperidinium picrate mono-piperidine solvate","","- C16 H25 N5 O7 -","- C16 H25 N5 O7 -","- C64 H100 N20 O28 -","4","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.1057","0.0584","","","0.1405","0.1659","","","","","","0.988","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214447","8.191","0.003","11.869","0.004","13.953","0.005","86.255","0.005","82.754","0.006","80.752","0.005","1326.8","0.8","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-Methylpyridinium picrate","","- C12 H10 N4 O7 -","- C12 H10 N4 O7 -","- C48 H40 N16 O28 -","4","2","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.0904","0.0596","","","0.1488","0.1643","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214448","8.259","0.002","9.243","0.002","19.849","0.005","90","","91.282","0.004","90","","1514.9","0.6","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8-Hydroxyquinolinium picrate","","- C15 H10 N4 O8 -","- C15 H10 N4 O8 -","- C60 H40 N16 O32 -","4","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.0668","0.048","","","0.1204","0.1331","","","","","","1.027","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214449","9.1996","0.0011","14.6492","0.0018","13.1834","0.0016","90","","108.918","0.002","90","","1680.7","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(2-pyridyl)ammonium picrate","","- C16 H12 N6 O7 -","- C16 H12 N6 O7 -","- C64 H48 N24 O28 -","4","1","","Chan, Eric J.; Grabowsky, Simon; Harrowfield, Jack M.; Shi, Ming W.; Skelton, Brian W.; Sobolev, Alexandre N.; White, Allan H.","Hirshfeld surface analysis of crystal packing in aza-aromatic picrate salts","CrystEngComm","2014","16","21","4508","","10.1039/c4ce00095a","","","0.71073","MoKα","","0.0803","0.0594","","","0.1502","0.1684","","","","","","0.917","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214457","10.9578","0.0003","16.3093","0.0005","9.2414","0.0003","90","","97.956","0.003","90","","1635.67","0.09","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C11 H8 Cd2 Cl0 K N5 O10 -","- C11 H8 Cd2 K N5 O10 -","- C44 H32 Cd8 K4 N20 O40 -","4","0.5","","Zhong, Di-Chang; Lu, Wen-Guan; Deng, Ji-Hua","Two three-dimensional cadmium(ii) coordination polymers based on 5-amino-tetrazolate and 1,2,4,5-benzenetetracarboxylate: the pH value controlled syntheses, crystal structures and luminescent properties","CrystEngComm","2014","16","21","4633","","10.1039/c4ce00219a","","","0.71073","MoKα","","0.0468","0.0341","","","0.056","0.0623","","","","","","1.044","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214458","6.595","0.0004","9.1653","0.0005","14.1958","0.001","85.873","0.005","82.166","0.005","74.734","0.004","819.48","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 Cd3 N5 O12 -","- C11 H9 Cd3 N5 O12 -","- C22 H18 Cd6 N10 O24 -","2","1","","Zhong, Di-Chang; Lu, Wen-Guan; Deng, Ji-Hua","Two three-dimensional cadmium(ii) coordination polymers based on 5-amino-tetrazolate and 1,2,4,5-benzenetetracarboxylate: the pH value controlled syntheses, crystal structures and luminescent properties","CrystEngComm","2014","16","21","4633","","10.1039/c4ce00219a","","","0.71073","MoKα","","0.0535","0.0364","","","0.0593","0.068","","","","","","1.06","","","","has coordinates,has disorder","180475","2020-10-21","18:00:00",""
"7214459","9.8996","0.0009","10.1499","0.0009","19.4607","0.0017","77.199","0.001","84.26","0.001","61.525","0.001","1676.1","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H26 Eu N3 O25 Y2 -","- C24 H26 Eu0.99 N3 O25 Y2.01 -","- C48 H52 Eu1.98 N6 O50 Y4.02 -","2","1","","Zhang, Yu; Ju, Weiwei; Xu, Xiao; Lv, Yun; Zhu, Dunru; Xu, Yan","Two novel mixed Eu3+/Y3+ Ln MOFs: influence of pH on the topology, Eu/Y ratio and energy transfer","CrystEngComm","2014","16","25","5681","","10.1039/c4ce00513a","","","0.71073","MoKα","","0.0449","0.0325","","","0.0822","0.0947","","","","","","1.05","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214460","7.4519","0.0006","19.2623","0.0015","12.3897","0.0009","90","","90","","90","","1778.4","0.2","296","2","296","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C7 H5 Eu0.44 N O5 Y0.56 -","- C7 H5 Eu0.44 N O5 Y0.56 -","- C56 H40 Eu3.52 N8 O40 Y4.48 -","8","1","","Zhang, Yu; Ju, Weiwei; Xu, Xiao; Lv, Yun; Zhu, Dunru; Xu, Yan","Two novel mixed Eu3+/Y3+ Ln MOFs: influence of pH on the topology, Eu/Y ratio and energy transfer","CrystEngComm","2014","16","25","5681","","10.1039/c4ce00513a","","","0.71073","MoKα","","0.028","0.023","","","0.0537","0.0553","","","","","","1.151","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214461","5.8743","0.0006","7.5065","0.0007","13.3959","0.0009","101.489","0.007","96.656","0.007","110.39","0.008","531.44","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Br N3 O -","- C11 H8 Br N3 O -","- C22 H16 Br2 N6 O2 -","2","1","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.0732","0.0491","","","0.1109","0.1186","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214462","7.287","0.002","24.367","0.005","12.004","0.003","90","","100.65","0.02","90","","2094.7","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 Br N4 O -","- C10 H7 Br N4 O -","- C80 H56 Br8 N32 O8 -","8","2","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.2004","0.0812","","","0.1605","0.2016","","","","","","0.892","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214463","5.8988","0.0019","7.408","0.003","13.191","0.004","101.56","0.03","96.55","0.02","110.55","0.03","518","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Cl N3 O -","- C11 H8 Cl N3 O -","- C22 H16 Cl2 N6 O2 -","2","1","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.0815","0.0715","","","0.141","0.1512","","","","","","1.038","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214464","7.375","0.004","10.92","0.005","13.606","0.007","86.2","0.04","83.56","0.04","73.19","0.04","1041.7","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H7 Cl N4 O -","- C10 H7 Cl N4 O -","- C40 H28 Cl4 N16 O4 -","4","2","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.162","0.071","","","0.1168","0.1433","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214465","6.0141","0.0015","23.974","0.005","13.582","0.003","90","","92.58","0.02","90","","1956.3","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H8 F N3 O -","- C11 H8 F N3 O -","- C88 H64 F8 N24 O8 -","8","2","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.1738","0.0538","","","0.0885","0.1149","","","","","","0.864","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214466","3.7671","0.0005","15.7465","0.0019","16.358","0.002","90","","92.991","0.011","90","","969","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 F N4 O -","- C10 H7 F N4 O -","- C40 H28 F4 N16 O4 -","4","1","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.0901","0.0466","","","0.0773","0.0862","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214467","5.7717","0.0003","24.9374","0.0008","7.5654","0.0003","90","","94.819","0.004","90","","1085.05","0.08","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 I N4 O -","- C10 H7 I N4 O -","- C40 H28 I4 N16 O4 -","4","1","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.0912","0.0787","","","0.1239","0.1598","","","","","","0.91","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214468","5.955","0.0008","7.7126","0.0011","12.9998","0.0017","78.85","0.011","85.64","0.011","70.594","0.011","552.47","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 I N3 O -","- C11 H8 I N3 O -","- C22 H16 I2 N6 O2 -","2","1","","Khavasi, Hamid Reza; Hosseini, Mahdieh; Tehrani, Alireza Azhdari; Naderi, Soheila","Strengthening N⋯X halogen bonding via nitrogen substitution in the aromatic framework of halogen-substituted arylpyrazinamides","CrystEngComm","2014","16","21","4546","","10.1039/c3ce41856a","","","0.71073","MoKα","","0.0355","0.0296","","","0.0668","0.0692","","","","","","1.091","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214469","18.4898","0.0011","18.4898","0.0011","38.7266","0.0019","90","","90","","120","","11465.8","1.1","150","2","150","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C22 H13 Cu2 N O12 -","- C22 H9 Cu2 N O12 -","- C198 H81 Cu18 N9 O108 -","9","0.25","","Zhang, Mingxing; Wang, Qian; Lu, Zhiyong; Liu, Huiyan; Liu, Wenlong; Bai, Junfeng","A nitro-decorated NbO-type metal‒organic framework with a highly selective CO2 uptake and CH4 storage capacity","CrystEngComm","2014","16","28","6287","","10.1039/c4ce00202d","","","0.71073","MoKα","","0.1328","0.1208","","","0.3356","0.3522","","","","","","1.449","","","","has coordinates,has disorder","180475","2020-10-21","18:00:00",""
"7214470","37.342","0.007","8.2819","0.0004","26.577","0.009","90","","134.36","0.03","90","","5876","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H23 N6 O9 Zn1.5 -","- C30 H23 N6 O9 Zn1.5 -","- C240 H184 N48 O72 Zn12 -","8","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.1415","0.0794","","","0.1381","0.1575","","","","","","1.043","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214471","38.1051","0.0019","8.0262","0.0002","26.1036","0.0012","90","","130.755","0.008","90","","6047.6","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H27 Cd1.5 N6 O11 -","- C30 H27 Cd1.5 N6 O11 -","- C240 H216 Cd12 N48 O88 -","8","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.0772","0.0531","","","0.0977","0.1049","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214472","10.1513","0.0015","32.003","0.006","18.417","0.004","90","","90","","90","","5983.2","1.9","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C30 H19 N6 O7.5 Zn1.5 -","- C30 H19 N6 O7.5 Zn1.5 -","- C240 H152 N48 O60 Zn12 -","8","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.1961","0.0987","","","0.2535","0.3063","","","","","","0.952","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214473","32.5833","0.0008","10.191","0.0003","19.138","0.0005","90","","90","","90","","6354.9","0.3","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C30 H24 Cd1.5 N6 O10 -","- C30 H24 Cd1.5 N6 O10 -","- C240 H192 Cd12 N48 O80 -","8","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.0614","0.0459","","","0.106","0.1119","","","","","","1.082","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214474","19.9674","0.0005","18.9868","0.0005","30.7298","0.0011","90","","90","","90","","11650.2","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C60 H43 N12 O18.5 Zn3 -","- C60 H43 N12 O18.5 Zn3 -","- C480 H344 N96 O148 Zn24 -","8","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.1264","0.0662","","","0.1578","0.1866","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214475","7.5481","0.0006","10.8878","0.001","19.046","0.0018","79.948","0.008","79.57","0.008","73.077","0.008","1460.3","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C60 H42 N12 O15 Zn2 -","- C60 H42 N12 O15 Zn2 -","- C60 H42 N12 O15 Zn2 -","1","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.074","0.0617","","","0.1591","0.168","","","","","","1.049","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214476","27.4177","0.0012","8.2315","0.0003","13.7691","0.0007","90","","94.263","0.005","90","","3098.9","0.2","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C30 H25 Cd1.5 N6 O10 -","- C30 H25 Cd1.5 N6 O10 -","- C120 H100 Cd6 N24 O40 -","4","1","","Yang, Wei; Wang, Chiming; Ma, Qi; Liu, Chenxi; Wang, Hailong; Jiang, Jianzhuang","Synthesis, crystal structures, and luminescence properties of seven tripodal imidazole-based Zn/Cd(ii) coordination polymers induced by tricarboxylates","CrystEngComm","2014","16","21","4554","","10.1039/c4ce00212a","","","0.71073","MoKα","","0.0583","0.0464","","","0.1002","0.1043","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214477","5.764","0.002","7.64","0.002","12.283","0.004","90","","96.901","0.011","90","","537","0.3","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) fumaric acid","bis(urea) (E)-butenedioic acid","","- C6 H12 N4 O6 -","- C6 H12 N4 O6 -","- C12 H24 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0442","0.035","","","0.0783","0.0832","","","","","","1.038","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214478","5.671","0.004","7.888","0.005","12.348","0.01","90","","96.719","0.003","90","","548.6","0.7","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) fumaric acid","bis(urea) (E)-butenedioic acid","","- C6 H12 N4 O6 -","- C6 H12 N4 O6 -","- C12 H24 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0481","0.0328","","","0.0826","0.0951","","","","","","1.132","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214479","5.541","0.006","8.214","0.007","12.427","0.012","90","","97.314","0.008","90","","561","0.9","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) fumaric acid","bis(urea) (E)-butenedioic acid","","- C6 H12 N4 O6 -","- C6 H12 N4 O6 -","- C12 H24 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0768","0.0577","","","0.1046","0.1114","","","","","","1.2","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214480","7.89","0.005","5.79","0.005","13.65","0.005","90","","91.22","","90","","623.4","0.7","20","","20","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0896","0.0538","","","0.081","0.086","","","","","","1.344","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214481","8.02","0.005","5.75","0.005","13.74","0.005","90","","91.43","","90","","633.4","0.7","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.08","0.0497","","","0.0881","0.092","","","","","","1.444","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214482","8.29","0.005","5.66","0.005","13.78","0.005","90","","91.8","","90","","646.3","0.7","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0906","0.053","","","0.0928","0.0983","","","","","","1.472","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214483","8.54","0.005","5.58","0.005","13.84","0.005","90","","92.92","","90","","658.7","0.7","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0814","0.0441","","","0.0803","0.0852","","","","","","1.381","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214484","8.0244","0.0012","5.7496","0.0007","13.735","0.002","90","","91.246","0.005","90","","633.54","0.15","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0371","0.0334","","","0.089","0.0918","","","","","","1.09","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214485","8.2868","0.0007","5.6618","0.0003","13.7761","0.0011","90","","91.799","0.004","90","","646.03","0.08","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0455","0.0353","","","0.0997","0.1077","","","","","","1.122","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214486","8.5398","0.0008","5.5798","0.0004","13.8377","0.0016","90","","92.291","0.004","90","","658.84","0.11","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) succinic acid","bis(N-methylurea) butanedioic acid","","- C8 H18 N4 O6 -","- C8 H18 N4 O6 -","- C16 H36 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0773","0.0432","","","0.1107","0.1464","","","","","","1.159","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214487","8.3188","0.001","5.6497","0.0005","13.8382","0.0013","90","","104.156","0.004","90","","630.63","0.11","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) fumaric acid","bis(N-methylurea) trans-butenedioic acid","","- C8 H16 N4 O6 -","- C8 H16 N4 O6 -","- C16 H32 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0435","0.0327","","","0.0745","0.0804","","","","","","1.07","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214488","8.5509","0.0016","5.5691","0.0008","13.909","0.002","90","","102.959","0.007","90","","645.49","0.18","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) fumaric acid","bis(N-methylurea) trans-butenedioic acid","","- C8 H16 N4 O6 -","- C8 H16 N4 O6 -","- C16 H32 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0656","0.0398","","","0.0933","0.1043","","","","","","1.074","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214489","8.7741","0.0014","5.4413","0.0007","13.9303","0.0019","90","","100.73","0.006","90","","653.44","0.16","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(methylurea) fumaric acid","bis(N-methylurea) trans-butenedioic acid","","- C8 H16 N4 O6 -","- C8 H16 N4 O6 -","- C16 H32 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0949","0.0487","","","0.0962","0.1168","","","","","","1.031","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214490","5.1081","0.0008","10.5388","0.0014","10.2233","0.0014","90","","102.717","0.007","90","","536.85","0.13","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-methylurea oxalic acid","N-methylurea ethandioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0696","0.0432","","","0.1088","0.1261","","","","","","1.173","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214491","5.1464","0.0014","10.555","0.002","10.313","0.003","90","","101.835","0.013","90","","548.3","0.2","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-methylurea oxalic acid","N-methylurea ethandioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.079","0.0508","","","0.111","0.1231","","","","","","1.061","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214492","8.35","0.005","5.44","0.005","15.43","0.005","90","","101.95","0.01","90","","685.7","0.8","20","","20","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(N,N-dimethylurea) succinic acid","bis(N,N-dimethylurea) butanedioic acid","","- C10 H22 N4 O6 -","- C10 H22 N4 O6 -","- C20 H44 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0871","0.0502","","","0.0779","0.0838","","","","","","1.281","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214493","8.4","0.005","5.47","0.005","15.47","0.005","90","","101.95","0.01","90","","695.4","0.8","50","","50","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(N,N-dimethylurea) succinic acid","bis(N,N-dimethylurea) butanedioic acid","","- C10 H22 N4 O6 -","- C10 H22 N4 O6 -","- C20 H44 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.08","0.0473","","","0.0777","0.0838","","","","","","1.217","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214494","8.483","0.003","5.5169","0.0014","15.415","0.005","90","","101.677","0.008","90","","706.5","0.4","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(N,N-dimethylurea) succinic acid","bis(N,N-dimethylurea) butanedioic acid","","- C10 H22 N4 O6 -","- C10 H22 N4 O6 -","- C20 H44 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.033","0.0308","","","0.088","0.09","","","","","","1.086","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214495","8.6629","0.0012","5.6284","0.0006","15.152","0.002","90","","100.948","0.004","90","","725.34","0.16","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(N,N-dimethylurea) succinic acid","bis(N,N-dimethylurea) butanedioic acid","","- C10 H22 N4 O6 -","- C10 H22 N4 O6 -","- C20 H44 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0408","0.0373","","","0.1078","0.1113","","","","","","1.081","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214496","8.797","0.002","5.6934","0.0013","15.059","0.004","90","","100.764","0.007","90","","741","0.3","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(N,N-dimethylurea) succinic acid","bis(N,N-dimethylurea) butanedioic acid","","- C10 H22 N4 O6 -","- C10 H22 N4 O6 -","- C20 H44 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0534","0.0472","","","0.1364","0.1435","","","","","","1.072","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214497","5.8025","0.0008","18.158","0.002","6.8184","0.0008","90","","101.019","0.004","90","","705.15","0.15","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(N,N-dimethylurea) fumaric acid","bis(N,N-Dimethylurea) trans-butenedioic acid","","- C10 H20 N4 O6 -","- C10 H20 N4 O6 -","- C20 H40 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0525","0.0417","","","0.1139","0.1251","","","","","","1.13","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214498","5.864","0.0005","18.2369","0.0011","6.8458","0.0004","90","","101.33","0.003","90","","717.83","0.09","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(N,N-dimethylurea) fumaric acid","bis(N,N-Dimethylurea) trans-butenedioic acid","","- C10 H20 N4 O6 -","- C10 H20 N4 O6 -","- C20 H40 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0485","0.0397","","","0.1113","0.1196","","","","","","1.081","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214499","5.924","0.004","18.376","0.009","6.873","0.005","90","","101.293","0.005","90","","733.7","0.8","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(N,N-dimethylurea) fumaric acid","bis(N,N-Dimethylurea) trans-butenedioic acid","","- C10 H20 N4 O6 -","- C10 H20 N4 O6 -","- C20 H40 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71073","MoKα","","0.0802","0.0507","","","0.1438","0.1693","","","","","","1.082","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214500","5.71","0.0006","7.97","0.001","12.16","0.0013","90","","96.16","0.004","90","","550.19","0.11","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) succinic acid","bis(urea) butanedioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0734","0.0453","","","0.0749","0.08","","","","","","1.258","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214501","5.67","0.0006","8.12","0.001","12.22","0.0013","90","","96.38","0.004","90","","559.13","0.11","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) succinic acid","bis(urea) butanedioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0565","0.0355","","","0.0642","0.0691","","","","","","1.235","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214502","5.64","0.0006","8.26","0.001","12.28","0.0013","90","","96.66","0.004","90","","568.22","0.11","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) succinic acid","bis(urea) butanedioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0678","0.0423","","","0.0746","0.0787","","","","","","1.368","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214503","5.7109","0.0007","7.9698","0.0011","12.158","0.0015","90","","96.16","0.004","90","","550.17","0.12","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) succinic acid","bis(urea) butanedioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.035","0.0299","","","0.0793","0.083","","","","","","1.069","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214504","5.6706","0.0005","8.1227","0.0007","12.2182","0.001","90","","96.375","0.003","90","","559.3","0.08","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) succinic acid","bis(urea) butanedioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0382","0.0315","","","0.0826","0.0896","","","","","","1.091","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214505","5.6366","0.0006","8.2568","0.001","12.279","0.0013","90","","96.659","0.004","90","","567.61","0.11","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(urea) succinic acid","bis(urea) butanedioic acid","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C12 H28 N8 O12 -","2","0.5","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","0.71075","MoKα","","0.0621","0.0351","","","0.0848","0.1074","","","","","","1.142","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214506","5.7976","0.001","7.5666","0.001","12.351","0.003","90","","97.03","0.03","90","","537.74","0.18","30","2","30","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H6 N2 O3 -","- C3 H6 N2 O3 -","- C12 H24 N8 O12 -","4","1","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0501","0.0501","","","","0.1268","","","","","","1.126","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214507","5.766","0.002","7.666","0.003","12.332","0.005","90","","96.81","0.03","90","","541.3","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(Urea) fumaric acid","","","- C3 H6 N2 O3 -","- C3 H6 N2 O3 -","- C12 H24 N8 O12 -","4","1","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0552","0.0552","","","0.1145","0.1145","","","","","","1.046","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214508","5.676","0.002","7.912","0.003","12.366","0.005","90","","96.66","0.03","90","","551.6","0.4","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(Urea) fumaric acid","","","- C3 H6 N2 O3 -","- C3 H6 N2 O3 -","- C12 H24 N8 O12 -","4","1","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0558","0.0558","","","0.1247","0.1247","","","","","","1.091","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214509","5.549","0.002","8.239","0.003","12.445","0.004","90","","97.24","0.03","90","","564.4","0.3","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(Urea) fumaric acid","","","- C3 H6 N2 O3 -","- C3 H6 N2 O3 -","- C12 H24 N8 O12 -","4","1","","Jones, Andrew O. F.; Leech, Charlotte K.; McIntyre, Garry J.; Wilson, Chick C.; Thomas, Lynne H.","Engineering short, strong hydrogen bonds in urea di-carboxylic acid complexes","CrystEngComm","2014","16","35","8177","","10.1039/C4CE00587B","","","","neutron","","0.0566","0.0566","","","0.13","0.1301","","","","","","1.096","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214510","7.4865","0.0014","13.522","0.003","17.24","0.003","67.769","0.009","81.362","0.009","79.166","0.009","1580.7","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H16 Cl6 I2 N2 O2 -","- C28 H16 Cl6 I2 N2 O2 -","- C56 H32 Cl12 I4 N4 O4 -","2","1","","Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Polymorphs and co-crystals of haloprogin: an antifungal agent","CrystEngComm","2014","16","26","5897","","10.1039/c4ce00367e","","","0.71073","MoKα","","0.0546","0.0303","","","0.0633","0.0733","","","","","","1.004","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214511","8.557","0.002","14.816","0.003","31.189","0.006","90","","90","","90","","3954.2","1.4","103","2","103","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C34 H44 Cl7 I2 N O2 -","- C34 H44 Cl7 I2 N O2 -","- C136 H176 Cl28 I8 N4 O8 -","4","0.5","","Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Polymorphs and co-crystals of haloprogin: an antifungal agent","CrystEngComm","2014","16","26","5897","","10.1039/c4ce00367e","","","0.71073","MoKα","","0.0405","0.0267","","","0.0497","0.0537","","","","","","1.086","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214512","8.9174","0.0009","15.2187","0.0012","31.429","0.003","90","","90","","90","","4265.3","0.7","296","2","296","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C34 H44 Cl6 I3 N O2 -","- C34 H44 Cl6 I3 N O2 -","- C136 H176 Cl24 I12 N4 O8 -","4","0.5","","Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Polymorphs and co-crystals of haloprogin: an antifungal agent","CrystEngComm","2014","16","26","5897","","10.1039/c4ce00367e","","","0.71073","MoKα","","0.0524","0.0341","","","0.0736","0.0869","","","","","","1.079","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214513","22.173","0.002","7.687","0.0007","13.8308","0.0013","90","","109.181","0.004","90","","2226.5","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H4 Cl3 I O -","- C9 H4 Cl3 I O -","- C72 H32 Cl24 I8 O8 -","8","1","","Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Polymorphs and co-crystals of haloprogin: an antifungal agent","CrystEngComm","2014","16","26","5897","","10.1039/c4ce00367e","","","0.71073","MoKα","","0.0452","0.0366","","","0.1035","0.1082","","","","","","1.058","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214514","4.2659","0.0006","10.4936","0.0014","13.3814","0.0016","108.226","0.012","93.893","0.012","90.291","0.012","567.43","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H4 Cl3 I O -","- C9 H4 Cl3 I O -","- C18 H8 Cl6 I2 O2 -","2","1","","Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Polymorphs and co-crystals of haloprogin: an antifungal agent","CrystEngComm","2014","16","26","5897","","10.1039/c4ce00367e","","","0.71073","MoKα","","0.0385","0.0314","","","0.0737","0.0785","","","","","","1.059","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214515","31.1","0.005","5.3807","0.0007","13.861","0.002","90","","107.05","0.005","90","","2217.6","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H3 Cl3 I O -","- C9 H4 Cl3 I O -","- C72 H32 Cl24 I8 O8 -","8","1","","Baldrighi, Michele; Bartesaghi, Davide; Cavallo, Gabriella; Chierotti, Michele R.; Gobetto, Roberto; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo","Polymorphs and co-crystals of haloprogin: an antifungal agent","CrystEngComm","2014","16","26","5897","","10.1039/c4ce00367e","","","0.71073","MoKα","","0.1436","0.1236","","","0.2744","0.2992","","","","","","1.044","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214516","11.4377","0.0005","10.9909","0.0004","23.6256","0.001","90","","101.327","0.002","90","","2912.1","0.2","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 Cd N4 O6 -","- C30 H20 Cd N4 O6 -","- C120 H80 Cd4 N16 O24 -","4","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.0692","0.0655","","","0.166","0.1683","","","","","","1.113","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214517","10.7918","0.0004","22.0438","0.0009","29.3454","0.0011","78.661","0.002","81.342","0.002","83.766","0.003","6744.3","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C120 H80 Cd4 N16 O28.5 -","- C120 H80 Cd4 N16 O28.5 -","- C240 H160 Cd8 N32 O57 -","2","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.0778","0.0548","","","0.1464","0.1537","","","","","","1.059","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7214518","27.665","0.011","21.903","0.007","29.854","0.009","90","","90","","90","","18090","11","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C90 H57 N15 O24 Zn3 -","- C90 H57 N15 O24 Zn3 -","- C720 H456 N120 O192 Zn24 -","8","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.138","0.0766","","","0.1852","0.2179","","","","","","0.977","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214519","15.0919","0.0005","14.1967","0.0005","18.1636","0.0006","90","","112.283","0.002","90","","3601","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H24 N6 O14 Zn -","- C38 H24 N6 O14 Zn -","- C152 H96 N24 O56 Zn4 -","4","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.0669","0.0425","","","0.0971","0.1073","","","","","","1.026","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214520","11.8446","0.0002","16.2081","0.0002","15.5426","0.0002","90","","116.373","0.001","90","","2673.29","0.07","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H20 N4 O8.5 Zn -","- C31 H20 N4 O8.5 Zn -","- C124 H80 N16 O34 Zn4 -","4","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.0402","0.0357","","","0.0823","0.085","","","","","","1.07","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7214521","8.5394","0.0007","17.9536","0.0016","14.646","0.001","90","","118.236","0.004","90","","1978.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H13 N2 O5 Zn -","- C23 H13 N2 O5 Zn -","- C92 H52 N8 O20 Zn4 -","4","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.0674","0.0547","","","0.1559","0.1673","","","","","","1.06","","","","has coordinates","180476","2020-10-21","18:00:00",""
"7214522","9.9223","0.0002","14.9699","0.0003","21.0207","0.0004","77.365","0.001","81.01","0.001","82.377","0.001","2993.54","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H40 N8 O12 Zn2 -","- C60 H40 N8 O12 Zn2 -","- C120 H80 N16 O24 Zn4 -","2","1","","Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng","Construction and modulation of structural diversity in acylamide-MOFs","CrystEngComm","2014","16","25","5608","","10.1039/c4ce00490f","","","0.71073","MoKα","","0.061","0.0417","","","0.1105","0.1165","","","","","","1.038","","","","has coordinates,has disorder","180476","2020-10-21","18:00:00",""
"7215044","15.529","0.002","7.9238","0.0011","28.524","0.003","90","","119.779","0.005","90","","3046.4","0.7","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C24 H83 Mn4 N16 O5 S12 Sb3 -","- C24 H83 Mn4 N16 O5 S12 Sb3 -","- C48 H166 Mn8 N32 O10 S24 Sb6 -","2","0.5","","Yue, Cheng-Yang; Lei, Xiao-Wu; Zang, Hui-Ping; Zhai, Xiu-Rong; Feng, Li-Juan; Zhao, Zhi-Fei; Zhao, Jian-Qiang; Liu, Xin-Yue","Two manganese‒amine complexes incorporating thioantimonates and exhibiting diversiform roles of amine ligands","CrystEngComm","2014","16","16","3424","","10.1039/c3ce42240b","","","0.71073","MoKα","","0.0492","0.0304","","","0.0752","0.1026","","","","","","1.079","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215045","12.79","0.003","12.867","0.003","13.616","0.003","112.894","0.002","91.768","0.003","92.612","0.003","2059.2","0.8","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C8 H32 Mn N6 O S15 Sb8 -","- C8 H32 Mn N6 O S15 Sb8 -","- C16 H64 Mn2 N12 O2 S30 Sb16 -","2","1","","Yue, Cheng-Yang; Lei, Xiao-Wu; Zang, Hui-Ping; Zhai, Xiu-Rong; Feng, Li-Juan; Zhao, Zhi-Fei; Zhao, Jian-Qiang; Liu, Xin-Yue","Two manganese‒amine complexes incorporating thioantimonates and exhibiting diversiform roles of amine ligands","CrystEngComm","2014","16","16","3424","","10.1039/c3ce42240b","","","0.71073","MoKα","","0.0544","0.0445","","","0.0972","0.1009","","","","","","1.006","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215046","8.0133","0.0007","11.2963","0.0004","19.9503","0.0013","90","","90","","90","","1805.9","0.2","200","2","200","2","","","","","","","synthesis as described","5","P c c n","-P 2ab 2ac","56","","","","- C14 H22 N4 O8 Zn -","- C14 H22 N4 O8 Zn -","- C56 H88 N16 O32 Zn4 -","4","0.5","","Fernández-Palacio, Francisco; Restrepo, Jimmy; Gálvez, Santos; Gómez-Sal, Pilar; Mosquera, Marta E. G.","Functionalized aminocarboxylate moieties as linkers for coordination polymers: influence of the substituents in the dimensionality of the final structure","CrystEngComm","2014","16","16","3376","","10.1039/c3ce42615g","","x-ray","0.71073","MoKα","","0.0995","0.0537","","","0.1133","0.141","","","","","","1.134","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215047","8.764","0.002","15.381","0.004","11.395","0.002","90","","106.617","0.01","90","","1471.9","0.6","200","2","200","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N4 O6 Zn -","- C12 H14 N4 O6 Zn -","- C48 H56 N16 O24 Zn4 -","4","1","","Fernández-Palacio, Francisco; Restrepo, Jimmy; Gálvez, Santos; Gómez-Sal, Pilar; Mosquera, Marta E. G.","Functionalized aminocarboxylate moieties as linkers for coordination polymers: influence of the substituents in the dimensionality of the final structure","CrystEngComm","2014","16","16","3376","","10.1039/c3ce42615g","","x-ray","0.71073","MoKα","","0.0731","0.0335","","","0.0678","0.077","","","","","","1.008","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215048","7.933","0.002","13.2295","0.0017","22.388","0.005","90","","90","","90","","2349.6","0.8","200","2","200","2","","","","","","","synthesis as described","5","P b c n","-P 2n 2ab","60","","","","- C24 H22 N4 O6 Zn -","- C24 H22 N4 O6 Zn -","- C96 H88 N16 O24 Zn4 -","4","0.5","","Fernández-Palacio, Francisco; Restrepo, Jimmy; Gálvez, Santos; Gómez-Sal, Pilar; Mosquera, Marta E. G.","Functionalized aminocarboxylate moieties as linkers for coordination polymers: influence of the substituents in the dimensionality of the final structure","CrystEngComm","2014","16","16","3376","","10.1039/c3ce42615g","","x-ray","0.71073","MoKα","","0.1176","0.0514","","","0.108","0.1417","","","","","","1.079","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215049","9.91","0.0009","16.496","0.003","18.716","0.003","90","","104.91","0.008","90","","2956.6","0.8","200","2","200","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C68 H56 N12 O12 Zn2 -","- C68 H56 N12 O12 Zn2 -","- C136 H112 N24 O24 Zn4 -","2","0.5","","Fernández-Palacio, Francisco; Restrepo, Jimmy; Gálvez, Santos; Gómez-Sal, Pilar; Mosquera, Marta E. G.","Functionalized aminocarboxylate moieties as linkers for coordination polymers: influence of the substituents in the dimensionality of the final structure","CrystEngComm","2014","16","16","3376","","10.1039/c3ce42615g","","x-ray","0.71073","MoKα","","0.1197","0.0574","","","0.1075","0.1351","","","","","","1.093","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215050","9.404","0.002","11.923","0.0017","14.556","0.003","77.24","0.01","84.17","0.01","72.49","0.01","1516.9","0.5","200","2","200","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C68 H58 N12 O9 Zn2 -","- C68 H58 N12 O9 Zn2 -","- C68 H58 N12 O9 Zn2 -","1","0.5","","Fernández-Palacio, Francisco; Restrepo, Jimmy; Gálvez, Santos; Gómez-Sal, Pilar; Mosquera, Marta E. G.","Functionalized aminocarboxylate moieties as linkers for coordination polymers: influence of the substituents in the dimensionality of the final structure","CrystEngComm","2014","16","16","3376","","10.1039/c3ce42615g","","x-ray","0.71073","MoKα","","0.0812","0.0361","","","0.0721","0.0874","","","","","","0.85","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215051","10.6806","0.0015","9.1982","0.0013","7.5204","0.0011","90","","107.139","0.002","90","","706.01","0.17","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 Ca Cl2 N2 O4 -","- C10 H18 Ca Cl2 N2 O4 -","- C20 H36 Ca2 Cl4 N4 O8 -","2","0.5","","Lamberts, Kevin; Porsche, Sven; Hentschel, Bernd; Kuhlen, Torsten; Englert, Ulli","An unusual linker and an unexpected node: CaCl2 dumbbells linked by proline to form square lattice networks","CrystEngComm","2014","16","16","3305","","10.1039/c3ce42357c","","","0.71073","MoKα","","0.032","0.0283","","","0.0686","0.0711","","","","","","1.027","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215052","5.872","0.0019","17.422","0.006","7.957","0.003","90","","104.233","0.005","90","","789","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H22 Ca Cl2 N2 O6 -","- C10 H22 Ca Cl2 N2 O6 -","- C20 H44 Ca2 Cl4 N4 O12 -","2","0.5","","Lamberts, Kevin; Porsche, Sven; Hentschel, Bernd; Kuhlen, Torsten; Englert, Ulli","An unusual linker and an unexpected node: CaCl2 dumbbells linked by proline to form square lattice networks","CrystEngComm","2014","16","16","3305","","10.1039/c3ce42357c","","","0.71073","MoKα","","0.069","0.0613","","","0.1596","0.1633","","","","","","1.09","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215053","7.6518","0.0012","9.7084","0.0015","19.982","0.003","90","","90","","90","","1484.4","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H18 Ca Cl2 N2 O4 -","- C10 H18 Ca Cl2 N2 O4 -","- C40 H72 Ca4 Cl8 N8 O16 -","4","1","","Lamberts, Kevin; Porsche, Sven; Hentschel, Bernd; Kuhlen, Torsten; Englert, Ulli","An unusual linker and an unexpected node: CaCl2 dumbbells linked by proline to form square lattice networks","CrystEngComm","2014","16","16","3305","","10.1039/c3ce42357c","","","0.71073","MoKα","","0.0434","0.0358","","","0.0747","0.0783","","","","","","1.04","","","","has coordinates,has disorder","288505","2023-12-22","15:12:04",""
"7215054","6.9732","0.0006","11.7268","0.0011","12.1168","0.0011","90","","90","","90","","990.83","0.15","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C5 H11 Ca Cl2 N O3 -","- C5 H11 Ca Cl2 N O3 -","- C20 H44 Ca4 Cl8 N4 O12 -","4","1","","Lamberts, Kevin; Porsche, Sven; Hentschel, Bernd; Kuhlen, Torsten; Englert, Ulli","An unusual linker and an unexpected node: CaCl2 dumbbells linked by proline to form square lattice networks","CrystEngComm","2014","16","16","3305","","10.1039/c3ce42357c","","","0.71073","MoKα","","0.0238","0.0227","","","0.0542","0.0557","","","","","","1.044","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215055","7.7297","0.0005","14.3257","0.0007","21.704","0.0003","90","","90","","90","","2403.4","0.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C7 H14 Be N2 O8 P2 -","- C7 H14 Be N2 O8 P2 -","- C56 H112 Be8 N16 O64 P16 -","8","1","","Wang, Guoming; Ding, Zhigao; Li, Jinhua; Lv, Xiang; Zhang, Xiao; Zhao, Xiaomeng; Wang, Zonghua; Wang, Yingxia; Lin, Jianhua","Series of crystalline beryllium phosphates including new templates generated by in situ N-methylation transformation","CrystEngComm","2014","16","16","3296","","10.1039/c3ce42487a","","","0.71073","MoKα","","0.051","0.0429","","","0.093","0.0964","","","","","","1.141","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215056","8.7135","0.0007","13.8526","0.0004","17.1154","0.0004","90","","98.947","0.005","90","","2040.77","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H25 Be3 N2 O17.5 P4 -","- C8 H10 Be3 N2 O17.5 P4 -","- C32 H40 Be12 N8 O70 P16 -","4","1","","Wang, Guoming; Ding, Zhigao; Li, Jinhua; Lv, Xiang; Zhang, Xiao; Zhao, Xiaomeng; Wang, Zonghua; Wang, Yingxia; Lin, Jianhua","Series of crystalline beryllium phosphates including new templates generated by in situ N-methylation transformation","CrystEngComm","2014","16","16","3296","","10.1039/c3ce42487a","","","0.71073","MoKα","","0.0596","0.051","","","0.1471","0.1531","","","","","","1.086","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215057","8.7901","0.0005","8.8969","0.0003","15.095","0.0002","88.59","0.003","75.26","0.004","62.81","0.007","1009.71","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H26 Be2 N2 O16 P4 -","- C8 H25.5 Be2 N2 O16 P4 -","- C16 H51 Be4 N4 O32 P8 -","2","1","","Wang, Guoming; Ding, Zhigao; Li, Jinhua; Lv, Xiang; Zhang, Xiao; Zhao, Xiaomeng; Wang, Zonghua; Wang, Yingxia; Lin, Jianhua","Series of crystalline beryllium phosphates including new templates generated by in situ N-methylation transformation","CrystEngComm","2014","16","16","3296","","10.1039/c3ce42487a","","","0.71073","MoKα","","0.0681","0.0481","","","0.0982","0.1067","","","","","","1.064","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215058","9.3591","0.0006","9.3128","0.0005","15.1655","0.0003","90","","92.505","0.005","90","","1320.55","0.11","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H28 Be4 N2 O24 P6 -","- C8 H28 Be4 N2 O24 P6 -","- C16 H56 Be8 N4 O48 P12 -","2","0.5","","Wang, Guoming; Ding, Zhigao; Li, Jinhua; Lv, Xiang; Zhang, Xiao; Zhao, Xiaomeng; Wang, Zonghua; Wang, Yingxia; Lin, Jianhua","Series of crystalline beryllium phosphates including new templates generated by in situ N-methylation transformation","CrystEngComm","2014","16","16","3296","","10.1039/c3ce42487a","","","0.71073","MoKα","","0.0524","0.0429","","","0.1077","0.1119","","","","","","1.129","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215059","20.872","0.008","20.872","0.008","5.882","0.002","90","","90","","90","","2562.4","1.6","298","2","298","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C18 H16 Cd2 N6 O7 -","- C18 H16 Cd2 N6 O7 -","- C72 H64 Cd8 N24 O28 -","4","0.5","","Li, Teng; Yang, Jian; Hong, Xu-Jia; Ou, Yan-Jun; Gu, Zhi-Gang; Cai, Yue-Peng","A robust porous pillar-chained Cd-framework with selective sorption for CO2 and guest-driven tunable luminescence","CrystEngComm","2014","16","19","3848","","10.1039/c4ce00045e","","","0.71073","MoKα","","0.0657","0.0429","","","0.1184","0.1351","","","","","","1.089","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215060","20.8164","0.0013","20.8164","0.0013","5.8701","0.0004","90","","90","","90","","2543.6","0.3","298","2","298","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C9 H7 Cd N3 O3 -","- C9 H7 Cd N3 O3 -","- C72 H56 Cd8 N24 O24 -","8","1","","Li, Teng; Yang, Jian; Hong, Xu-Jia; Ou, Yan-Jun; Gu, Zhi-Gang; Cai, Yue-Peng","A robust porous pillar-chained Cd-framework with selective sorption for CO2 and guest-driven tunable luminescence","CrystEngComm","2014","16","19","3848","","10.1039/c4ce00045e","","","0.71073","MoKα","","0.039","0.0313","","","0.0865","0.0904","","","","","","1.081","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215061","21.23","0.06","21.23","0.06","6.029","0.017","90","","90","","90","","2717","13","298","2","298","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C9 H7 Cd I N3 O3 -","- C9 H7 Cd I N3 O3 -","- C72 H56 Cd8 I8 N24 O24 -","8","1","","Li, Teng; Yang, Jian; Hong, Xu-Jia; Ou, Yan-Jun; Gu, Zhi-Gang; Cai, Yue-Peng","A robust porous pillar-chained Cd-framework with selective sorption for CO2 and guest-driven tunable luminescence","CrystEngComm","2014","16","19","3848","","10.1039/c4ce00045e","","","0.71073","MoKα","","0.083","0.0611","","","0.179","0.2029","","","","","","1.086","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215062","9.1013","0.0011","10.8625","0.0014","12.5697","0.0016","76.698","0.002","86.585","0.002","79.993","0.002","1190.7","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H21 Mg N3 O10 S2 -","- C21 H21 Mg N3 O10 S2 -","- C42 H42 Mg2 N6 O20 S4 -","2","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Xie, Tao; Liu, Zi-Meng; Wen, Xi-Ling; Chen, Xue-Yun; Fan, Jun; Zhang, Wei-Guang","Construction of several new s-/p-block complexes containing binuclear metal‒terpyridine building blocks: dependence of structural diversity on the number of coordinated water molecules","CrystEngComm","2014","16","19","4029","","10.1039/c3ce41790e","","","0.71073","MoKα","","0.0602","0.0472","","","0.1405","0.1535","","","","","","1.053","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215063","18.538","0.017","16.748","0.016","16.019","0.015","90","","103.804","0.012","90","","4830","8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H20 Ca N3 O9.5 S2 -","- C21 H18 Ca N3 O9.5 S2 -","- C168 H144 Ca8 N24 O76 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Xie, Tao; Liu, Zi-Meng; Wen, Xi-Ling; Chen, Xue-Yun; Fan, Jun; Zhang, Wei-Guang","Construction of several new s-/p-block complexes containing binuclear metal‒terpyridine building blocks: dependence of structural diversity on the number of coordinated water molecules","CrystEngComm","2014","16","19","4029","","10.1039/c3ce41790e","","","0.71073","MoKα","","0.1266","0.0637","","","0.1653","0.2067","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215064","8.9535","0.0011","11.451","0.0014","12.3912","0.0015","69.024","0.002","81.056","0.002","79.498","0.002","1160.7","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H19 N3 O9 Pb S2 -","- C21 H19 N3 O9 Pb S2 -","- C42 H38 N6 O18 Pb2 S4 -","2","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Xie, Tao; Liu, Zi-Meng; Wen, Xi-Ling; Chen, Xue-Yun; Fan, Jun; Zhang, Wei-Guang","Construction of several new s-/p-block complexes containing binuclear metal‒terpyridine building blocks: dependence of structural diversity on the number of coordinated water molecules","CrystEngComm","2014","16","19","4029","","10.1039/c3ce41790e","","","0.71073","MoKα","","0.0628","0.0445","","","0.0903","0.0991","","","","","","1.002","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215065","15.792","0.006","19.232","0.007","14.198","0.005","90","","91.16","0.005","90","","4311","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 N3 O6.5 Pb S2 -","- C21 H13 N3 O6.5 Pb S2 -","- C168 H104 N24 O52 Pb8 S16 -","8","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Xie, Tao; Liu, Zi-Meng; Wen, Xi-Ling; Chen, Xue-Yun; Fan, Jun; Zhang, Wei-Guang","Construction of several new s-/p-block complexes containing binuclear metal‒terpyridine building blocks: dependence of structural diversity on the number of coordinated water molecules","CrystEngComm","2014","16","19","4029","","10.1039/c3ce41790e","","","0.71073","MoKα","","0.0816","0.0685","","","0.215","0.2229","","","","","","1.087","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215066","13.85","0.0012","14.6293","0.0012","17.9504","0.0016","97.443","0.001","101.793","0.001","90.424","0.001","3528.1","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H57 N9 O27 Pb3 S6 -","- C63 H41 N9 O27 Pb3 S6 -","- C126 H82 N18 O54 Pb6 S12 -","2","1","","Zheng, Sheng-Run; Chen, Rui-Ling; Xie, Tao; Liu, Zi-Meng; Wen, Xi-Ling; Chen, Xue-Yun; Fan, Jun; Zhang, Wei-Guang","Construction of several new s-/p-block complexes containing binuclear metal‒terpyridine building blocks: dependence of structural diversity on the number of coordinated water molecules","CrystEngComm","2014","16","19","4029","","10.1039/c3ce41790e","","","0.71073","MoKα","","0.0754","0.0457","","","0.0985","0.1143","","","","","","0.987","","","","has coordinates,has disorder","180481","2020-10-21","18:00:00",""
"7215067","14.2823","0.0019","17.776","0.003","27.245","0.003","90","","90","","90","","6917","1.7","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C34 H30 N4 O16 Zn3 -","- C20 H4 O16 Zn3 -","- C160 H32 O128 Zn24 -","8","1","","Ji, Wen-Juan; Hu, Man-Cheng; Li, Shu-Ni; Jiang, Yu-Cheng; Zhai, Quan-Guo","Ionic liquids used for synthesis of supramolecular isomeric open-frameworks as photocatalysts for visible-light-driven degradation of organic dyes","CrystEngComm","2014","16","17","3474","","10.1039/c4ce00014e","","","0.71073","MoKα","","0.0528","0.0486","","","0.1424","0.1461","","","","","","1.067","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215068","19.743","0.0003","26.8524","0.0005","29.2175","0.0005","90","","90","","90","","15489.6","0.5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C36 H34 N4 O16 Zn3 -","- C20 H4 O16 Zn3 -","- C320 H64 O256 Zn48 -","16","0.5","","Ji, Wen-Juan; Hu, Man-Cheng; Li, Shu-Ni; Jiang, Yu-Cheng; Zhai, Quan-Guo","Ionic liquids used for synthesis of supramolecular isomeric open-frameworks as photocatalysts for visible-light-driven degradation of organic dyes","CrystEngComm","2014","16","17","3474","","10.1039/c4ce00014e","","","0.71073","MoKα","","0.0315","0.0291","","","0.107","0.1083","","","","","","1.014","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215069","41.0363","0.0018","12.1733","0.0004","14.1609","0.0005","90","","100.869","0.003","90","","6947.1","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 Cu4 O23 Se -","- C18 H6 Cu4 O23 Se -","- C144 H48 Cu32 O184 Se8 -","8","1","","Papaefstathiou, Giannis S.; Subrahmanyam, Kota S.; Armatas, Gerasimos S.; Malliakas, Christos D.; Kanatzidis, Mercouri G.; Manos, Manolis J.","A unique microporous copper trimesate selenite with high selectivity for CO2","CrystEngComm","2014","16","17","3483","","10.1039/c4ce00091a","","","0.71073","MoKα","","0.0903","0.0639","","","0.1371","0.1453","","","","","","1.093","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215070","38.391","0.006","12.3697","0.0011","14.1757","0.0014","90","","90.165","0.01","90","","6731.8","1.4","473","2","473","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H6 Cu4 O15 Se -","- C18 H6 Cu4 O15 Se -","- C144 H48 Cu32 O120 Se8 -","8","1","","Papaefstathiou, Giannis S.; Subrahmanyam, Kota S.; Armatas, Gerasimos S.; Malliakas, Christos D.; Kanatzidis, Mercouri G.; Manos, Manolis J.","A unique microporous copper trimesate selenite with high selectivity for CO2","CrystEngComm","2014","16","17","3483","","10.1039/c4ce00091a","","","0.71073","MoKα","","0.249","0.1312","","","0.2912","0.3382","","","","","","1.071","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215071","14.3644","0.0017","8.318","0.001","8.8927","0.0011","90","","120.75","0.005","90","","913.1","0.2","185","2","185","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C5 H11 Mn N O6 -","- C5 H11 Mn N O6 -","- C20 H44 Mn4 N4 O24 -","4","1","","Sánchez-Andújar, M.; Gómez-Aguirre, L. C.; Pato Doldán, B.; Yáñez-Vilar, S.; Artiaga, R.; Llamas-Saiz, A. L.; Manna, R. S.; Schnelle, F.; Lang, M.; Ritter, F.; Haghighirad, A. A.; Señarís-Rodríguez, M. A.","First-order structural transition in the multiferroic perovskite-like formate [(CH3)2NH2][Mn(HCOO)3]","CrystEngComm","2014","16","17","3558","","10.1039/c3ce42411a","","","0.71073","MoKα","","0.1006","0.0634","","","0.1535","0.1739","","","","","","0.955","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215072","8.3544","0.0005","8.3544","0.0005","22.8701","0.0016","90","","90","","120","","1382.39","0.15","190","2","190","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C5 H11 Mn N O6 -","- C5 H3 Mn N0.99 O6 -","- C30 H18 Mn6 N5.94 O36 -","6","0.166667","","Sánchez-Andújar, M.; Gómez-Aguirre, L. C.; Pato Doldán, B.; Yáñez-Vilar, S.; Artiaga, R.; Llamas-Saiz, A. L.; Manna, R. S.; Schnelle, F.; Lang, M.; Ritter, F.; Haghighirad, A. A.; Señarís-Rodríguez, M. A.","First-order structural transition in the multiferroic perovskite-like formate [(CH3)2NH2][Mn(HCOO)3]","CrystEngComm","2014","16","17","3558","","10.1039/c3ce42411a","","","0.71073","MoKα","","0.0426","0.0371","","","0.1036","0.1066","","","","","","1.2","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215073","7.1628","0.0004","7.9091","0.0004","10.2589","0.0004","91.372","0.004","101.829","0.004","102.587","0.005","553.73","0.05","101.893","0.002","101.829","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H6 Eu N3 O7 -","- C9 H6 Eu N3 O7 -","- C18 H12 Eu2 N6 O14 -","2","1","","Ahmad, Waqar; Zhang, Lijuan; Zhou, Yunshan","2-D lanthanide‒organic complexes constructed from 6,7-dihydropyrido(2,3-d)pyridazine-5,8-dione: synthesis, characterization and photoluminescence for sensing small molecules","CrystEngComm","2014","16","17","3521","","10.1039/c3ce42575d","","","0.71073","MoKα","","0.022","0.02","","","0.0426","0.0432","","","","","","1.042","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215074","7.1205","0.0003","7.8366","0.0005","10.2949","0.0006","91.199","0.005","102.326","0.004","102.157","0.004","547.33","0.05","102.2","","102.2","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H6 N3 O7 Tb -","- C9 H6 N3 O7 Tb -","- C18 H12 N6 O14 Tb2 -","2","1","","Ahmad, Waqar; Zhang, Lijuan; Zhou, Yunshan","2-D lanthanide‒organic complexes constructed from 6,7-dihydropyrido(2,3-d)pyridazine-5,8-dione: synthesis, characterization and photoluminescence for sensing small molecules","CrystEngComm","2014","16","17","3521","","10.1039/c3ce42575d","","","0.7107","MoKα","","0.0331","0.0305","","","0.0672","0.069","","","","","","1.043","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215075","10.7697","0.0011","10.158","0.0008","29.054","0.003","90","","91.111","0.004","90","","3177.9","0.5","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H12 I2 N4 S2 Zn -","- C8 H12 I2 N4 S2 Zn -","- C64 H96 I16 N32 S16 Zn8 -","8","2","","Isaia, Francesco; Aragoni, M. Carla; Arca, Massimiliano; Caltagirone, Claudia; Garau, Alessandra; Jones, Peter G.; Lippolis, Vito; Montis, Riccardo","Reactivity of the drug methimazole and its iodine adduct with elemental zinc","CrystEngComm","2014","16","17","3613","","10.1039/c3ce42601g","","","0.71073","MoKα","","0.0234","0.0181","","","0.0395","0.0412","","","","","","1.058","","","","has coordinates","180481","2020-10-21","18:00:00",""
"7215192","13.7574","0.0009","11.2371","0.0008","19.0368","0.0012","90","","95.529","0.002","90","","2929.3","0.3","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H18 Ag2 F6 N4 O9 S2 -","- C24 H18 Ag2 F6 N4 O9 S2 -","- C96 H72 Ag8 F24 N16 O36 S8 -","4","0.5","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71069","MoKα","","0.0204","0.0199","","","0.0522","0.0525","","","","","","1.146","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215193","12.4586","0.0005","9.8846","0.0004","21.2874","0.0009","90","","102.794","0.0018","90","","2556.43","0.18","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 Ag2 Cl2 N4 O11 -","- C22 H18 Ag2 Cl2 N4 O11 -","- C88 H72 Ag8 Cl8 N16 O44 -","4","0.5","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71069","MoKα","","0.0367","0.0285","","","0.0923","0.1269","","","","","","1.209","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215194","7.5345","0.0003","19.1191","0.001","23.0434","0.0011","90","","92.045","0.001","90","","3317.4","0.3","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H27 Ag2 Cl2 N7 O11 -","- C28 H27 Ag2 Cl2 N7 O11 -","- C112 H108 Ag8 Cl8 N28 O44 -","4","1","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71073","MoKα","","0.062","0.0495","","","0.1094","0.1157","","","","","","1.069","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215195","7.8231","0.0005","18.8411","0.0011","22.8612","0.0013","90","","90.874","0.003","90","","3369.3","0.3","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 Ag2 Cl2 N7 O10 -","- C28 H25 Ag2 Cl2 N7 O10 -","- C112 H100 Ag8 Cl8 N28 O40 -","4","1","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71069","MoKα","","0.0838","0.0687","","","0.1704","0.1792","","","","","","1.066","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215196","7.989","0.0005","22.9536","0.0015","20.1547","0.0015","90","","91.046","0.003","90","","3695.3","0.4","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 Ag2 F12 N8 O2 P2 -","- C30 H25 Ag2 F12 N8 O2 P2 -","- C120 H100 Ag8 F48 N32 O8 P8 -","4","1","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71073","MoKα","","0.0874","0.0694","","","0.2074","0.2414","","","","","","1.149","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215197","27.5782","0.0015","10.6328","0.0005","18.6286","0.0009","90","","117.517","0.0017","90","","4844.6","0.4","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H34 Ag2 F6 N8 O11 S2 -","- C46 H34 Ag2 F6 N8 O11 S2 -","- C184 H136 Ag8 F24 N32 O44 S8 -","4","0.5","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71069","MoKα","","0.0631","0.0596","","","0.1349","0.1368","","","","","","1.15","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215198","11.02","0.011","18.3216","0.0017","10.7558","0.001","90","","93.782","0.004","90","","2167","2","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Ag B F4 N4 O2 -","- C22 H16 Ag B F4 N4 O2 -","- C88 H64 Ag4 B4 F16 N16 O8 -","4","1","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71073","MoKα","","0.0263","0.0221","","","0.0502","0.0559","","","","","","1.083","","","","has coordinates","180482","2020-10-21","18:00:00",""
"7215199","11.0709","0.0007","18.5174","0.0012","11.6388","0.0008","90","","96.473","0.003","90","","2370.8","0.3","90","2","90","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Ag F6 N4 O2 P -","- C22 H16 Ag F6 N4 O2 P -","- C88 H64 Ag4 F24 N16 O8 P4 -","4","1","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71069","MoKα","","0.0368","0.034","","","0.0832","0.0846","","","","","","1.145","","","","has coordinates,has disorder","180482","2020-10-21","18:00:00",""
"7215200","10.95","0.007","11.1081","0.0007","12.1273","0.0009","85.248","0.002","86.205","0.003","83.68","0.003","1458.7","0.9","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H22 Ag F6 N6 O2 P -","- C26 H22 Ag F6 N6 O2 P -","- C52 H44 Ag2 F12 N12 O4 P2 -","2","1","","Patil, Komal M.; Cameron, Scott A.; Moratti, Stephen C.; Hanton, Lyall R.","Effect of anion on Ag(i) meso-helical chains formed with 4,4′-dipyridyl ketone: solvent versus anion bridging and anion effects on the strength of ligand binding","CrystEngComm","2014","16","21","4587","","10.1039/c4ce00155a","","","0.71069","MoKα","","0.0515","0.0446","","","0.1202","0.1247","","","","","","1.082","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215201","17.4704","0.0016","28.935","0.002","8.6998","0.0007","90","","113.244","0.002","90","","4040.8","0.6","296","2","296","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C32 H38 Cd N8 O6 P2 -","- C32 H38 Cd N8 O6 P2 -","- C128 H152 Cd4 N32 O24 P8 -","4","0.5","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.0813","0.0533","","","0.1245","0.1369","","","","","","1.008","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215202","10.2738","0.0002","20.8895","0.0005","19.9247","0.0005","90","","97.822","0.002","90","","4236.34","0.17","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H49 Co N6 O14 P2 -","- C33 H33 Co N6 O14 P2 -","- C132 H132 Co4 N24 O56 P8 -","4","1","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.1243","0.0677","","","0.1678","0.1988","","","","","","1.027","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215203","21.757","0.0003","14.2474","0.0002","14.6058","0.0002","90","","118.16","0.001","90","","3991.61","0.1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H34 Cd N6 O8 P2 -","- C33 H34 Cd N6 O8 P2 -","- C132 H136 Cd4 N24 O32 P8 -","4","0.5","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.0497","0.0376","","","0.1003","0.1051","","","","","","1.049","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215204","21.531","0.0004","14.105","0.0002","14.541","0.0002","90","","117.432","0.001","90","","3919.48","0.11","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H34 Co N6 O8 P2 -","- C33 H34 Co N6 O8 P2 -","- C132 H136 Co4 N24 O32 P8 -","4","0.5","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.0738","0.0532","","","0.1408","0.15","","","","","","1.062","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215205","21.6074","0.0006","14.0197","0.0004","14.471","0.0004","90","","117.832","0.002","90","","3876.6","0.2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H34 Cu N6 O8 P2 -","- C33 H34 Cu N6 O8 P2 -","- C132 H136 Cu4 N24 O32 P8 -","4","0.5","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.1212","0.064","","","0.1284","0.1452","","","","","","0.995","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215206","7.6515","0.0002","8.0147","0.0002","9.3307","0.0002","71.162","0.002","67.62","0.002","84.036","0.002","500.64","0.02","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 O6 P2 -","- C18 H24 O6 P2 -","- C18 H24 O6 P2 -","1","0.5","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.0854","0.0518","","","0.1208","0.1383","","","","","","1.042","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215207","15.8384","0.0008","8.4589","0.0005","17.7369","0.0011","90","","96.493","0.002","90","","2361.1","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 O6 P2 -","- C22 H32 O6 P2 -","- C88 H128 O24 P8 -","4","1","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.1295","0.0578","","","0.1142","0.1422","","","","","","1","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215208","8.9485","0.0004","13.0362","0.0006","13.095","0.0006","82.837","0.001","71.006","0.001","87.486","0.001","1433.13","0.11","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H34 Cd N4 O8 P2 -","- C25 H34 Cd N4 O8 P2 -","- C50 H68 Cd2 N8 O16 P4 -","2","1","","Zhang, Jian-Wei; Zhao, Cui-Cui; Zhao, Yin-Ping; Xu, Hai-Qun; Du, Zi-Yi; Jiang, Hai-Long","Metal‒organic frameworks with improved moisture stability based on a phosphonate monoester: effect of auxiliary N-donor ligands on framework dimensionality","CrystEngComm","2014","16","29","6635","","10.1039/c4ce00655k","","","0.71073","MoKα","","0.0326","0.0272","","","0.0709","0.0747","","","","","","1.035","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215209","21.576","0.0004","21.576","0.0004","8.9043","0.0004","90","","90","","120","","3589.82","0.19","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C3 H6 Cu N4 O4 -","- C3 H6 Cu N4 O4 -","- C54 H108 Cu18 N72 O72 -","18","1","","Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Lu, Kai-Hsiang","Impeller-like dodecameric water clusters in metal‒organic nanotubes","CrystEngComm","2014","16","25","5516","","10.1039/c3ce42087f","","","0.71073","MoKα","","0.0472","0.0359","","","0.1044","0.1117","","","","","","1.067","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215216","11.274","0.002","8.2761","0.0017","27.958","0.006","90","","95.47","0.03","90","","2596.7","0.9","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H7 N S4 -","- C13 H7 N S4 -","- C104 H56 N8 S32 -","8","2","","Hayward, John J.; Gumbau-Brisa, Roger; Alberola, Antonio; Clarke, Caroline S.; Rawson, Jeremy M.; Pilkington, Melanie","An unusual single-crystal-to-single-crystal [2 + 2] photocyclisation reaction of a TTF-arylnitrile derivative","CrystEngComm","2014","16","31","7268","","10.1039/C4CE00346B","","","0.71073","MoKα","","0.1039","0.0869","","","0.1718","0.1787","","","","","","1.26","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215217","11.119","0.002","8.3345","0.0017","28.069","0.006","90","","95.85","0.03","90","","2587.6","0.9","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H14 N2 S8 -","- C26 H14 N2 S8 -","- C104 H56 N8 S32 -","4","1","","Hayward, John J.; Gumbau-Brisa, Roger; Alberola, Antonio; Clarke, Caroline S.; Rawson, Jeremy M.; Pilkington, Melanie","An unusual single-crystal-to-single-crystal [2 + 2] photocyclisation reaction of a TTF-arylnitrile derivative","CrystEngComm","2014","16","31","7268","","10.1039/C4CE00346B","","","0.71073","MoKα","","0.0491","0.0365","","","0.0745","0.0789","","","","","","1.076","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215218","3.9337","0.0004","11.3951","0.0009","27.644","0.002","90","","91.393","0.005","90","","1238.77","0.18","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 N2 S4 -","- C12 H6 N2 S4 -","- C48 H24 N8 S16 -","4","1","","Hayward, John J.; Gumbau-Brisa, Roger; Alberola, Antonio; Clarke, Caroline S.; Rawson, Jeremy M.; Pilkington, Melanie","An unusual single-crystal-to-single-crystal [2 + 2] photocyclisation reaction of a TTF-arylnitrile derivative","CrystEngComm","2014","16","31","7268","","10.1039/C4CE00346B","","","0.71073","MoKα","","0.0959","0.0849","","","0.2579","0.2704","","","","","","1.148","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215219","4.984","0.004","7.525","0.005","31.24","0.02","90","","92.611","0.01","90","","1170.4","1.4","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H18 O3 -","- C12 H18 O3 -","- C48 H72 O12 -","4","1","","Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.","Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family","CrystEngComm","2014","16","29","6716","","10.1039/c4ce00519h","","","0.71073","MoKα","","0.0774","0.0471","","","0.0986","0.1124","","","","","","1.054","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215220","5.0871","0.0013","7.5857","0.0019","26.719","0.007","90","","90","","90","","1031.1","0.5","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H16 O3 -","- C11 H16 O3 -","- C44 H64 O12 -","4","1","","Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.","Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family","CrystEngComm","2014","16","29","6716","","10.1039/c4ce00519h","","","0.71073","MoKα","","0.0563","0.0477","","","0.1128","0.1176","","","","","","1.051","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215221","5.0077","0.0009","30.877","0.006","7.4685","0.0014","90","","90.117","0.002","90","","1154.8","0.4","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C12 H18 O3 -","- C12 H18 O3 -","- C48 H72 O12 -","4","2","","Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.","Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family","CrystEngComm","2014","16","29","6716","","10.1039/c4ce00519h","","","0.71073","MoKα","","0.0616","0.0603","","","0.1569","0.1578","","","","","","1.104","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215222","14.756","0.01","14.756","0.01","4.819","0.004","90","","90","","120","","908.7","1.2","150","2","150","2","","","","","","","","3","P 32","P 32","145","","","","- C12 H18 O3 -","- C12 H18 O3 -","- C36 H54 O9 -","3","1","","Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.","Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family","CrystEngComm","2014","16","29","6716","","10.1039/c4ce00519h","","","0.71073","MoKα","","0.0707","0.0517","","","0.1213","0.13","","","","","","1.053","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215223","16.149","0.002","17.459","0.002","8.1259","0.001","90","","90","","90","","2291.1","0.5","150","2","150","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C12 H18 O3 -","- C12 H18 O3 -","- C96 H144 O24 -","8","2","","Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.","Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family","CrystEngComm","2014","16","29","6716","","10.1039/c4ce00519h","","","0.71073","MoKα","","0.0654","0.0434","","","0.1008","0.1143","","","","","","1.015","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215224","15.383","0.0019","20.014","0.003","7.6027","0.0011","90","","90","","90","","2340.7","0.6","150","2","150","2","","","","","","","","3","I b a 2","I 2 -2c","45","","","","- C12 H18 O3 -","- C12 H18 O3 -","- C96 H144 O24 -","8","1","","Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.","Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family","CrystEngComm","2014","16","29","6716","","10.1039/c4ce00519h","","","0.71073","MoKα","","0.0662","0.0468","","","0.099","0.1084","","","","","","1.057","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215230","12.761","0.003","14.961","0.003","17.532","0.006","90","","132.259","0.019","90","","2477.3","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 Cd N4 O4 -","- C27 H24 Cd N4 O4 -","- C108 H96 Cd4 N16 O16 -","4","1","","Li, Ming; Liu, Lu; Zhang, Lin; Lv, Xiaofeng; Ding, Jie; Hou, Hongwei; Fan, Yaoting","Novel coordination polymers of Zn(ii) and Cd(ii) tuned by different aromatic polycarboxylates: synthesis, structures and photocatalytic properties","CrystEngComm","2014","16","28","6408","","10.1039/c4ce00093e","","","0.71073","MoKα","","0.0476","0.0411","","","0.1337","0.1413","","","","","","1.002","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215231","9.4806","0.0019","18.127","0.004","18.693","0.004","61.88","0.03","83.98","0.03","86.35","0.03","2817.3","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H58 N8 O18 Zn3 -","- C56 H46 N8 O18 Zn3 -","- C112 H92 N16 O36 Zn6 -","2","1","","Li, Ming; Liu, Lu; Zhang, Lin; Lv, Xiaofeng; Ding, Jie; Hou, Hongwei; Fan, Yaoting","Novel coordination polymers of Zn(ii) and Cd(ii) tuned by different aromatic polycarboxylates: synthesis, structures and photocatalytic properties","CrystEngComm","2014","16","28","6408","","10.1039/c4ce00093e","","","0.71073","MoKα","","0.0782","0.0643","","","0.1982","0.2129","","","","","","1.032","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215232","12.156","0.002","18.59","0.004","21.024","0.004","74.05","0.03","75.94","0.03","75.58","0.03","4345.8","1.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C75 H74 Cd3 N12 O16 -","- C75 H66 Cd3 N12 O13 -","- C150 H132 Cd6 N24 O26 -","2","1","","Li, Ming; Liu, Lu; Zhang, Lin; Lv, Xiaofeng; Ding, Jie; Hou, Hongwei; Fan, Yaoting","Novel coordination polymers of Zn(ii) and Cd(ii) tuned by different aromatic polycarboxylates: synthesis, structures and photocatalytic properties","CrystEngComm","2014","16","28","6408","","10.1039/c4ce00093e","","","0.71073","MoKα","","0.0911","0.0685","","","0.195","0.2142","","","","","","0.999","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215233","11.65","0.002","15.49","0.003","17.108","0.006","90","","115.37","0.02","90","","2789.5","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 N4 O8 Zn2 -","- C28 H23 N4 O8 Zn2 -","- C112 H92 N16 O32 Zn8 -","4","1","","Li, Ming; Liu, Lu; Zhang, Lin; Lv, Xiaofeng; Ding, Jie; Hou, Hongwei; Fan, Yaoting","Novel coordination polymers of Zn(ii) and Cd(ii) tuned by different aromatic polycarboxylates: synthesis, structures and photocatalytic properties","CrystEngComm","2014","16","28","6408","","10.1039/c4ce00093e","","","0.71073","MoKα","","0.0929","0.0824","","","0.3068","0.3213","","","","","","1.05","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215234","9.4698","0.0019","11.079","0.002","11.161","0.002","77.45","0.03","78.01","0.03","85.11","0.03","1117.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H21 Cd N4 O4 -","- C24 H21 Cd N4 O4 -","- C48 H42 Cd2 N8 O8 -","2","1","","Li, Ming; Liu, Lu; Zhang, Lin; Lv, Xiaofeng; Ding, Jie; Hou, Hongwei; Fan, Yaoting","Novel coordination polymers of Zn(ii) and Cd(ii) tuned by different aromatic polycarboxylates: synthesis, structures and photocatalytic properties","CrystEngComm","2014","16","28","6408","","10.1039/c4ce00093e","","","0.71073","MoKα","","0.0746","0.0567","","","0.1407","0.1635","","","","","","0.959","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215235","12.005","0.002","18.834","0.004","16.723","0.006","90","","123.27","0.02","90","","3161.4","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H32 Cd N4 O8 S -","- C33 H28 Cd N4 O8 S -","- C132 H112 Cd4 N16 O32 S4 -","4","1","","Li, Ming; Liu, Lu; Zhang, Lin; Lv, Xiaofeng; Ding, Jie; Hou, Hongwei; Fan, Yaoting","Novel coordination polymers of Zn(ii) and Cd(ii) tuned by different aromatic polycarboxylates: synthesis, structures and photocatalytic properties","CrystEngComm","2014","16","28","6408","","10.1039/c4ce00093e","","","0.71073","MoKα","","0.0448","0.0419","","","0.1658","0.1716","","","","","","0.999","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215236","10.591","0.002","14.358","0.003","14.998","0.003","71.38","0.03","82.17","0.03","85.58","0.03","2139.8","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H33 Ag3 Cl3 N7 -","- C47 H33 Ag3 Cl3 N7 -","- C94 H66 Ag6 Cl6 N14 -","2","1","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","0.71073","MoKα","","0.0424","0.0356","","","0.0823","0.0865","","","","","","1.11","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215237","9.6655","0.0009","20.3062","0.0016","24.3648","0.0019","90","","90","","90","","4782.1","0.7","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C47 H34 Ag3 Cl7 N6 -","- C47 H34 Ag3 Cl7 N6 -","- C188 H136 Ag12 Cl28 N24 -","4","1","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","0.71073","MoKα","","0.1014","0.0631","","","0.099","0.1159","","","","","","1.041","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215238","9.681","0.002","20.34","0.005","23.673","0.005","90","","90","","90","","4661.5","1.8","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C52 H35 Ag3 Cl3 N7 -","- C52 H35 Ag3 Cl3 N7 -","- C208 H140 Ag12 Cl12 N28 -","4","1","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","0.71073","MoKα","","0.0807","0.061","","","0.0679","0.0731","","","","","","1.074","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215239","14.337","0.003","29.013","0.006","10.568","0.002","90","","100.72","0.03","90","","4319.1","1.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H30 Ag3 I3 N6 -","- C45 H30 Ag3 I3 N6 -","- C180 H120 Ag12 I12 N24 -","4","1","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","0.71073","MoKα","","0.0869","0.0615","","","0.1263","0.1428","","","","","","1.191","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215240","14.6187","0.0003","16.8833","0.0005","18.7304","0.0005","109.403","0.003","97.433","0.002","92.184","0.002","4307.4","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C48.5 H39.5 Ag3 Cl1.5 N6 -","- C48.5 H39.5 Ag3 Cl1.5 N6 -","- C194 H158 Ag12 Cl6 N24 -","4","2","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","1.54178","CuKα","","0.0441","0.037","","","0.0918","0.0975","","","","","","1.02","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215241","29.9358","0.0006","17.05","0.0004","17.3679","0.0006","90","","98.081","0.002","90","","8776.6","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H32 Au3 Cl5 N6 -","- C46 H32 Au3 Cl5 N6 -","- C368 H256 Au24 Cl40 N48 -","8","1","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","0.71073","MoKα","","0.0681","0.041","","","0.06","0.067","","","","","","0.991","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215242","14.567","0.003","28.956","0.006","10.803","0.002","90","","102.74","0.03","90","","4444.5","1.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H30 Au3 I3 N6 -","- C45 H30 Au3 I3 N6 -","- C180 H120 Au12 I12 N24 -","4","1","","Chen, Jing-Huo; Liu, Ya-Mei; Zhang, Jin-Xue; Zhu, Yan-Yan; Tang, Ming-Sheng; Ng, Seik Weng; Yang, Guang","Halogen-involving weak interactions manifested in the crystal structures of silver(i) or gold(i) 4-halogenated-3,5-diphenylpyrazolato trimers","CrystEngComm","2014","16","23","4987","","10.1039/c4ce00029c","","","0.71073","MoKα","","0.1134","0.0938","","","0.2154","0.2296","","","","","","1.237","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215243","7.151","0.0001","24.8988","0.0004","28.6097","0.0004","90","","93.406","0.001","90","","5085","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ROD-8","","","- C49 H37 Cd2 N O12 -","- C47 H33 Cd2 N O11 -","- C188 H132 Cd8 N4 O44 -","4","1","","Li, Ru-Jin; Li, Mian; Zhou, Xiao-Ping; Ng, Seik Weng; O'Keeffe, Michael; Li, Dan","ROD-8, a rod MOF with a pyrene-cored tetracarboxylate linker: framework disorder, derived nets and selective gas adsorption","CrystEngComm","2014","16","28","6291","","10.1039/c4ce00279b","","","1.54178","CuKα","","0.0887","0.0523","","","0.1249","0.1429","","","","","","1.06","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215244","9.2826","0.001","19.692","0.002","13.6649","0.0015","90","","108.704","0.005","90","","2365.9","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","BPTE Succinic Acid","1-(4-pyridyl)-2-(3-thienyl)ethylene butanedioic acid","","- C26 H24 N2 O4 S2 -","- C26 H24 N2 O4 S2 -","- C104 H96 N8 O16 S8 -","4","1","","Hutchins, Kristin M.; Sumrak, Joseph C.; Swenson, Dale C.; MacGillivray, Leonard R.","Head-to-tail photodimerization of a thiophene in a co-crystal and a rare adipic acid dimer in the presence of a heterosynthon","CrystEngComm","2014","16","26","5762","","10.1039/c4ce00481g","","","0.71073","MoKα","","0.1029","0.0591","","","0.1319","0.1523","","","","","","1.041","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215245","11.6886","0.0012","15.1755","0.0015","12.1662","0.0012","90","","117.334","0.005","90","","1917.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4p3tc","rctt-1,3-bis(4-pyridyl)-2,4-bis(3-thienyl) cyclobutane","","- C22 H18 N2 S2 -","- C22 H18 N2 S2 -","- C88 H72 N8 S8 -","4","1","","Hutchins, Kristin M.; Sumrak, Joseph C.; Swenson, Dale C.; MacGillivray, Leonard R.","Head-to-tail photodimerization of a thiophene in a co-crystal and a rare adipic acid dimer in the presence of a heterosynthon","CrystEngComm","2014","16","26","5762","","10.1039/c4ce00481g","","","0.71073","MoKα","","0.0822","0.0443","","","0.1052","0.1268","","","","","","1.037","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215246","15.935","0.0016","7.3782","0.0007","21.823","0.003","90","","100.382","0.005","90","","2523.8","0.5","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","BPTE Glutaric Acid","1-(4-pyridyl)-2-(3-thienyl)ethylene pentanedioic acid","","- C27 H26 N2 O4 S2 -","- C27 H26 N2 O4 S2 -","- C108 H104 N8 O16 S8 -","4","1","","Hutchins, Kristin M.; Sumrak, Joseph C.; Swenson, Dale C.; MacGillivray, Leonard R.","Head-to-tail photodimerization of a thiophene in a co-crystal and a rare adipic acid dimer in the presence of a heterosynthon","CrystEngComm","2014","16","26","5762","","10.1039/c4ce00481g","","","0.71073","MoKα","","0.0564","0.0408","","","0.096","0.1041","","","","","","1.055","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215247","5.6534","0.0006","8.1587","0.0008","18.996","0.002","83.851","0.005","83.879","0.005","74.142","0.005","835.24","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","BPTE Adipic Acid","1-(4-pyridyl)-2-(3-thienyl)ethylene hexanedioic acid","","- C17 H19 N O4 S -","- C17 H19 N O4 S -","- C34 H38 N2 O8 S2 -","2","1","","Hutchins, Kristin M.; Sumrak, Joseph C.; Swenson, Dale C.; MacGillivray, Leonard R.","Head-to-tail photodimerization of a thiophene in a co-crystal and a rare adipic acid dimer in the presence of a heterosynthon","CrystEngComm","2014","16","26","5762","","10.1039/c4ce00481g","","","0.71073","MoKα","","0.1643","0.061","","","0.1012","0.1279","","","","","","0.967","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215248","23.1286","0.0007","9.4276","0.0003","23.3606","0.0007","90","","93.1691","0.0016","90","","5085.9","0.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H15 F3 I3 P Se -","- C24 H15 F3 I3 P Se -","- C192 H120 F24 I24 P8 Se8 -","8","2","","Viger-Gravel, Jasmine; Meyer, Julia E.; Korobkov, Ilia; Bryce, David L.","Probing halogen bonds with solid-state NMR spectroscopy: observation and interpretation of J(77Se,31P) coupling in halogen-bonded PSe⋯I motifs","CrystEngComm","2014","16","31","7285","","10.1039/C4CE00345D","","","0.71073","MoKα","","0.0379","0.0287","","","0.0641","0.0681","","","","","","1.017","","","","has coordinates","194155","2020-10-21","18:00:00",""
"7215249","13.7022","0.0003","12.7689","0.0003","13.9386","0.0003","90","","101.214","0.001","90","","2392.16","0.09","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H15 F4 I2 P Se -","- C24 H15 F4 I2 P Se -","- C96 H60 F16 I8 P4 Se4 -","4","1","","Viger-Gravel, Jasmine; Meyer, Julia E.; Korobkov, Ilia; Bryce, David L.","Probing halogen bonds with solid-state NMR spectroscopy: observation and interpretation of J(77Se,31P) coupling in halogen-bonded PSe⋯I motifs","CrystEngComm","2014","16","31","7285","","10.1039/C4CE00345D","","","0.71073","MoKα","","0.0179","0.0164","","","0.0416","0.0424","","","","","","1.049","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215250","12.243","0.0003","12.0173","0.0002","19.2931","0.0004","90","","101.549","0.001","90","","2781.08","0.1","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C26 H17 Br F3 N4 O7 Re S -","- C26 H17 Br F3 N4 O7 Re S -","- C104 H68 Br4 F12 N16 O28 Re4 S4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0551","0.041","","","0.0933","0.1005","","","","","","1.054","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215251","8.5187","0.0003","11.9891","0.0004","13.4341","0.0004","77.04","0.002","89.004","0.002","84.019","0.002","1329.79","0.08","210","2","210","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H17 F4 N4 O7 Re S -","- C26 H17 F4 N4 O7 Re S -","- C52 H34 F8 N8 O14 Re2 S2 -","2","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.047","0.0403","","","0.097","0.1017","","","","","","1.043","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215252","10.0523","0.0002","11.6515","0.0004","13.0988","0.0004","69.74","0.001","78.794","0.002","82.263","0.002","1408.05","0.07","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H17 F3 I N4 O7 Re S -","- C26 H17 F3 I N4 O7 Re S -","- C52 H34 F6 I2 N8 O14 Re2 S2 -","2","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0375","0.0324","","","0.0716","0.0744","","","","","","1.046","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215253","20.461","0.0003","8.9968","0.0001","31.6923","0.0004","90","","104.268","0.001","90","","5654.07","0.13","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H17 Br F3 N4 O7 Re S -","- C26 H17 Br F3 N4 O7 Re S -","- C208 H136 Br8 F24 N32 O56 Re8 S8 -","8","2","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0564","0.0462","","","0.0886","0.0921","","","","","","1.156","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215254","10.8109","0.0004","11.2437","0.0004","13.6707","0.0005","109.009","0.002","91.179","0.002","117.018","0.002","1371.34","0.09","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H17 Cl F3 N4 O7 Re S -","- C26 H17 Cl F3 N4 O7 Re S -","- C52 H34 Cl2 F6 N8 O14 Re2 S2 -","2","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0872","0.059","","","0.1118","0.1228","","","","","","1.053","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215255","8.3032","0.0003","18.0645","0.0005","18.8024","0.0007","90","","96.999","0.001","90","","2799.22","0.16","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H17 F4 N4 O7 Re S -","- C26 H17 F4 N4 O7 Re S -","- C104 H68 F16 N16 O28 Re4 S4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.1082","0.0572","","","0.0935","0.1096","","","","","","1.042","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215256","9.305","0.0003","18.728","0.0008","17.282","0.0006","90","","101.354","0.002","90","","2952.69","0.19","294","2","294","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C26 H17 F3 I N4 O7 Re S -","- C26 H17 F3 I N4 O7 Re S -","- C104 H68 F12 I4 N16 O28 Re4 S4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.1073","0.0607","","","0.1403","0.1706","","","","","","1.055","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215257","8.563","0.0008","20.396","0.002","16.227","0.0018","90","","94.112","0.007","90","","2826.8","0.5","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C26 H17 F3 I N4 O7 Re S -","- C26 H17 F3 I N4 O7 Re S -","- C104 H68 F12 I4 N16 O28 Re4 S4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.1056","0.0732","","","0.1676","0.1852","","","","","","1.051","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215258","11.4748","0.0007","26.9371","0.0018","23.6378","0.0013","90","","96.295","0.003","90","","7262.3","0.8","110","2","110","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C58 H48 F6 N10 O15 Re2 S2 -","- C58 H45 F6 N10 O15 Re2 S2 -","- C232 H180 F24 N40 O60 Re8 S8 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.1783","0.0897","","","0.2165","0.2757","","","","","","1.058","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215259","12.1162","0.001","27.444","0.003","19.0654","0.0016","90","","99.666","0.004","90","","6249.6","1","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C54 H42 F6 N8 O15 Re2 S2 -","- C54 H40 F6 N8 O15 Re2 S2 -","- C216 H160 F24 N32 O60 Re8 S8 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.2588","0.1206","","","0.23","0.2559","","","","","","0.775","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215260","12.8722","0.0004","4.9256","0.0002","17.571","0.0005","90","","104.327","0.002","90","","1079.41","0.06","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C12 H9 Br N2 O -","- C12 H9 Br N2 O -","- C48 H36 Br4 N8 O4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0442","0.0355","","","0.0815","0.0861","","","","","","1.031","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215261","10.8408","0.0005","21.2412","0.0011","4.8537","0.0002","90","","90","","90","","1117.67","0.09","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C12 H9 I N2 O -","- C12 H9 I N2 O -","- C48 H36 I4 N8 O4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0431","0.0341","","","0.0731","0.0782","","","","","","1.054","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215262","10.512","0.0012","4.8327","0.0006","21.187","0.002","90","","101.264","0.007","90","","1055.6","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N2 O -","- C13 H12 N2 O -","- C52 H48 N8 O4 -","4","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.2443","0.0919","","","0.146","0.192","","","","","","0.979","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215263","9.8494","0.0018","3.8718","0.0007","13.972","0.002","90","","96.018","0.01","90","","529.88","0.16","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H9 Br N2 O -","- C12 H9 Br N2 O -","- C24 H18 Br2 N4 O2 -","2","1","","Taylor, Rupert G. D.; Yeo, Benjamin R.; Hallett, Andrew J.; Kariuki, Benson M.; Pope, Simon J. A.","An organometallic complex revealing an unexpected, reversible, temperature induced SC‒SC transformation","CrystEngComm","2014","16","21","4641","","10.1039/c4ce00070f","","","0.71073","MoKα","","0.0908","0.0806","","","0.1669","0.1746","","","","","","1.163","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215264","17.4918","0.0003","10.4582","0.0002","14.8252","0.0003","90","","97.197","0.001","90","","2690.65","0.09","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H27 Co N6 O2 -","- C33 H27 Co N6 O2 -","- C132 H108 Co4 N24 O8 -","4","0.5","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0365","0.0326","","","0.0866","0.0899","","","","","","0.897","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215265","10.0207","0.0001","10.1954","0.0001","15.5113","0.0002","106.449","0.001","92.122","0.001","103.141","0.001","1471.3","0.03","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H21 Co F6 N6 O2 -","- C33 H21 Co F6 N6 O2 -","- C66 H42 Co2 F12 N12 O4 -","2","1","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0654","0.0463","","","0.113","0.124","","","","","","1.04","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215266","13.2927","0.0015","14.5956","0.0016","17.1232","0.0017","90","","90","","90","","3322.2","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H35 Co N6 O3 -","- C37 H35 Co N6 O3 -","- C148 H140 Co4 N24 O12 -","4","1","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0735","0.0416","","","0.0991","0.1147","","","","","","1.039","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215267","13.3859","0.0005","13.508","0.0005","17.1308","0.0007","90","","96.215","0.002","90","","3079.3","0.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H21 Co F6 N6 O2 -","- C33 H21 Co F6 N6 O2 -","- C132 H84 Co4 F24 N24 O8 -","4","0.5","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0743","0.0598","","","0.1441","0.1569","","","","","","1.043","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215268","9.4261","0.0002","13.4558","0.0002","13.9409","0.0002","106.57","0.001","106.717","0.001","98.302","0.001","1573","0.05","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C68 H62 Cd Cl2 Co2 N12 O6 -","- C68 H62 Cd Cl2 Co2 N12 O6 -","- C68 H62 Cd Cl2 Co2 N12 O6 -","1","0.5","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0389","0.0322","","","0.0841","0.0885","","","","","","1.057","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215269","8.7796","0.0004","16.0109","0.0007","25.1541","0.0011","83.011","0.002","82.318","0.002","79.518","0.002","3428.4","0.3","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C69 H49 Cd Cl2 Co2 F12 N13 O5 -","- C69 H49 Cd Cl2 Co2 F12 N13 O5 -","- C138 H98 Cd2 Cl4 Co4 F24 N26 O10 -","2","1","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.1146","0.0788","","","0.1975","0.2165","","","","","","1.103","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215270","21.3913","0.0005","14.0119","0.0003","26.0194","0.0007","90","","97.703","0.001","90","","7728.5","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C69 H61 Cd Cl2 Co2 N13 O5 -","- C69 H61 Cd Cl2 Co2 N13 O5 -","- C276 H244 Cd4 Cl8 Co8 N52 O20 -","4","1","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.098","0.0592","","","0.1615","0.175","","","","","","1.032","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215271","23.1158","0.0007","25.2786","0.0008","15.2033","0.0005","90","","100.685","0.001","90","","8729.8","0.5","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C66 H42 Cd Cl2 Co2 F12 N12 O4 -","- C66 H42 Cd Cl2 Co2 F12 N12 O4 -","- C264 H168 Cd4 Cl8 Co8 F48 N48 O16 -","4","0.5","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0554","0.0402","","","0.1182","0.1231","","","","","","1.129","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215272","12.1312","0.0006","17.8056","0.0008","22.2981","0.001","102.464","0.002","105.322","0.002","94.702","0.002","4486.1","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C166 H194 Br10 Cd5 Co4 N34 O22 -","- C166 H194 Br10 Cd5 Co4 N34 O22 -","- C166 H194 Br10 Cd5 Co4 N34 O22 -","1","0.5","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.1093","0.0529","","","0.1216","0.1409","","","","","","1.039","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215273","11.3197","0.0005","16.7537","0.0009","24.2708","0.0013","99.224","0.002","102.917","0.002","94.544","0.002","4396.6","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C156 H146 Cd5 Cl10 Co4 F24 N26 O16 -","- C156 H146 Cd5 Cl10 Co4 F24 N26 O16 -","- C156 H146 Cd5 Cl10 Co4 F24 N26 O16 -","1","0.5","","Béziau, Antoine; Baudron, Stéphane A.; Rasoloarison, Dimby; Hosseini, Mir Wais","Rigid yet flexible heteroleptic Co(iii) dipyrrin complexes for the construction of heterometallic 1- and 2-D coordination polymers","CrystEngComm","2014","16","23","4973","","10.1039/c4ce00273c","","","0.71073","MoKα","","0.0877","0.0606","","","0.1524","0.1615","","","","","","1.048","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215281","10.869","0.005","12.13","0.005","13.783","0.004","90","","117.75","0.02","90","","1608.2","1.1","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Mn N2 O6 -","- C14 H16 Mn N2 O6 -","- C56 H64 Mn4 N8 O24 -","4","1","","Matoga, Dariusz; Gil, Barbara; Nitek, Wojciech; Todd, Alexander D.; Bielawski, Christopher W.","Dynamic 2D manganese(ii) isonicotinate framework with reversible crystal-to-amorphous transformation and selective guest adsorption","CrystEngComm","2014","16","23","4959","","10.1039/c4ce00647j","","x-ray","1.5418","CuKα","","0.0366","0.0329","","","0.0832","0.0867","","","","","","0.901","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215282","19.9588","0.0008","19.9588","0.0008","7.6768","0.0004","90","","90","","120","","2648.4","0.2","296","2","296","2","","","","","","","","6","P 3 c 1","P 3 -2""c","158","JA81","","","- C2 H5 Br Cu N S -","- C2 H5 Br Cu N S -","- C36 H90 Br18 Cu18 N18 S18 -","18","3","","Troyano, J.; Perles, J.; Amo-Ochoa, P.; Martínez, J. I.; Zamora, F.; Delgado, S.","Reversible recrystallization process of copper and silver thioacetamide‒halide coordination polymers and their basic building blocks","CrystEngComm","2014","16","35","8224","","10.1039/C4CE00480A","","","0.71073","","","0.0412","0.0295","","","0.0842","0.1004","","","","","","1.003","","","","has coordinates,has disorder","180483","2020-10-21","18:00:00",""
"7215283","11.7896","0.0002","11.7896","0.0002","8.1509","0.0001","90","","90","","120","","981.15","0.03","296","2","296","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","JA100","","","- C2 H5 Cu I N S -","- C2 H5 Cu I N S -","- C12 H30 Cu6 I6 N6 S6 -","6","1","","Troyano, J.; Perles, J.; Amo-Ochoa, P.; Martínez, J. I.; Zamora, F.; Delgado, S.","Reversible recrystallization process of copper and silver thioacetamide‒halide coordination polymers and their basic building blocks","CrystEngComm","2014","16","35","8224","","10.1039/C4CE00480A","","","0.71073","","","0.0605","0.0311","","","0.0862","0.1109","","","","","","1.005","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215284","8.8371","0.0003","8.4068","0.0002","7.4343","0.0002","90","","90","","90","","552.31","0.03","296","2","296","2","","","","","","","","6","P b c m","-P 2c 2b","57","AgTAA","","","- C2 H5 Ag Cl N S -","- C2 H5 Ag Cl N S -","- C8 H20 Ag4 Cl4 N4 S4 -","4","0.5","","Troyano, J.; Perles, J.; Amo-Ochoa, P.; Martínez, J. I.; Zamora, F.; Delgado, S.","Reversible recrystallization process of copper and silver thioacetamide‒halide coordination polymers and their basic building blocks","CrystEngComm","2014","16","35","8224","","10.1039/C4CE00480A","","","0.71073","","","0.0391","0.0296","","","0.072","0.0785","","","","","","1","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215285","8.9917","0.0002","8.4982","0.0002","7.7639","0.0002","90","","90","","90","","593.26","0.02","296","2","296","2","","","","","","","","6","P b c m","-P 2c 2b","57","AgBrTAA_py","","","- C2 H5 Ag Br N S -","- C2 H5 Ag Br N S -","- C8 H20 Ag4 Br4 N4 S4 -","4","0.5","","Troyano, J.; Perles, J.; Amo-Ochoa, P.; Martínez, J. I.; Zamora, F.; Delgado, S.","Reversible recrystallization process of copper and silver thioacetamide‒halide coordination polymers and their basic building blocks","CrystEngComm","2014","16","35","8224","","10.1039/C4CE00480A","","","0.71073","","","0.0345","0.0285","","","0.0738","0.0767","","","","","","1","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215286","4.0277","0.0002","6.3237","0.0006","14.0649","0.0014","97.11","0.008","91.015","0.006","100.632","0.007","349.07","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H6 B F O2 -","- C7 H6 B F O2 -","- C14 H12 B2 F2 O4 -","2","1","","Sene, Saad; Berthomieu, Dorothée; Donnadieu, Bruno; Richeter, Sébastien; Vezzani, Joris; Granier, Dominique; Bégu, Sylvie; Mutin, Hubert; Gervais, Christel; Laurencin, Danielle","A combined experimental-computational study of benzoxaborole crystal structures","CrystEngComm","2014","16","23","4999","","10.1039/c4ce00313f","","","0.71073","MoKα","","0.048","0.037","","","0.0906","0.0975","","","","","","1.043","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215287","24.6035","0.0005","11.9649","0.0003","18.4269","0.0004","90","","114.571","0.001","90","","4933.3","0.2","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H38 Cd N8 O10 -","- C46 H38 Cd N8 O10 -","- C184 H152 Cd4 N32 O40 -","4","0.5","","Singh, Udai P.; Narang, Shikha; Pachfule, Pradip; Banerjee, Rahul","Variation of CO2 adsorption in isostructural Cd(ii)/Co(ii) based MOFs by anion modulation","CrystEngComm","2014","16","23","5012","","10.1039/c4ce00058g","","","0.71073","MoKα","","0.0577","0.0483","","","0.1441","0.1508","","","","","","1.087","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215288","24.665","0.002","11.9542","0.0011","17.8777","0.0018","90","","112.764","0.004","90","","4860.6","0.8","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H38 Br2 Cd N6 O4 -","- C46 H38 Br2 Cd N6 O4 -","- C184 H152 Br8 Cd4 N24 O16 -","4","0.5","","Singh, Udai P.; Narang, Shikha; Pachfule, Pradip; Banerjee, Rahul","Variation of CO2 adsorption in isostructural Cd(ii)/Co(ii) based MOFs by anion modulation","CrystEngComm","2014","16","23","5012","","10.1039/c4ce00058g","","","0.71073","MoKα","","0.0562","0.0397","","","0.1292","0.1388","","","","","","0.967","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215289","25.611","0.0007","11.5667","0.0003","18.5397","0.0006","90","","114.345","0.001","90","","5003.7","0.3","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H38 Cd I2 N6 O4 -","- C46 H38 Cd I2 N6 O4 -","- C184 H152 Cd4 I8 N24 O16 -","4","0.5","","Singh, Udai P.; Narang, Shikha; Pachfule, Pradip; Banerjee, Rahul","Variation of CO2 adsorption in isostructural Cd(ii)/Co(ii) based MOFs by anion modulation","CrystEngComm","2014","16","23","5012","","10.1039/c4ce00058g","","","0.71073","MoKα","","0.0406","0.0311","","","0.1106","0.1178","","","","","","0.809","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215290","24.4845","0.0018","11.8901","0.0008","18.1106","0.0013","90","","114.564","0.004","90","","4795.2","0.6","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H38 Cl2 Co N6 O4 -","- C46 H38 Cl2 Co N6 O4 -","- C184 H152 Cl8 Co4 N24 O16 -","4","0.5","","Singh, Udai P.; Narang, Shikha; Pachfule, Pradip; Banerjee, Rahul","Variation of CO2 adsorption in isostructural Cd(ii)/Co(ii) based MOFs by anion modulation","CrystEngComm","2014","16","23","5012","","10.1039/c4ce00058g","","","0.71073","MoKα","","0.1181","0.0731","","","0.215","0.2277","","","","","","1.33","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215291","9.4682","0.0014","10.4331","0.0017","10.7425","0.0017","67.349","0.009","73.251","0.009","85.916","0.009","936.8","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H19 N3 O2 -","- C23 H19 N3 O2 -","- C46 H38 N6 O4 -","2","1","","Singh, Udai P.; Narang, Shikha; Pachfule, Pradip; Banerjee, Rahul","Variation of CO2 adsorption in isostructural Cd(ii)/Co(ii) based MOFs by anion modulation","CrystEngComm","2014","16","23","5012","","10.1039/c4ce00058g","","","0.71073","MoKα","","0.0751","0.0457","","","0.1282","0.1539","","","","","","0.912","","","","has coordinates","180483","2020-10-21","18:00:00",""
"7215449","8.5014","0.0005","13.1428","0.0007","9.5296","0.0005","90","","94.682","0.002","90","","1061.21","0.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H10 Eu O11 -","- C6 H7 Eu O11 -","- C24 H28 Eu4 O44 -","4","1","","da Luz, Leonis L.; Lucena Viana, Bárbara F.; da Silva, Gabriel C. Oliveira; Gatto, Claudia C.; Fontes, Adriana M.; Malta, Marcos; Weber, Ingrid T.; Rodrigues, Marcelo O.; Júnior, Severino Alves","Controlling the energy transfer in lanthanide‒organic frameworks for the production of white-light emitting materials","CrystEngComm","2014","16","30","6914","","10.1039/C4CE00538D","","","0.71073","MoKα","","0.0259","0.0223","","","0.0512","0.0526","","","","","","1.065","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7215450","8.4612","0.0009","13.1272","0.0016","9.4855","0.0011","90","","94.652","0.007","90","","1050.1","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H10 Gd O11 -","- C6 H6 Gd O11 -","- C24 H24 Gd4 O44 -","4","1","","da Luz, Leonis L.; Lucena Viana, Bárbara F.; da Silva, Gabriel C. Oliveira; Gatto, Claudia C.; Fontes, Adriana M.; Malta, Marcos; Weber, Ingrid T.; Rodrigues, Marcelo O.; Júnior, Severino Alves","Controlling the energy transfer in lanthanide‒organic frameworks for the production of white-light emitting materials","CrystEngComm","2014","16","30","6914","","10.1039/C4CE00538D","","","0.71073","MoKα","","0.0201","0.0186","","","0.0453","0.0459","","","","","","1.152","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7215451","8.4548","0.0002","13.1047","0.0004","9.4885","0.0002","90","","94.439","0.001","90","","1048.15","0.05","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H10 O11 Tb -","- C6 H10 O11 Tb -","- C24 H40 O44 Tb4 -","4","1","","da Luz, Leonis L.; Lucena Viana, Bárbara F.; da Silva, Gabriel C. Oliveira; Gatto, Claudia C.; Fontes, Adriana M.; Malta, Marcos; Weber, Ingrid T.; Rodrigues, Marcelo O.; Júnior, Severino Alves","Controlling the energy transfer in lanthanide‒organic frameworks for the production of white-light emitting materials","CrystEngComm","2014","16","30","6914","","10.1039/C4CE00538D","","","0.71073","MoKα","","0.0317","0.0303","","","0.0777","0.0787","","","","","","1.122","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7215452","6.483","0.002","9.222","0.004","10.555","0.003","64.5","","81.417","0.004","80.98","","560.2","0.3","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H9 Ag2 N2 O4 -","- C11 H9 Ag2 N2 O4 -","- C22 H18 Ag4 N4 O8 -","2","1","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","MoKα","","0.0305","0.027","","","0.0651","0.0689","","","","","","1.102","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215453","8.059","0.002","10.243","0.004","17.378","0.003","98.88","","96.736","0.004","105.14","","1349.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H20 Ag4 N2 O8 -","- C30 H20 Ag4 N2 O8 -","- C60 H40 Ag8 N4 O16 -","2","1","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","MoKα","","0.0546","0.0408","","","0.108","0.1134","","","","","","1.082","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215454","13.687","0.002","14.88","0.003","13.809","0.004","90","","90","","90","","2812.4","1.1","273","2","273.15","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C28 H24 Ag4 N4 O8 -","- C28 H24 Ag4 N4 O8 -","- C112 H96 Ag16 N16 O32 -","4","1","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","MoKα","","0.0824","0.06","","","0.1318","0.1496","","","","","","1","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215455","7.2517","0.0014","7.7768","0.0015","25.608","0.004","90","","90.522","0.004","90","","1444.1","0.5","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H44 Ag8 N12 O24 -","- C56 H44 Ag8 N12 O24 -","- C56 H44 Ag8 N12 O24 -","1","0.25","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","","","0.058","0.0395","","","","0.0978","","","","","","1.019","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215456","9.3459","0.0019","21.924","0.004","7.0573","0.0014","90","","106.11","0.03","90","","1389.3","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H6 Ag N O2 -","- C7 H6 Ag N O2 -","- C56 H48 Ag8 N8 O16 -","8","1","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","MoKα","","0.0324","0.0294","","","0.0743","0.0775","","","","","","1.115","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215457","16.306","0.002","11.578","0.004","19.417","0.003","90","","90.207","0.004","90","","3665.7","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 Ag6 N4 O17 -","- C30 H32 Ag6 N4 O17 -","- C120 H128 Ag24 N16 O68 -","4","1","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","MoKα","","0.0361","0.0298","","","0.0748","0.0776","","","","","","1.182","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215458","14.757","0.003","20.578","0.004","13.995","0.002","90","","90.04","0.004","90","","4249.9","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H36 Ag6 N6 O12 -","- C42 H36 Ag6 N6 O12 -","- C168 H144 Ag24 N24 O48 -","4","1","","Wang, Zhan-Hui; Wang, Dan-Feng; Zhang, Ting; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, characterization, crystal structures and thermal and photoluminescence studies of dimethylpyrazine-carboxylate mixed ligand silver(i) coordination polymers with various multinuclear silver units","CrystEngComm","2014","16","23","5028","","10.1039/c4ce00072b","","","0.71073","MoKα","","0.141","0.0818","","","0.1963","0.2676","","","","","","1.01","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215459","18.431","0.0017","18.431","0.0017","69.911","0.015","90","","90","","120","","20567","5","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C14 H8 Cu N2 O5 -","- C14 H8 Cu N2 O5 -","- C504 H288 Cu36 N72 O180 -","36","1","","Du, Liting; Yang, Shilong; Xu, Li; Min, Huihua; Zheng, Baishu","Highly selective carbon dioxide uptake by a microporous kgm-pillared metal‒organic framework with acylamide groups","CrystEngComm","2014","16","25","5520","","10.1039/c4ce00530a","","","0.71073","MoKα","","0.0744","0.0642","","","0.1905","0.1993","","","","","","1.183","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215460","11.0637","0.0009","7.2056","0.0006","22.927","0.002","90","","101.564","0.008","90","","1790.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H14 N4 S4 -","- C16 H14 N4 S4 -","- C64 H56 N16 S16 -","4","1","","Biet, Thomas; Avarvari, Narcis","Electroactive tetrathiafulvalene based pyridine-mono and -bis(1,2,3-triazoles) click ligands: synthesis, crystal structures and coordination chemistry","CrystEngComm","2014","16","29","6612","","10.1039/c4ce00736k","","","0.71073","MoKα","","0.1654","0.06","","","0.0924","0.1178","","","","","","1.003","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215461","11.278","0.0012","31.812","0.003","8.79","0.004","90","","98.853","0.014","90","","3116.1","1.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H23 N7 S8 -","- C27 H23 N7 S8 -","- C108 H92 N28 S32 -","4","0.5","","Biet, Thomas; Avarvari, Narcis","Electroactive tetrathiafulvalene based pyridine-mono and -bis(1,2,3-triazoles) click ligands: synthesis, crystal structures and coordination chemistry","CrystEngComm","2014","16","29","6612","","10.1039/c4ce00736k","","","0.71073","MoKα","","0.1353","0.0608","","","0.1107","0.1367","","","","","","1.047","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215462","12.283","0.0013","12.898","0.0015","22.171","0.004","80.437","0.012","87.138","0.011","89.403","0.008","3459.3","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H16 Co F12 N4 O4 S4 -","- C26 H16 Co F12 N4 O4 S4 -","- C104 H64 Co4 F48 N16 O16 S16 -","4","2","","Biet, Thomas; Avarvari, Narcis","Electroactive tetrathiafulvalene based pyridine-mono and -bis(1,2,3-triazoles) click ligands: synthesis, crystal structures and coordination chemistry","CrystEngComm","2014","16","29","6612","","10.1039/c4ce00736k","","","0.71073","MoKα","","0.2174","0.0896","","","0.1577","0.2078","","","","","","1.026","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215463","21.102","0.003","21.102","0.002","15.611","0.0014","90","","90","","90","","6951.5","1.3","293","2","293","2","","","","","","","","7","P 4 c c","P 4 -2c","103","","","","- C108 H92 Cd Cl2 N28 O12 S32 -","- C108 H92 Cd Cl2 N28 O12 S32 -","- C216 H184 Cd2 Cl4 N56 O24 S64 -","2","0.25","","Biet, Thomas; Avarvari, Narcis","Electroactive tetrathiafulvalene based pyridine-mono and -bis(1,2,3-triazoles) click ligands: synthesis, crystal structures and coordination chemistry","CrystEngComm","2014","16","29","6612","","10.1039/c4ce00736k","","","0.71073","MoKα","","0.0962","0.0497","","","0.086","0.103","","","","","","1.117","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215464","16.796","0.004","9.9569","0.0012","25.493","0.003","90","","103.108","0.009","90","","4152.3","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H52 Cd5 Cl10 N16 S16 -","- C58 H52 Cd5 Cl10 N16 S16 -","- C116 H104 Cd10 Cl20 N32 S32 -","2","0.5","","Biet, Thomas; Avarvari, Narcis","Electroactive tetrathiafulvalene based pyridine-mono and -bis(1,2,3-triazoles) click ligands: synthesis, crystal structures and coordination chemistry","CrystEngComm","2014","16","29","6612","","10.1039/c4ce00736k","","","0.71073","MoKα","","0.0553","0.0372","","","0.0837","0.0896","","","","","","1.063","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215465","13.262","0.003","13.508","0.002","24.549","0.004","76.154","0.008","86.364","0.009","63.763","0.008","3825.5","1.2","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C37 H56 Cl3 N3 O4 -","- C37 H56 Cl3 N3 O4 -","- C148 H224 Cl12 N12 O16 -","4","4","","Asthana, Deepak; Keshri, Sudhir K.; Hundal, Geeta; Sharma, Gyaneswar; Mukhopadhyay, Pritam","Self-assembly patterns of steroid-based all-organic ferroelectrics: valuable insights from the single-crystals derived from an organogel and solution","CrystEngComm","2014","16","22","4861","","10.1039/c4ce00013g","","","0.71073","MoKα","","0.0975","0.0628","","","0.1517","0.1753","","","","","","0.975","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215466","12.9772","0.0003","14.3714","0.0002","22.68","0.0006","73.075","0.001","79.981","0.001","69.56","0.001","3779.49","0.15","123","0.1","123","0.1","","","","","","","synthesis as described","4","P 1","P 1","1","","","","- C156 H252 N12 O20 -","- C156 H252 N12 O20 -","- C156 H252 N12 O20 -","1","1","","Asthana, Deepak; Keshri, Sudhir K.; Hundal, Geeta; Sharma, Gyaneswar; Mukhopadhyay, Pritam","Self-assembly patterns of steroid-based all-organic ferroelectrics: valuable insights from the single-crystals derived from an organogel and solution","CrystEngComm","2014","16","22","4861","","10.1039/c4ce00013g","","x-ray","0.71073","MoKα","","0.0824","0.061","","","0.13","0.1427","","","","","","1.03","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215472","10.1249","0.0007","4.7655","0.0003","35.02","0.003","90","","93.387","0.002","90","","1686.8","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H42 O13 -","- C32 H36 O13 -","- C64 H72 O26 -","2","0.5","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.1049","0.0858","","","0.2555","0.2743","","","","","","1.081","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215473","10.125","0.006","4.993","0.003","37.33","0.02","90","","93.079","0.015","90","","1884.5","1.9","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 O6 -","- C18 H24 O6 -","- C72 H96 O24 -","4","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0938","0.0792","","","0.2436","0.2647","","","","","","1.161","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215474","30.0728","0.0008","9.9777","0.0003","16.8414","0.0004","90","","105.73","0.002","90","","4864.1","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H39 N O6 -","- C24 H39 N O6 -","- C192 H312 N8 O48 -","8","2","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.1579","0.1053","","","0.2468","0.2727","","","","","","1.085","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215475","33.1689","0.001","10.1077","0.0003","16.6962","0.0005","90","","103.568","0.002","90","","5441.4","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H68 N2 O14 -","- C52 H68 N2 O14 -","- C208 H272 N8 O56 -","4","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0903","0.0767","","","0.2162","0.2351","","","","","","1.007","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215476","13.957","0.004","10.086","0.003","17.006","0.005","90","","113.026","0.005","90","","2203.2","1.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H29 N O6 -","- C21 H21 N O6 -","- C84 H84 N4 O24 -","4","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0717","0.0617","","","0.1932","0.204","","","","","","1.067","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215477","17.7425","0.0009","8.7392","0.0005","19.5395","0.001","90","","102.293","0.002","90","","2960.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H49 N O7 -","- C30 H49 N O7 -","- C120 H196 N4 O28 -","4","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0508","0.0411","","","0.1168","0.1297","","","","","","1.017","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215478","31.663","0.003","10.0805","0.001","16.7716","0.0017","90","","104.662","0.002","90","","5178.8","0.9","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H43 N O6 -","- C26 H39 N O6 -","- C208 H312 N8 O48 -","8","2","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0686","0.0495","","","0.1327","0.1474","","","","","","1.079","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215479","16.681","0.002","10.1817","0.0014","28.164","0.004","90","","90","","90","","4783.4","1.1","296","2","296","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C24 H32 N O6 -","- C24 H32 N O6 -","- C192 H256 N8 O48 -","8","2","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0405","0.0368","","","0.0998","0.1031","","","","","","0.993","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215480","8.405","0.011","16.69","0.02","9.156","0.013","90","","117.32","0.08","90","","1141","3","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H37 N O6 -","- C23 H37 N O6 -","- C46 H74 N2 O12 -","2","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0673","0.063","","","0.1606","0.1643","","","","","","1.047","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215481","14.566","0.01","9.991","0.007","17.129","0.011","90","","112.74","0.013","90","","2299","3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H33 N O6 -","- C21 H17 N O6 -","- C84 H68 N4 O24 -","4","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.1429","0.0866","","","0.2308","0.2754","","","","","","1.016","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215482","14.494","0.005","8.794","0.005","19.179","0.005","90","","111.665","0.005","90","","2271.9","1.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H37 N O6 -","- C23 H37 N O6 -","- C92 H148 N4 O24 -","4","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0628","0.0502","","","0.1366","0.1483","","","","","","1.066","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215483","29.446","0.014","39.144","0.019","17.41","0.008","90","","90","","90","","20067","16","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C51 H89 N3 O7 -","- C51 H89 N3 O7 -","- C816 H1424 N48 O112 -","16","1","","Adalder, Tapas Kumar; Dastidar, Parthasarathi","The role of secondary ammonium cations in controlling the conformation of C3-symmetric acid moieties and its implication for the design of supramolecular capsules","CrystEngComm","2014","16","22","4867","","10.1039/c3ce42655f","","","0.71073","MoKα","","0.0502","0.039","","","0.0987","0.1067","","","","","","1.147","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215484","17.9447","0.0004","19.1082","0.0004","11.5533","0.0002","90","","90","","90","","3961.52","0.14","296","2","296","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C44 H36 Mo2 N16 -","- C44 H36 Mo2 N16 -","- C176 H144 Mo8 N64 -","4","0.5","","Hsu, Wayne; Li, Yu-Sian; He, Hsiu-Yi; Chen, Kuan-Ting; Wu, Hong-Sheng; Proserpio, Davide M.; Chen, Jhy-Der; Wang, Ju-Chun","Stepwise formation of heteronuclear coordination networks based on quadruple-bonded dimolybdenum units containing formamidinate ligands","CrystEngComm","2014","16","32","7385","","10.1039/C4CE00474D","","","0.71073","MoKα","","0.0525","0.0289","","","0.0591","0.0673","","","","","","1.018","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215485","14.9903","0.0008","9.2196","0.0005","20.0369","0.0011","90","","101.615","0.003","90","","2712.5","0.3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22.5 H20 Br2 Hg Mo N8 O0.5 -","- C22.5 H19.5 Br2 Hg Mo N8 O0.5 -","- C90 H78 Br8 Hg4 Mo4 N32 O2 -","4","1","","Hsu, Wayne; Li, Yu-Sian; He, Hsiu-Yi; Chen, Kuan-Ting; Wu, Hong-Sheng; Proserpio, Davide M.; Chen, Jhy-Der; Wang, Ju-Chun","Stepwise formation of heteronuclear coordination networks based on quadruple-bonded dimolybdenum units containing formamidinate ligands","CrystEngComm","2014","16","32","7385","","10.1039/C4CE00474D","","","0.71073","MoKα","","0.077","0.0458","","","0.1127","0.1275","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215486","15.3948","0.0003","9.2721","0.0002","20.2932","0.0003","90","","103.088","0.001","90","","2821.45","0.09","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22.5 H20 Hg I2 Mo N8 O0.5 -","- C22.5 H19.5 Hg I2 Mo N8 O0.5 -","- C90 H78 Hg4 I8 Mo4 N32 O2 -","4","1","","Hsu, Wayne; Li, Yu-Sian; He, Hsiu-Yi; Chen, Kuan-Ting; Wu, Hong-Sheng; Proserpio, Davide M.; Chen, Jhy-Der; Wang, Ju-Chun","Stepwise formation of heteronuclear coordination networks based on quadruple-bonded dimolybdenum units containing formamidinate ligands","CrystEngComm","2014","16","32","7385","","10.1039/C4CE00474D","","","0.71073","MoKα","","0.0605","0.0497","","","0.1496","0.1618","","","","","","1.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215487","12.8206","0.0007","12.7766","0.0007","17.2962","0.0009","90","","95.517","0.002","90","","2820.1","0.3","99","2","99","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H36 Cl7 Hg3.5 Mo2 N16 -","- C43.92 H35.92 Cl7.2 Hg3.6 Mo2 N16 -","- C87.84 H71.84 Cl14.4 Hg7.2 Mo4 N32 -","2","0.5","","Hsu, Wayne; Li, Yu-Sian; He, Hsiu-Yi; Chen, Kuan-Ting; Wu, Hong-Sheng; Proserpio, Davide M.; Chen, Jhy-Der; Wang, Ju-Chun","Stepwise formation of heteronuclear coordination networks based on quadruple-bonded dimolybdenum units containing formamidinate ligands","CrystEngComm","2014","16","32","7385","","10.1039/C4CE00474D","","","0.71073","MoKα","","0.0742","0.0598","","","0.1541","0.1631","","","","","","1.043","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215488","5.659","0.0013","7.9562","0.0018","19.147","0.004","96.62","0.003","95.808","0.004","98.313","0.003","841.2","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H22 Cd3 O20 P4 -","- C28 H22 Cd3 O20 P4 -","- C28 H22 Cd3 O20 P4 -","1","0.5","","Dai, Lu-Lu; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Zhou, Wei; Li, Wen-Zhu; Sun, Tong; Luo, Hui; Ma, Ming-Xue","Syntheses, structures, luminescence and molecular recognition properties of four new cadmium carboxyphosphonates with 2D layered and 3D supramolecular structures","CrystEngComm","2014","16","23","5050","","10.1039/c4ce00040d","","","0.71073","MoKα","","0.0563","0.0525","","","0.1493","0.1553","","","","","","1.073","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215489","18.2285","0.0013","12.4643","0.0009","18.4247","0.0019","90","","117.261","0.001","90","","3721.2","0.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H17 Cd N2 O7 P -","- C17 H17 Cd N2 O7 P -","- C136 H136 Cd8 N16 O56 P8 -","8","1","","Dai, Lu-Lu; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Zhou, Wei; Li, Wen-Zhu; Sun, Tong; Luo, Hui; Ma, Ming-Xue","Syntheses, structures, luminescence and molecular recognition properties of four new cadmium carboxyphosphonates with 2D layered and 3D supramolecular structures","CrystEngComm","2014","16","23","5050","","10.1039/c4ce00040d","","","0.71073","MoKα","","0.0396","0.0275","","","0.0647","0.0701","","","","","","1.021","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215490","13.9812","0.0014","14.7218","0.0014","15.0185","0.0014","103.264","0.002","92.471","0.002","110.865","0.001","2784.9","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H44 Cd3 N6 O16 P2 -","- C50 H44 Cd3 N6 O16 P2 -","- C100 H88 Cd6 N12 O32 P4 -","2","1","","Dai, Lu-Lu; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Zhou, Wei; Li, Wen-Zhu; Sun, Tong; Luo, Hui; Ma, Ming-Xue","Syntheses, structures, luminescence and molecular recognition properties of four new cadmium carboxyphosphonates with 2D layered and 3D supramolecular structures","CrystEngComm","2014","16","23","5050","","10.1039/c4ce00040d","","","0.71073","MoKα","","0.0827","0.0512","","","0.1532","0.1738","","","","","","1.038","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215491","11.78","0.0011","9.4034","0.0009","18.8322","0.0018","90","","103.465","0.002","90","","2028.7","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 Cd N2 O9 P -","- C17 H21 Cd N2 O9 P -","- C68 H84 Cd4 N8 O36 P4 -","4","1","","Dai, Lu-Lu; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Zhou, Wei; Li, Wen-Zhu; Sun, Tong; Luo, Hui; Ma, Ming-Xue","Syntheses, structures, luminescence and molecular recognition properties of four new cadmium carboxyphosphonates with 2D layered and 3D supramolecular structures","CrystEngComm","2014","16","23","5050","","10.1039/c4ce00040d","","","0.71073","MoKα","","0.0651","0.0415","","","0.1044","0.1166","","","","","","1.032","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215492","7.81","0.0013","21.238","0.004","26.989","0.005","90","","90","","90","","4476.6","1.4","293","","293","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C14 H18 B F4 O2 S8 -","- C14 H18 B F4.005 O2 S8 -","- C112 H144 B8 F32.04 O16 S64 -","8","1","","Martin, Lee; Wallis, John D.; Guziak, Milena A.; Oxspring, Jack; Lopez, Jordan R.; Nakatsuji, Shin'ichi; Yamada, Jun'ichi; Akutsu, Hiroki","Stereoisomeric semiconducting radical cation salts of chiral bis(2-hydroxypropylthio)ethylenedithioTTF with tetrafluoroborate anions","CrystEngComm","2014","16","24","5424","","10.1039/c4ce00116h","","","0.71075","MoKα","","","0.0486","","","","0.1232","","","","","","1.044","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215493","7.8172","0.0013","21.232","0.004","26.987","0.005","90","","90","","90","","4479.2","1.4","293","","293","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C14 H18 B F4 O2 S8 -","- C14 H18 B F3.993 O2 S8 -","- C112 H144 B8 F31.944 O16 S64 -","8","1","","Martin, Lee; Wallis, John D.; Guziak, Milena A.; Oxspring, Jack; Lopez, Jordan R.; Nakatsuji, Shin'ichi; Yamada, Jun'ichi; Akutsu, Hiroki","Stereoisomeric semiconducting radical cation salts of chiral bis(2-hydroxypropylthio)ethylenedithioTTF with tetrafluoroborate anions","CrystEngComm","2014","16","24","5424","","10.1039/c4ce00116h","","","0.71075","MoKα","","","0.0603","","","","0.1421","","","","","","1.041","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215494","7.81","0.0013","21.238","0.004","26.989","0.005","90","","90","","90","","4476.6","1.4","293","","293","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C14 H18 B F4 O2 S8 -","- C14 H18 B F4 O2 S8 -","- C112 H144 B8 F32 O16 S64 -","8","1","","Martin, Lee; Wallis, John D.; Guziak, Milena A.; Oxspring, Jack; Lopez, Jordan R.; Nakatsuji, Shin'ichi; Yamada, Jun'ichi; Akutsu, Hiroki","Stereoisomeric semiconducting radical cation salts of chiral bis(2-hydroxypropylthio)ethylenedithioTTF with tetrafluoroborate anions","CrystEngComm","2014","16","24","5424","","10.1039/c4ce00116h","","","0.71075","MoKα","","","0.0647","","","","0.2003","","","","","","1.299","","","","has coordinates","180485","2020-10-21","18:00:00",""
"7215499","11.5361","0.0003","11.5361","0.0003","37.3168","0.0019","90","","90","","90","","4966.2","0.3","173","2","173","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C27 H23 N3 O5 Zn -","- C26.994 H22 N3 O5 Zn -","- C215.952 H176 N24 O40 Zn8 -","8","1","","Mehlana, Gift; Ramon, Gaëlle; Bourne, Susan A.","The role of C‒H⋯π interactions in modulating the breathing amplitude of a 2D square lattice net: alcohol sorption studies","CrystEngComm","2014","16","35","8160","","10.1039/C4CE00496E","","","0.71073","MoKα","","0.0543","0.0429","","","0.0982","0.1029","","","","","","1.059","","","","has coordinates,has disorder","180485","2020-10-21","18:00:00",""
"7215500","11.5806","0.0003","11.5806","0.0003","34.904","0.002","90","","90","","90","","4681","0.3","173","2","173","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C24 H16 N2 O4 Zn -","- C24 H16 N2 O4 Zn -","- C192 H128 N16 O32 Zn8 -","8","1","","Mehlana, Gift; Ramon, Gaëlle; Bourne, Susan A.","The role of C‒H⋯π interactions in modulating the breathing amplitude of a 2D square lattice net: alcohol sorption studies","CrystEngComm","2014","16","35","8160","","10.1039/C4CE00496E","","","0.71073","MoKα","","0.0483","0.0404","","","0.1283","0.134","","","","","","1.053","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215501","11.6638","0.0004","11.6638","0.0004","36.79","0.003","90","","90","","90","","5005.1","0.5","173","2","173","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C27 H24 N2 O5 Zn -","- C25.2 H16 N2 O4.4 Zn -","- C201.6 H128 N16 O35.2 Zn8 -","8","1","","Mehlana, Gift; Ramon, Gaëlle; Bourne, Susan A.","The role of C‒H⋯π interactions in modulating the breathing amplitude of a 2D square lattice net: alcohol sorption studies","CrystEngComm","2014","16","35","8160","","10.1039/C4CE00496E","","","0.71073","MoKα","","0.1152","0.0917","","","0.2524","0.2739","","","","","","1.043","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215502","19.0671","0.0019","10.4052","0.0008","22.384","0.0019","90","","99.004","0.001","90","","4386.2","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H18 Mn N2 O5 -","- C27 H18 Mn N2 O5 -","- C216 H144 Mn8 N16 O40 -","8","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.0745","0.046","","","0.0929","0.1105","","","","","","1.03","","","","has coordinates,has disorder","180486","2020-10-21","18:00:00",""
"7215503","10.7055","0.0007","12.564","0.0009","15.7296","0.001","113.095","0.002","98.85","0.001","102.229","0.001","1834.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H38 Co N4 O11 -","- C39 H38 Co N4 O11 -","- C78 H76 Co2 N8 O22 -","2","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.0918","0.059","","","0.1455","0.1686","","","","","","1.029","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215504","19.0329","0.0018","10.395","0.0009","22.382","0.002","90","","99.021","0.001","90","","4373.4","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H18 Co N2 O5 -","- C27 H18 Co N2 O5 -","- C216 H144 Co8 N16 O40 -","8","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.1072","0.0593","","","0.1441","0.1803","","","","","","1.044","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215505","19.2419","0.0007","10.4225","0.0003","22.3595","0.0007","90","","98.676","0.001","90","","4432.9","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H18 Cd N2 O5 -","- C27 H18 Cd N2 O5 -","- C216 H144 Cd8 N16 O40 -","8","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.0601","0.0376","","","0.0652","0.0764","","","","","","1.064","","","","has coordinates,has disorder","180486","2020-10-21","18:00:00",""
"7215506","35.13","0.003","7.3946","0.0003","19.1657","0.0013","90","","109.809","0.002","90","","4684.1","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H22 Mn N2 O7 -","- C25 H22 Mn N2 O7 -","- C200 H176 Mn8 N16 O56 -","8","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.1107","0.0567","","","0.0879","0.115","","","","","","1.057","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215507","35.083","0.003","7.294","0.0005","19.1329","0.0017","90","","109.888","0.002","90","","4604","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H22 Co N2 O7 -","- C25 H22 Co N2 O7 -","- C200 H176 Co8 N16 O56 -","8","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.1128","0.0572","","","0.1147","0.1421","","","","","","0.991","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215508","7.5718","0.0007","14.0421","0.0019","17.244","0.002","74.534","0.001","83.804","0.001","88.439","0.002","1756.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H34 Cu N2 O12 -","- C40 H34 Cu N2 O12 -","- C80 H68 Cu2 N4 O24 -","2","1","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.1358","0.069","","","0.0797","0.1025","","","","","","1.095","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215509","12.6755","0.0005","16.983","0.0006","20.7087","0.0011","90","","103.418","0.002","90","","4336.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H36 Cd2 N4 O10 -","- C50 H36 Cd2 N4 O10 -","- C200 H144 Cd8 N16 O40 -","4","0.5","","Cao, Xinyu; Mu, Bao; Huang, Rudan","Synthesis of a series of coordination polymers based on mixed ligands to tune the structural dimension","CrystEngComm","2014","16","23","5093","","10.1039/c3ce42272k","","","0.71073","MoKα","","0.0597","0.0358","","","0.0572","0.0667","","","","","","1.04","","","","has coordinates","180486","2020-10-21","18:00:00",""
"7215510","31.684","0.004","10.0017","0.0012","13.3763","0.0017","90","","106.607","0.003","90","","4062.1","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14.5 H16 N6 O4.5 Pb S -","- C14.5 H16 N6 O4.5 Pb S -","- C116 H128 N48 O36 Pb8 S8 -","8","1","","Hashemi, Lida; Morsali, Ali","A new lead(ii) nanoporous three-dimensional coordination polymer: pore size effect on iodine adsorption affinity","CrystEngComm","2014","16","23","4955","","10.1039/c4ce00454j","","","0.71073","MoKα","","0.0524","0.0345","","","0.08","0.0885","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215654","11.3224","0.0003","14.6492","0.0004","18.371","0.0005","71","0.002","78.352","0.002","73.441","0.002","2741.51","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H41 Co Ge2 N9 S6 -","- C12 H41 Co Ge2 N9 S6 -","- C48 H164 Co4 Ge8 N36 S24 -","4","2","","Lichte, Jessica; Näther, Christian; Bensch, Wolfgang","Polymorphism and tautomerism in [dienH2][Co(dien)2][Ge2S6] leading to different hydrogen bonded networks","CrystEngComm","2014","16","25","5551","","10.1039/c4ce00312h","","","0.71073","MoKα","","0.0545","0.0388","","","0.0854","0.0908","","","","","","1.043","","","","has coordinates,has disorder","180487","2020-10-21","18:00:00",""
"7215655","7.2034","0.0005","9.2773","0.0006","11.4365","0.0008","74.107","0.005","73.402","0.005","71.293","0.005","679.62","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H41 Co Ge2 N9 S6 -","- C12 H41 Co Ge2 N9 S6 -","- C12 H41 Co Ge2 N9 S6 -","1","0.5","","Lichte, Jessica; Näther, Christian; Bensch, Wolfgang","Polymorphism and tautomerism in [dienH2][Co(dien)2][Ge2S6] leading to different hydrogen bonded networks","CrystEngComm","2014","16","25","5551","","10.1039/c4ce00312h","","","0.71073","MoKα","","0.0336","0.0295","","","0.0728","0.0744","","","","","","1.11","","","","has coordinates,has disorder","180487","2020-10-21","18:00:00",""
"7215656","15.211","0.0003","16.7025","0.0004","21.8821","0.0004","90","","90","","90","","5559.4","0.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H41 Co Ge2 N9 S6 -","- C12 H41 Co Ge2 N9 S6 -","- C96 H328 Co8 Ge16 N72 S48 -","8","1","","Lichte, Jessica; Näther, Christian; Bensch, Wolfgang","Polymorphism and tautomerism in [dienH2][Co(dien)2][Ge2S6] leading to different hydrogen bonded networks","CrystEngComm","2014","16","25","5551","","10.1039/c4ce00312h","","","0.71073","MoKα","","0.0613","0.0474","","","0.0792","0.0832","","","","","","1.142","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215657","14.7043","0.0003","9.0099","0.0002","21.454","0.0005","90","","90","","90","","2842.32","0.11","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C12 H41 Co Ge2 N9 S6 -","- C12 H41 Co Ge2 N9 S6 -","- C48 H164 Co4 Ge8 N36 S24 -","4","1","","Lichte, Jessica; Näther, Christian; Bensch, Wolfgang","Polymorphism and tautomerism in [dienH2][Co(dien)2][Ge2S6] leading to different hydrogen bonded networks","CrystEngComm","2014","16","25","5551","","10.1039/c4ce00312h","","","0.71073","MoKα","","0.0205","0.0199","","","0.0479","0.0482","","","","","","1.042","","","","has coordinates,has disorder","180487","2020-10-21","18:00:00",""
"7215658","27.144","0.005","6.5905","0.0013","10.766","0.002","90","","90","","90","","1926","0.6","153","2","153","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C17 H14 Cl F6 N4 P Pt -","- C17 H14 Cl F6 N4 P Pt -","- C68 H56 Cl4 F24 N16 P4 Pt4 -","4","0.5","","Zhang, Rui; Liang, Zhenning; Han, Ali; Wu, Haotian; Du, Pingwu; Lai, Wenzhen; Cao, Rui","Structural, spectroscopic and theoretical studies of a vapochromic platinum(ii) terpyridyl complex","CrystEngComm","2014","16","25","5531","","10.1039/c4ce00514g","","","0.71073","MoKα","","0.0502","0.0434","","","0.0978","0.1025","","","","","","1.064","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215659","20.0402","0.0006","20.0402","0.0006","41.6541","0.0013","90","","90","","120","","14487.5","0.8","150","2","150","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C9 H9 Cu N O5 S -","- C9 H9 Cu N O5 S -","- C324 H324 Cu36 N36 O180 S36 -","36","1","","Yang, Jie; Lutz, Martin; Grzech, Anna; Mulder, Fokko M.; Dingemans, Theo J.","Copper-based coordination polymers from thiophene and furan dicarboxylates with high isosteric heats of hydrogen adsorption","CrystEngComm","2014","16","23","5121","","10.1039/c4ce00145a","","","0.71073","MoKα","","0.0473","0.0367","","","0.1204","0.1281","","","","","","1.141","","","","has coordinates,has disorder","180487","2020-10-21","18:00:00",""
"7215660","18.9198","0.0011","18.8335","0.0014","12.6671","0.0008","90","","92.396","0.003","90","","4509.7","0.5","150","2","150","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C18 H12 Cu3 O18 -","- C18 H12 Cu3 O18 -","- C72 H48 Cu12 O72 -","4","0.5","","Yang, Jie; Lutz, Martin; Grzech, Anna; Mulder, Fokko M.; Dingemans, Theo J.","Copper-based coordination polymers from thiophene and furan dicarboxylates with high isosteric heats of hydrogen adsorption","CrystEngComm","2014","16","23","5121","","10.1039/c4ce00145a","","","0.71073","MoKα","","0.0354","0.032","","","0.0835","0.085","","","","","","1.04","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215661","21.4985","0.0013","24.7145","0.0014","24.8218","0.0014","110.166","0.004","112.898","0.003","102.544","0.002","10420.7","1.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C222 H166 Cu24 N10 O120 -","- C222 H166 Cu24 N10 O120 -","- C222 H166 Cu24 N10 O120 -","1","0.5","","Yang, Jie; Lutz, Martin; Grzech, Anna; Mulder, Fokko M.; Dingemans, Theo J.","Copper-based coordination polymers from thiophene and furan dicarboxylates with high isosteric heats of hydrogen adsorption","CrystEngComm","2014","16","23","5121","","10.1039/c4ce00145a","","","0.71073","MoKα","","0.0969","0.0712","","","0.222","0.2456","","","","","","1.057","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215662","11.945","0.0002","9.5273","0.0001","5.3438","0.0001","90","","90","","90","","608.144","0.017","298","2","298","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","Creatine form I","","","- C4 H9 N3 O2 -","- C4 H9 N3 O2 -","- C16 H36 N12 O8 -","4","1","","Arlin, Jean-Baptiste; Bhardwaj, Rajni M.; Johnston, Andrea; Miller, Gary J.; Bardin, Julie; MacDougall, Fiona; Fernandes, Philippe; Shankland, Kenneth; David, William I. F.; Florence, Alastair J.","Structure and stability of two polymorphs of creatine and its monohydrate","CrystEngComm","2014","16","35","8197","","10.1039/C4CE00508B","powder diffraction","","1.54056","","","","","","","","","","","2.099","","","","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215663","9.845","0.0003","5.8373","0.0002","11.6698","0.0003","90","","105.723","0.002","90","","645.55","0.03","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Creatine form II","","","- C4 H9 N3 O2 -","- C4 H9 N3 O2 -","- C16 H36 N12 O8 -","4","1","","Arlin, Jean-Baptiste; Bhardwaj, Rajni M.; Johnston, Andrea; Miller, Gary J.; Bardin, Julie; MacDougall, Fiona; Fernandes, Philippe; Shankland, Kenneth; David, William I. F.; Florence, Alastair J.","Structure and stability of two polymorphs of creatine and its monohydrate","CrystEngComm","2014","16","35","8197","","10.1039/C4CE00508B","powder diffraction","","1.54056","","","","","","","","","","","3.538","","","","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215664","17.4929","0.0014","4.7791","0.0004","10.1101","0.0008","90","","90","","90","","845.21","0.12","123","2","123","2","","","","","","","","4","P n a 21","P 2c -2n","33","Creatine formic acid solvate","","","- C5 H11 N3 O4 -","- C5 H11 N3 O4 -","- C20 H44 N12 O16 -","4","1","","Arlin, Jean-Baptiste; Bhardwaj, Rajni M.; Johnston, Andrea; Miller, Gary J.; Bardin, Julie; MacDougall, Fiona; Fernandes, Philippe; Shankland, Kenneth; David, William I. F.; Florence, Alastair J.","Structure and stability of two polymorphs of creatine and its monohydrate","CrystEngComm","2014","16","35","8197","","10.1039/C4CE00508B","","","0.71073","MoKα","","0.0595","0.0397","","","0.0831","0.0934","","","","","","1.013","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215667","7.2376","0.0006","8.981","0.0008","10.8011","0.0008","87.807","0.007","76.086","0.007","87.04","0.007","680.33","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","isonicotinamide - 3,5-dinitrobenzoic acid","4-Carbamoylpyridinium 3,5-dinitrobenzoate","","- C13 H10 N4 O7 -","- C13 H10 N4 O7 -","- C26 H20 N8 O14 -","2","1","","Seaton, Colin C.","Proton location in acid⋯pyridine hydrogen bonds of multi-component crystals","CrystEngComm","2014","16","26","5878","","10.1039/c4ce00043a","","","0.71073","MoKα","","0.0603","0.043","","","0.1102","0.1181","","","","","","0.974","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215668","7.0678","0.0004","8.8189","0.0005","16.2172","0.0009","93.761","0.005","90.458","0.005","95.498","0.005","1003.9","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","3,5-dinitrobenzoic acid isonicotinamide 3-aminobenzoic acid","","- C20 H17 N5 O9 -","- C20 H17 N5 O9 -","- C40 H34 N10 O18 -","2","1","","Seaton, Colin C.","Proton location in acid⋯pyridine hydrogen bonds of multi-component crystals","CrystEngComm","2014","16","26","5878","","10.1039/c4ce00043a","","","0.71073","MoKα","","0.0843","0.0376","","","0.0585","0.0634","","","","","","0.781","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215669","12.8093","0.0014","13.1563","0.0012","7.4708","0.0008","90","","90","","90","","1259","0.2","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","pyridinium-4-carboxamide 2,4,6-trihydroxybenzoate","","- C13 H12 N2 O6 -","- C13 H12 N2 O6 -","- C52 H48 N8 O24 -","4","1","","Seaton, Colin C.","Proton location in acid⋯pyridine hydrogen bonds of multi-component crystals","CrystEngComm","2014","16","26","5878","","10.1039/c4ce00043a","","","0.71073","MoKα","","0.0588","0.0352","","","0.0453","0.0482","","","","","","0.825","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215670","13.013","0.002","8.7755","0.0016","8.4187","0.0013","90","","103.902","0.005","90","","933.2","0.3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H15 La N10 O10 -","- C14 H15 La N10 O10 -","- C28 H30 La2 N20 O20 -","2","0.5","","Vilela, Sérgio M. F.; Ananias, Duarte; Silva, Patrícia; Nolasco, Mariela; Carlos, Luís D.; de Zea Bermudez, Verónica; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Coordination polymers based on a glycine-derivative ligand","CrystEngComm","2014","16","35","8119","","10.1039/C4CE00465E","","","0.71073","MoKα","","0.0766","0.0454","","","0.069","0.0766","","","","","","0.995","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215671","11.2216","0.0003","15.0063","0.0004","6.8432","0.0002","90","","90.245","0.002","90","","1152.35","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H10 Cl N5 O5 -","- C7 H10 Cl N5 O5 -","- C28 H40 Cl4 N20 O20 -","4","1","","Vilela, Sérgio M. F.; Ananias, Duarte; Silva, Patrícia; Nolasco, Mariela; Carlos, Luís D.; de Zea Bermudez, Verónica; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Coordination polymers based on a glycine-derivative ligand","CrystEngComm","2014","16","35","8119","","10.1039/C4CE00465E","","","0.71073","MoKα","","0.0657","0.0398","","","0.0943","0.1056","","","","","","1.015","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215672","7.2191","0.0005","24.9432","0.0019","7.4918","0.0005","90","","113.281","0.005","90","","1239.19","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H12 Cl N5 O4 -","- C9 H12 Cl N5 O4 -","- C36 H48 Cl4 N20 O16 -","4","1","","Vilela, Sérgio M. F.; Ananias, Duarte; Silva, Patrícia; Nolasco, Mariela; Carlos, Luís D.; de Zea Bermudez, Verónica; Rocha, João; Tomé, João P. C.; Almeida Paz, Filipe A.","Coordination polymers based on a glycine-derivative ligand","CrystEngComm","2014","16","35","8119","","10.1039/C4CE00465E","","","0.71073","MoKα","","0.0835","0.0476","","","0.1101","0.1275","","","","","","1.027","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215673","25.5089","0.0009","25.5089","0.0009","34.3318","0.0017","90","","90","","120","","19346.9","1.4","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C104 H458 Cl29 Dy25 Ni2 O364 -","- C96 H158 Cl5 Dy25 Ni2 O184 -","- C192 H316 Cl10 Dy50 Ni4 O368 -","2","0.166667","","Liu, Da-Peng; Peng, Jun-Bo; Lin, Xin-Ping; Huang, Que; Kong, Xiang-Jian; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Myo-inositol supported heterometallic Dy24M2 (M = Ni, Mn) cages","CrystEngComm","2014","16","25","5527","","10.1039/c4ce00362d","","","0.71073","MoKα","","0.1879","0.0893","","","0.1902","0.2274","","","","","","0.853","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215674","25.525","0.0011","25.525","0.0011","34.3906","0.0014","90","","90","","120","","19404.5","1.4","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C104 H458 Cl29 Dy25 Mn2 O364 -","- C96 H158 Cl5 Dy25 Mn2 O184 -","- C192 H316 Cl10 Dy50 Mn4 O368 -","2","0.166667","","Liu, Da-Peng; Peng, Jun-Bo; Lin, Xin-Ping; Huang, Que; Kong, Xiang-Jian; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Myo-inositol supported heterometallic Dy24M2 (M = Ni, Mn) cages","CrystEngComm","2014","16","25","5527","","10.1039/c4ce00362d","","","0.71073","MoKα","","0.2094","0.0877","","","0.1767","0.2193","","","","","","0.82","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215675","10.015","0.0006","9.668","0.0006","26.365","0.0016","90","","97.999","0.005","90","","2528","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C60 H48 N18 -","- C60 H48 N18 -","- C120 H96 N36 -","2","0.5","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.1345","0.0743","","","0.1935","0.241","","","","","","1.002","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215676","11.653","0.0006","12.157","0.0007","13.87","0.0008","67.552","0.005","89.98","0.006","69.718","0.005","1683.55","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 Ag2 N10 O6 -","- C34 H26 Ag2 N10 O6 -","- C68 H52 Ag4 N20 O12 -","2","1","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.0638","0.0486","","","0.1333","0.1468","","","","","","1.031","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215677","20.657","0.0008","14.236","0.0006","23.358","0.0009","90","","103.847","0.004","90","","6669.3","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C69 H56 Ag4 N20 O14 -","- C69 H51 Ag4 N20 O14 -","- C276 H204 Ag16 N80 O56 -","4","0.5","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.0977","0.0571","","","0.1478","0.1736","","","","","","1.01","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215678","10.986","0.0004","12.307","0.0005","13.891","0.0006","82.446","0.004","68.707","0.004","71.97","0.003","1663.6","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H26 Ag3 N10 O7 -","- C34 H26 Ag3 N10 O7 -","- C68 H52 Ag6 N20 O14 -","2","1","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.0621","0.0435","","","0.092","0.1032","","","","","","1.02","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215679","13.04","0.0008","13.95","0.0011","22.54","0.0015","107.566","0.007","96.682","0.005","96.412","0.006","3835.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H58 Ag6 N22 O16 -","- C74 H54 Ag6 N22 O16 -","- C148 H108 Ag12 N44 O32 -","2","1","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.1821","0.0841","","","0.1783","0.2334","","","","","","0.988","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215680","12.675","0.0005","14.312","0.0007","15.22","0.0007","106.736","0.004","99.655","0.004","115.188","0.004","2254.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H34 Ag5 N10 O12 -","- C46 H29 Ag5 N10 O12 -","- C92 H58 Ag10 N20 O24 -","2","1","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71073","MoKα","","0.0796","0.0498","","","0.1068","0.1245","","","","","","1.015","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215681","11.486","0.0006","12.951","0.0008","13.976","0.0006","85.015","0.004","79.768","0.004","65.61","0.005","1863.14","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H32 Ag2 N9 O8 -","- C42 H32 Ag2 N9 O8 -","- C84 H64 Ag4 N18 O16 -","2","1","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.1017","0.0612","","","0.1375","0.163","","","","","","1.021","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215682","10.325","0.0007","14.158","0.001","14.916","0.001","68.417","0.007","71.336","0.007","81.65","0.006","1920","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H62 Ag6 N18 O18 -","- C88 H61 Ag6 N18 O18 -","- C88 H61 Ag6 N18 O18 -","1","0.5","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.0814","0.0512","","","0.103","0.1197","","","","","","1.067","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215683","11.927","0.0007","13.94","0.0007","14.06","0.0009","71.773","0.005","79.535","0.005","74.679","0.005","2128.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H33 Ag3 N9 O10 -","- C46 H31 Ag3 N9 O10 -","- C92 H62 Ag6 N18 O20 -","2","1","","Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang","Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties","CrystEngComm","2014","16","23","5110","","10.1039/c4ce00236a","","","0.71069","MoKα","","0.1174","0.0646","","","0.1405","0.176","","","","","","1.023","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215688","29.127","0.003","6.885","0.0002","18.849","0.0008","90","","114.089","0.006","90","","3450.8","0.4","100","2","100","2","","","","","","","see text","5","C 1 2 1","C 2y","5","Levofloxacin hemihydrate","","","- C36 H42 F2 N6 O9 -","- C36 H42 F2 N6 O9 -","- C144 H168 F8 N24 O36 -","4","1","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71073","MoKα","","0.1176","0.0624","","","0.1404","0.1636","","","","","","1.021","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215689","6.745","0.005","13.836","0.009","18.393","0.012","90","","95.38","0.011","90","","1709","2","100","2","100","2","","","","","","","see text","5","P 1 21 1","P 2yb","4","Levofloxacin Monohydrate","","","- C18 H22 F N3 O5 -","- C18 H22 F N3 O5 -","- C72 H88 F4 N12 O20 -","4","2","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71075","MoKα","","0.0768","0.061","","","0.1431","0.151","","","","","","1.069","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215690","17.856","0.003","6.989","0.001","36.502","0.007","90","","99.282","0.006","90","","4495.6","1.3","293","2","293","2","","","","","","","see text","5","C 1 2 1","C 2y","5","Levofloxacin Malonic Acid Hydrate","","","- C21 H21 F N3 O9 -","- C21 H21 F N3 O9 -","- C168 H168 F8 N24 O72 -","8","2","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71075","MoKα","","0.1829","0.0963","","","0.2613","0.3253","","","","","","1.032","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215691","6.83","0.004","34.84","0.02","9.908","0.006","90","","105.713","0.012","90","","2270","2","293","2","293","2","","","","","","","see text","5","P 1 21 1","P 2yb","4","Levofloxacin Maleic acid salt","","","- C22 H20 F N3 O8 -","- C22 H20 F N3 O8 -","- C88 H80 F4 N12 O32 -","4","2","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71073","MoKα","","0.1829","0.0869","","","0.1726","0.2264","","","","","","1.025","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215692","18.103","0.0012","6.741","0.0004","23.923","0.0017","90","","93.8","0.007","90","","2913","0.3","293","2","293","2","","","","","","","see text","5","C 1 2 1","C 2y","5","Levofloxacin Tetramethylene glutaric acid salt","","","- C27 H29 F N3 O8 -","- C27 H29 F N3 O8 -","- C108 H116 F4 N12 O32 -","4","1","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71073","MoKα","","0.1699","0.0887","","","0.2253","0.2615","","","","","","0.996","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215693","9.984","0.002","17.199","0.003","19.058","0.004","67.254","0.008","86.503","0.012","77.145","0.011","2941.2","1","100","2","100","2","","","","","","","see text","5","P 1","P 1","1","","","","- C114 H126 F6 N18 O47 -","- C114 H126 F6 N18 O47 -","- C114 H126 F6 N18 O47 -","1","1","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71073","MoKα","","0.0544","0.0458","","","0.1102","0.1161","","","","","","1.013","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215694","17.06","0.02","6.916","0.007","19.12","0.02","90","","110.106","0.017","90","","2118","4","293","2","293","2","","","","","","","see text","5","C 1 2 1","C 2y","5","","","","- C20 H21 F N3 O8 -","- C20 H21 F N3 O8 -","- C80 H84 F4 N12 O32 -","4","1","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71073","MoKα","","0.1369","0.0834","","","0.2168","0.2733","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215695","9.135","0.002","12.008","0.003","16.533","0.005","79.91","0.013","78.135","0.014","73.833","0.013","1691.1","0.8","100","","100","2","","","","","","","see text","5","P 1","P 1","1","Levofloxacin 3,5-dinitrobenzoate 1:2","","","- C32 H28 F N7 O16 -","- C32 H28 F N7 O16 -","- C64 H56 F2 N14 O32 -","2","2","","Singh, Shiv Shankar; Thakur, Tejender S.","New crystalline salt forms of levofloxacin: conformational analysis and attempts towards the crystal structure prediction of the anhydrous form","CrystEngComm","2014","16","20","4215","","10.1039/c4ce00263f","","x-ray","0.71075","MoKα","","0.0438","0.0353","","","0.0824","0.0888","","","","","","1.01","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215696","9.9165","0.0006","13.0528","0.0007","10.9693","0.0007","90","","101.633","0.006","90","","1390.68","0.15","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H10 Mn N2 O5 -","- C12 H8 Mn N2 O5 -","- C48 H32 Mn4 N8 O20 -","4","2","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Syntheses of two coordination polymers with rutile-type topology and the single-crystal-to-single-crystal transformation of Mg(ii) complex induced by methanol","CrystEngComm","2014","16","20","4210","","10.1039/c3ce42660b","","","0.71073","MoKα","","0.138","0.0725","","","0.1713","0.2182","","","","","","1.04","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215697","9.846","0.0012","12.8415","0.0013","10.9975","0.0013","90","","99.39","0.012","90","","1371.9","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H10 Mg N2 O5 -","- C12 H8 Mg N2 O5 -","- C48 H32 Mg4 N8 O20 -","4","2","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Syntheses of two coordination polymers with rutile-type topology and the single-crystal-to-single-crystal transformation of Mg(ii) complex induced by methanol","CrystEngComm","2014","16","20","4210","","10.1039/c3ce42660b","","","0.71073","MoKα","","0.0927","0.066","","","0.1697","0.1923","","","","","","1.054","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215698","7.699","0.003","7.897","0.003","9.378","0.003","84.34","0.03","72.67","0.03","64.01","0.04","488.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H24 Mg N2 O8 -","- C16 H24 Mg N2 O8 -","- C16 H24 Mg N2 O8 -","1","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Syntheses of two coordination polymers with rutile-type topology and the single-crystal-to-single-crystal transformation of Mg(ii) complex induced by methanol","CrystEngComm","2014","16","20","4210","","10.1039/c3ce42660b","","","0.71073","MoKα","","0.0986","0.0649","","","0.1756","0.2124","","","","","","1.037","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215699","5.1633","0.0011","9.5569","0.0019","12.229","0.003","87.326","0.003","83.816","0.003","76.459","0.003","583.1","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H12 N10 O3 -","- C6 H12 N10 O3 -","- C12 H24 N20 O6 -","2","1","","Su, Zhiyong; Liu, Xiangyu; Yang, Qi; Zhang, Sheng; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli","Intermolecular interaction influenced energy and sensitivity of highly energetic salts: structure and physicochemical properties","CrystEngComm","2014","16","20","4245","","10.1039/c4ce00259h","","","0.71073","MoKα","","0.0839","0.0667","","","0.2099","0.2373","","","","","","1.016","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215700","3.6377","0.001","11.723","0.003","12.387","0.003","90","","97.696","0.005","90","","523.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H8 N10 O4 -","- C4 H8 N10 O4 -","- C8 H16 N20 O8 -","2","0.5","","Su, Zhiyong; Liu, Xiangyu; Yang, Qi; Zhang, Sheng; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli","Intermolecular interaction influenced energy and sensitivity of highly energetic salts: structure and physicochemical properties","CrystEngComm","2014","16","20","4245","","10.1039/c4ce00259h","","","0.71073","MoKα","","0.0902","0.0529","","","0.1315","0.1819","","","","","","1.04","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215701","13.559","0.003","8.9163","0.0017","6.7232","0.0013","90","","93.051","0.004","90","","811.7","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H7 N7 O6 -","- C2 H7 N7 O6 -","- C8 H28 N28 O24 -","4","1","","Su, Zhiyong; Liu, Xiangyu; Yang, Qi; Zhang, Sheng; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli","Intermolecular interaction influenced energy and sensitivity of highly energetic salts: structure and physicochemical properties","CrystEngComm","2014","16","20","4245","","10.1039/c4ce00259h","","","0.71073","MoKα","","0.0674","0.043","","","0.097","0.1099","","","","","","1.007","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215702","7.1272","0.0012","12.249","0.002","12.943","0.002","71.973","0.002","89.308","0.002","89.483","0.002","1074.4","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Acetone Solvate (2)","","","- C38 H48 Ag2 B2 F8 N8 O2 -","- C38 H48 Ag2 B2 F8 N8 O2 -","- C38 H48 Ag2 B2 F8 N8 O2 -","1","0.5","","du Plessis, Marike; Smith, Vincent J.; Barbour, Leonard J.","Single-crystal to single-crystal guest exchange and phase transformations in a porous metallocycle","CrystEngComm","2014","16","20","4126","","10.1039/c4ce00244j","","","0.71073","MoKα","","0.0322","0.031","","","0.0753","0.0759","","","","","","1.174","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215703","7.091","0.0019","20.479","0.006","14.855","0.005","90","","91.038","0.004","90","","2156.8","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Chloroform Solvate (3)","","","- C34 H38 Ag2 B2 Cl6 F8 N8 -","- C34 H38 Ag2 B2 Cl6 F8 N8 -","- C68 H76 Ag4 B4 Cl12 F16 N16 -","2","0.5","","du Plessis, Marike; Smith, Vincent J.; Barbour, Leonard J.","Single-crystal to single-crystal guest exchange and phase transformations in a porous metallocycle","CrystEngComm","2014","16","20","4126","","10.1039/c4ce00244j","","","0.71073","MoKα","","0.0807","0.0573","","","0.1403","0.1515","","","","","","1.061","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215704","7.102","0.0018","12.388","0.003","12.794","0.003","72.237","0.004","89.284","0.004","89.239","0.004","1071.8","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Benzene Solvate","","","- C38 H42 Ag2 B2 F8 N8 -","- C37.994 H41.994 Ag2 B2 F8 N8 -","- C37.994 H41.994 Ag2 B2 F8 N8 -","1","0.5","","du Plessis, Marike; Smith, Vincent J.; Barbour, Leonard J.","Single-crystal to single-crystal guest exchange and phase transformations in a porous metallocycle","CrystEngComm","2014","16","20","4126","","10.1039/c4ce00244j","","","0.71073","MoKα","","0.051","0.0372","","","0.0868","0.0937","","","","","","1.005","","","","has coordinates,has disorder","288505","2023-12-22","15:12:04",""
"7215705","7.0814","0.0011","12.445","0.002","12.837","0.002","71.505","0.002","89.185","0.002","89.43","0.002","1072.7","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Difluorobenzene Solvate","","","- C38 H40 Ag2 B2 F10 N8 -","- C38 H40 Ag2 B2 F10 N8 -","- C38 H40 Ag2 B2 F10 N8 -","1","0.5","","du Plessis, Marike; Smith, Vincent J.; Barbour, Leonard J.","Single-crystal to single-crystal guest exchange and phase transformations in a porous metallocycle","CrystEngComm","2014","16","20","4126","","10.1039/c4ce00244j","","","0.71073","MoKα","","0.051","0.0459","","","0.1125","0.1148","","","","","","1.153","","","","has coordinates,has disorder","288505","2023-12-22","15:12:04",""
"7215706","6.9746","0.001","12.0647","0.0017","13.1454","0.0018","72.422","0.002","87.762","0.002","86.363","0.002","1052.1","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Toluene Solvate (6)","","","- C39 H43 Ag2 B2 F8 N8 -","- C39 H43 Ag2 B2 F8 N8 -","- C39 H43 Ag2 B2 F8 N8 -","1","0.5","","du Plessis, Marike; Smith, Vincent J.; Barbour, Leonard J.","Single-crystal to single-crystal guest exchange and phase transformations in a porous metallocycle","CrystEngComm","2014","16","20","4126","","10.1039/c4ce00244j","","","0.71073","MoKα","","0.0552","0.0412","","","0.0911","0.0962","","","","","","1.026","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215707","5.6482","0.0011","15.05","0.003","8.6769","0.0017","90","","93.73","0.03","90","","736","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N4 O2 -","- C18 H14 N4 O2 -","- C36 H28 N8 O4 -","2","0.5","","Cheng, Nongyi; Yan, Qifan; Liu, Shuai; Zhao, Dahui","Probing the intermolecular interactions of aromatic amides containing N-heterocycles and triptycene","CrystEngComm","2014","16","20","4265","","10.1039/c4ce00089g","","","0.71073","MoKα","","0.0664","0.0614","","","0.1283","0.1313","","","","","","1.191","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215708","18.047","0.004","5.2394","0.001","7.8799","0.0016","90","","94.25","0.03","90","","743","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C40 H32 N4 O4 -","2","0.5","","Cheng, Nongyi; Yan, Qifan; Liu, Shuai; Zhao, Dahui","Probing the intermolecular interactions of aromatic amides containing N-heterocycles and triptycene","CrystEngComm","2014","16","20","4265","","10.1039/c4ce00089g","","","1.54187","CuKα","","0.1104","0.0931","","","0.1685","0.1756","","","","","","1.199","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215709","48.195","0.01","13.492","0.003","19.716","0.004","90","","112.39","0.03","90","","11854","5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H24 N2 O2 -","- C34 H24 N2 O2 -","- C544 H384 N32 O32 -","16","2","","Cheng, Nongyi; Yan, Qifan; Liu, Shuai; Zhao, Dahui","Probing the intermolecular interactions of aromatic amides containing N-heterocycles and triptycene","CrystEngComm","2014","16","20","4265","","10.1039/c4ce00089g","","","0.71073","MoKα","","0.1407","0.1002","","","0.2549","0.2724","","","","","","1.374","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215710","4.813","0.003","9.377","0.005","15.91","0.009","90","","90.696","0.009","90","","718","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N4 O2 -","- C18 H14 N4 O2 -","- C36 H28 N8 O4 -","2","0.5","","Cheng, Nongyi; Yan, Qifan; Liu, Shuai; Zhao, Dahui","Probing the intermolecular interactions of aromatic amides containing N-heterocycles and triptycene","CrystEngComm","2014","16","20","4265","","10.1039/c4ce00089g","","","0.71073","MoKα","","0.0744","0.0623","","","0.1107","0.1163","","","","","","1.17","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215711","5.4114","0.0011","20.902","0.004","6.7857","0.0014","90","","107.29","0.03","90","","732.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H15 N3 O2 -","- C19 H15 N3 O2 -","- C38 H30 N6 O4 -","2","0.5","","Cheng, Nongyi; Yan, Qifan; Liu, Shuai; Zhao, Dahui","Probing the intermolecular interactions of aromatic amides containing N-heterocycles and triptycene","CrystEngComm","2014","16","20","4265","","10.1039/c4ce00089g","","","0.71073","MoKα","","0.0795","0.0686","","","0.119","0.1244","","","","","","1.208","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215712","5.307","0.0011","21.226","0.004","6.883","0.0014","90","","107.01","0.03","90","","741.4","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C40 H32 N4 O4 -","2","0.5","","Cheng, Nongyi; Yan, Qifan; Liu, Shuai; Zhao, Dahui","Probing the intermolecular interactions of aromatic amides containing N-heterocycles and triptycene","CrystEngComm","2014","16","20","4265","","10.1039/c4ce00089g","","","0.71073","MoKα","","0.0751","0.064","","","0.1308","0.1369","","","","","","1.152","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215713","31.3858","0.0014","24.8618","0.0013","13.1852","0.0007","90","","112.774","0.005","90","","9486.4","0.9","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C124.5 H122.5 Co9 N23.5 O47.5 -","- C108 H72 Co9 N18 O42 -","- C216 H144 Co18 N36 O84 -","2","0.25","","Kang, Yao; Wang, Fei","A highly-connected metal‒organic framework based on [Co2(μ2-OH2)] units and mononuclear Co centers with high gas uptake capacity","CrystEngComm","2014","16","20","4088","","10.1039/c3ce42361a","","","0.71073","MoKα","","0.0894","0.0639","","","0.1787","0.1941","","","","","","0.955","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215714","29.958","0.004","29.958","0.004","15.57","0.003","90","","90","","120","","12102","3","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C32 H40 N12 O16 Pb2 -","- C32 H40 N12 O16 Pb2 -","- C288 H360 N108 O144 Pb18 -","9","0.5","","Guo, Chun-Li; Li, Xiao-Zeng; Zhang, Xing-Mei; Wang, Lu; Zhu, Li-Na","A novel porous metal‒organic framework from a new bis(acylhydrazone) ligand capable of reversibly adsorbing/desorbing water and small alcohol molecules","CrystEngComm","2014","16","20","4095","","10.1039/c4ce00140k","","","0.71073","MoKα","","0.0671","0.0571","","","0.1431","0.1503","","","","","","1.14","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215715","27.13","0.005","11.761","0.002","43.999","0.013","90","","128.01","0.02","90","","11061","5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C124 H84 Cu2 La2 N10 O28 -","- C124 H84 Cu2 La2 N10 O28 -","- C496 H336 Cu8 La8 N40 O112 -","4","1","","Fang, Wei-Hui; Yang, Guo-Yu","Heterometal‒organic framework with pcu net constructed from mixed linear ligands","CrystEngComm","2014","16","20","4091","","10.1039/c4ce00282b","","","0.71073","MoKα","","0.106","0.0879","","","0.2419","0.2648","","","","","","1.028","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215716","6.785","0.005","7.594","0.006","10.591","0.008","70.714","0.015","77.107","0.014","88.869","0.014","501.2","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H6 Cu N4 O4 -","- C8 H6 Cu N4 O4 -","- C16 H12 Cu2 N8 O8 -","2","1","","Yang, Lan; Zhang, Sheng; Liu, Xiangyu; Yang, Qi; Wei, Qing; Xie, Gang; Chen, Sanping","Effect of phenylacetic acid coligands on the structures and magnetic properties of azido-bridged copper(ii)-chain compounds","CrystEngComm","2014","16","20","4194","","10.1039/c3ce42532k","","","0.71073","MoKα","","0.1716","0.0858","","","0.1803","0.236","","","","","","1.049","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215717","17.787","0.003","6.6764","0.0013","8.4841","0.0016","90","","102.003","0.003","90","","985.5","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H9 Cu N3 O2 -","- C9 H9 Cu N3 O2 -","- C36 H36 Cu4 N12 O8 -","4","1","","Yang, Lan; Zhang, Sheng; Liu, Xiangyu; Yang, Qi; Wei, Qing; Xie, Gang; Chen, Sanping","Effect of phenylacetic acid coligands on the structures and magnetic properties of azido-bridged copper(ii)-chain compounds","CrystEngComm","2014","16","20","4194","","10.1039/c3ce42532k","","","0.71073","MoKα","","0.0907","0.0508","","","0.121","0.1628","","","","","","1.003","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215718","13.5498","0.0016","6.5985","0.0008","13.6226","0.0016","90","","116.118","0.002","90","","1093.6","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 Cu N4 O5 -","- C8 H8 Cu N4 O5 -","- C32 H32 Cu4 N16 O20 -","4","1","","Yang, Lan; Zhang, Sheng; Liu, Xiangyu; Yang, Qi; Wei, Qing; Xie, Gang; Chen, Sanping","Effect of phenylacetic acid coligands on the structures and magnetic properties of azido-bridged copper(ii)-chain compounds","CrystEngComm","2014","16","20","4194","","10.1039/c3ce42532k","","","0.71073","MoKα","","0.0439","0.0331","","","0.0795","0.0855","","","","","","1.075","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215719","6.8518","0.0004","11.3764","0.0006","17.4137","0.0008","90","","90","","90","","1357.38","0.12","110","2","110","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-methoxy-6-(naphthalene-2-yliminomethyl)-phenol","2-methoxy-6-(naphthalene-2-yliminomethyl)-phenol","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C72 H60 N4 O8 -","4","1","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.0328","0.0288","","","0.0732","0.0743","","","","","","1.083","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215720","7.0652","0.0004","11.3687","0.0006","17.5723","0.0008","90","","90","","90","","1411.44","0.13","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2-methoxy-6-(naphthalene-2-yliminomethyl)-phenol","2-methoxy-6-(naphthalene-2-yliminomethyl)-phenol","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C72 H60 N4 O8 -","4","1","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.0592","0.0315","","","0.067","0.0717","","","","","","0.854","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215721","12.2742","0.0003","15.2924","0.0004","16.6009","0.0005","69.246","0.003","80.702","0.002","70.336","0.002","2740.72","0.14","110","2","110","2","","","","","","","","4","P -1","-P 1","2","2-Methoxy-6-(Naphthalene-1-yliminomethyl)-phenol","2-Methoxy-6-(Naphthalene-1-yliminomethyl)-phenol","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C144 H120 N8 O16 -","8","4","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.08","0.0387","","","0.0792","0.086","","","","","","0.826","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215722","12.3034","0.0004","15.406","0.0005","16.9536","0.0004","69.62","0.002","80.598","0.002","70.17","0.003","2829.99","0.16","298","2","298","2","","","","","","","","4","P -1","-P 1","2","2-methoxy-6-(naphthalene-1-yliminomethyl)-phenol","2-methoxy-6-(naphthalene-1-yliminomethyl)-phenol","","- C18 H15 N O2 -","- C18 H15 N O2 -","- C144 H120 N8 O16 -","8","4","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","1.54184","CuKα","","0.0489","0.0441","","","0.1218","0.1284","","","","","","1.039","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215723","11.9796","0.0004","9.9836","0.0004","10.9926","0.0004","90","","103.664","0.004","90","","1277.5","0.08","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(naphthalen-1-yliminomethyl)-benzene-1,4-diol","2-(naphthalen-1-yliminomethyl)-benzene-1,4-diol","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.0395","0.0347","","","0.0935","0.0958","","","","","","1.071","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215724","11.9699","0.0006","10.1432","0.0007","11.0736","0.0007","90","","103.312","0.005","90","","1308.35","0.14","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(naphthalen-1-yliminomethyl)-benzene-1,4-diol","2-(naphthalen-1-yliminomethyl)-benzene-1,4-diol","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.0485","0.038","","","0.1104","0.1153","","","","","","1.091","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215725","11.6407","0.0008","12.0666","0.0009","12.0964","0.0008","90","","91.535","0.007","90","","1698.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(benzhydrylimino-methyl)-6-methoxy-phenol","2-(benzhydrylimino-methyl)-6-methoxy-phenol","","- C21 H19 N O2 -","- C21 H19 N O2 -","- C84 H76 N4 O8 -","4","1","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.0716","0.0531","","","0.1191","0.1312","","","","","","1.045","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215726","11.756","0.002","12.176","0.002","12.2037","0.0019","90","","91.224","0.015","90","","1746.5","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(benzhydrylimino-methyl)-6-methoxy-phenol","2-(benzhydrylimino-methyl)-6-methoxy-phenol","","- C21 H19 N O2 -","- C21 H19 N O2 -","- C84 H76 N4 O8 -","4","1","","Zbačnik, M.; Kaitner, B.","Ex situ and in situ monitoring of the syntheses of thermochromic Schiff bases","CrystEngComm","2014","16","20","4162","","10.1039/c3ce42583e","","x-ray","0.71073","MoKα","","0.2084","0.0345","","","0.0491","0.0651","","","","","","0.605","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7215727","12.678","0.012","12.682","0.012","15.44","0.014","90","","96.706","0.01","90","","2465","4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- B20 H22 K8 O57 V6 -","- B20 K8 O57 V6 -","- B40 K16 O114 V12 -","2","0.5","","An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui","A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units","CrystEngComm","2014","16","20","4236","","10.1039/c4ce00073k","","","0.71073","MoKα","","0.0408","0.0393","","","0.1162","0.1172","","","","","","1.094","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215728","19.49","0.02","19.16","0.02","20.09","0.02","90","","91.785","0.012","90","","7499","13","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H68 B18 K6 N6 O76 V12 -","- C8 B18 K6 N6 O76 V12 -","- C32 B72 K24 N24 O304 V48 -","4","0.5","","An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui","A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units","CrystEngComm","2014","16","20","4236","","10.1039/c4ce00073k","","","0.71073","MoKα","","0.0559","0.0482","","","0.1275","0.133","","","","","","1.181","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215729","22.3371","0.001","12.5753","0.0006","22.3967","0.0011","90","","116.864","0.001","90","","5612.2","0.5","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H58 B20 K2 N6 O59 V6 -","- C8 H32 B20 K2 N6 O59 V6 -","- C32 H128 B80 K8 N24 O236 V24 -","4","0.5","","An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui","A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units","CrystEngComm","2014","16","20","4236","","10.1039/c4ce00073k","","","0.71073","MoKα","","0.0654","0.0632","","","0.1626","0.1645","","","","","","1.057","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215730","18.212","0.002","19.276","0.002","19.306","0.002","90","","90","","90","","6777.5","1.2","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- B18 H36 K10 O75 V12 -","- B18 K10 O75 V12 -","- B72 K40 O300 V48 -","4","0.5","","An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui","A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units","CrystEngComm","2014","16","20","4236","","10.1039/c4ce00073k","","","0.71073","MoKα","","0.0696","0.0621","","","0.194","0.2029","","","","","","1.197","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7215731","11.901","0.012","13.365","0.014","13.987","0.014","117.07","0.011","96.342","0.012","107.344","0.013","1810","3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- B18 H46 K10 O80 V12 -","- B18 K10 O80 V12 -","- B18 K10 O80 V12 -","1","0.5","","An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui","A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units","CrystEngComm","2014","16","20","4236","","10.1039/c4ce00073k","","","0.71073","MoKα","","0.0753","0.0669","","","0.1924","0.2009","","","","","","1.048","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215732","8.1577","0.0006","10.1407","0.0008","18.2913","0.0014","95.207","0.001","94.88","0.001","98.663","0.001","1482.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 F4 N2 O4 -","- C14 H10 F4 N2 O4 -","- C56 H40 F16 N8 O16 -","4","2","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.077","0.0568","","","0.167","0.1823","","","","","","1.07","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215733","7.825","0.0004","9.0424","0.0004","11.634","0.0004","92.81","0.003","105.233","0.004","115.272","0.005","705.88","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 F4 N2 O4 -","- C14 H10 F4 N2 O4 -","- C28 H20 F8 N4 O8 -","2","1","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.0959","0.0637","","","0.1626","0.1871","","","","","","1.034","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215734","4.886","0.0012","11.475","0.003","17.771","0.004","90","","90.01","0.01","90","","996.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 F4 N10 O4 -","- C16 H16 F4 N10 O4 -","- C32 H32 F8 N20 O8 -","2","0.5","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.053","0.044","","","0.1384","0.1446","","","","","","1.083","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215735","7.657","0.0004","10.0492","0.0008","11.3387","0.0004","89.108","0.004","86.461","0.003","83.07","0.005","864.42","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H22 F8 N10 O8 -","- C34 H22 F8 N10 O8 -","- C34 H22 F8 N10 O8 -","1","0.5","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.068","0.0472","","","0.1202","0.1367","","","","","","1.042","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215736","28.889","0.002","9.7001","0.0008","19.7288","0.0016","90","","129.198","0.001","90","","4284.4","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H30 F12 N6 O12 -","- C48 H29 F12 N6 O12 -","- C192 H116 F48 N24 O48 -","4","0.5","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.1089","0.0626","","","0.1658","0.1912","","","","","","0.909","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215737","7.3027","0.0006","9.6227","0.0007","9.7417","0.0007","94.022","0.006","109.536","0.007","90.479","0.006","643.2","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H9 F4 N2 O4 -","- C13 H9 F4 N2 O4 -","- C26 H18 F8 N4 O8 -","2","1","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.0635","0.0448","","","0.1011","0.1181","","","","","","1.054","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215738","6.1044","0.0004","12.0203","0.0006","20.6007","0.0013","90","","97.195","0.005","90","","1499.71","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 F4 N3 O6 -","- C13 H11 F4 N3 O6 -","- C52 H44 F16 N12 O24 -","4","1","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.1075","0.053","","","0.086","0.1035","","","","","","0.999","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215739","9.0755","0.0004","36.884","0.002","9.7005","0.0003","90","","93.508","0.003","90","","3241.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 F8 N4 O9 -","- C32 H24 F8 N4 O9 -","- C128 H96 F32 N16 O36 -","4","1","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.0932","0.0548","","","0.111","0.1276","","","","","","1.024","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215740","7.1153","0.0005","8.4148","0.0006","14.4196","0.0013","99.895","0.001","97.073","0.002","111.878","0.001","772.54","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H22 F8 N4 O8 -","- C32 H20 F8 N4 O8 -","- C32 H20 F8 N4 O8 -","1","0.5","","Wang, Lei; Hu, Yanjing; Wang, Wenqiang; Liu, Faqian; Huang, Keke","Energetic multi-component molecular solids of tetrafluoroterephthalic acid with some aza compounds by strong hydrogen bonds and weak intermolecular interactions of C‒H⋯F and C‒H⋯O","CrystEngComm","2014","16","20","4142","","10.1039/c4ce00133h","","","0.71073","MoKα","","0.0644","0.0531","","","0.1488","0.1597","","","","","","1.083","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215741","13.982","0.003","6.4735","0.0015","15.002","0.004","90","","100.43","0.003","90","","1335.4","0.6","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-({((1S,2R,5S)-6,6-Dimethylbicyclo[3.1.1]hept-2-yl)methyl}sulfonyl)ethanol","","- C12 H22 O3 S -","- C12 H22 O3 S -","- C48 H88 O12 S4 -","4","2","","Lodochnikova, Olga A.; Startseva, Valeriya A.; Nikitina, Liliya E.; Bodrov, Andrei V.; Klimovitskii, Alexander E.; Klimovitskii, Evgenii N.; Litvinov, Igor A.","When two symmetrically independent molecules must be different: “Crystallization-induced diastereomerization” of chiral pinanyl sulfone","CrystEngComm","2014","16","20","4314","","10.1039/c3ce42642d","","x-ray","0.71073","MoKα","","0.131","0.0601","","","0.1446","0.1743","","","","","","0.975","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215742","6.7596","0.0002","31.6474","0.0008","7.9922","0.0003","90","","108.548","0.003","90","","1620.91","0.09","110","0.1","110","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C7 H F4 I O2 -","- C7 H F4 I O2 -","- C56 H8 F32 I8 O16 -","8","4","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.035918","0.034122","","","0.0808","0.084841","","","","","","1.04612","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215743","6.2546","0.0004","7.8761","0.0004","11.5781","0.0006","78.743","0.005","75.347","0.005","83.455","0.005","539.94","0.05","110","0.1","110","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C9 H5 F4 I O2 S -","- C9 H5 F4 I O2 S -","- C18 H10 F8 I2 O4 S2 -","2","1","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.0383","0.0346","","","0.1","0.1025","","","","","","1.097","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215744","5.7209","0.0007","10.3273","0.0013","14.4539","0.0017","107.044","0.011","99.741","0.01","92.149","0.01","801.24","0.18","110","0.1","110","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C26 H29 F8 I2 N3 O4 S3 -","- C26 H29 F8 I2 N3 O4 S3 -","- C26 H29 F8 I2 N3 O4 S3 -","1","0.5","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.0695","0.0494","","","0.1024","0.1123","","","","","","1.066","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215745","6.295","0.0003","6.3948","0.0005","8.09","0.003","90","","104.161","0.013","90","","315.77","0.12","110","0.1","110","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H8 O2 S2 -","- C4 H8 O2 S2 -","- C8 H16 O4 S4 -","2","0.5","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.0337","0.0292","","","0.0759","0.0827","","","","","","1.139","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215746","5.89886","0.00016","21.0112","0.0005","16.1143","0.0004","90","","95.557","0.003","90","","1987.85","0.09","110.05","0.1","110.05","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 Br2 F8 O4 S2 -","- C16 H10 Br2 F8 O4 S2 -","- C64 H40 Br8 F32 O16 S8 -","4","1","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.0395","0.0292","","","0.0612","0.0651","","","","","","1.032","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215747","9.1682","0.0014","9.4618","0.0016","12.3198","0.0016","75.183","0.014","74.084","0.013","79.202","0.014","985.6","0.3","110","0.1","110","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H10 F8 I2 O3 S -","- C16 H10 F8 I2 O3 S -","- C32 H20 F16 I4 O6 S2 -","2","1","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.0317","0.0254","","","0.0517","0.0556","","","","","","1.044","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215748","16.0299","0.0011","4.0059","0.0002","25.154","0.003","90","","106.546","0.009","90","","1548.4","0.2","110","0.1","110","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 F4 I N2 O -","- C16 H9 F4 I N2 O -","- C64 H36 F16 I4 N8 O4 -","4","1","","Takemura, Akihiro; McAllister, Linda J.; Karadakov, Peter B.; Pridmore, Natalie E.; Whitwood, Adrian C.; Bruce, Duncan W.","Competition and cooperation: hydrogen and halogen bonding in co-crystals involving 4-iodotetrafluorobenzoic acid, 4-iodotetrafluorophenol and 4-bromotetrafluorophenol","CrystEngComm","2014","16","20","4254","","10.1039/c4ce00319e","","","0.7107","MoKα","","0.0724","0.0651","","","0.1239","0.1267","","","","","","1.325","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215760","10.13","0.002","10.646","0.002","28.531","0.006","90","","94.23","0.03","90","","3068.5","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H18 Cd2 N10 O10 -","- C30 H18 Cd2 N10 O10 -","- C120 H72 Cd8 N40 O40 -","4","1","","Liu, Kang; Peng, Yu; Yang, Fen; Ma, Dingxuan; Li, Guanghua; Shi, Zhan; Feng, Shouhua","Three metal‒organic frameworks based on the semirigid V-shaped 5-(3-amino-tetrazole-5-phenoxy)-isophthalic acid ligand: syntheses, topological structures and properties","CrystEngComm","2014","16","21","4382","","10.1039/c4ce00105b","","","0.71073","MoKα","","0.0518","0.0394","","","0.0804","0.0859","","","","","","1.085","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215761","19.408","0.004","38.069","0.008","14.436","0.003","90","","105.32","0.03","90","","10287","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H23.5 Mn3 N15 O18.25 -","- C45 H21 Mn3 N15 O18.25 -","- C360 H168 Mn24 N120 O146 -","8","1","","Liu, Kang; Peng, Yu; Yang, Fen; Ma, Dingxuan; Li, Guanghua; Shi, Zhan; Feng, Shouhua","Three metal‒organic frameworks based on the semirigid V-shaped 5-(3-amino-tetrazole-5-phenoxy)-isophthalic acid ligand: syntheses, topological structures and properties","CrystEngComm","2014","16","21","4382","","10.1039/c4ce00105b","","","0.71073","MoKα","","0.1106","0.0652","","","0.1651","0.1917","","","","","","1.014","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215762","9.976","0.002","9.999","0.002","17.099","0.003","85.38","0.03","75.37","0.03","84.31","0.03","1639.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H19 Cu3 N10 O12 -","- C30 H18 Cu3 N10 O12.5 -","- C60 H36 Cu6 N20 O25 -","2","1","","Liu, Kang; Peng, Yu; Yang, Fen; Ma, Dingxuan; Li, Guanghua; Shi, Zhan; Feng, Shouhua","Three metal‒organic frameworks based on the semirigid V-shaped 5-(3-amino-tetrazole-5-phenoxy)-isophthalic acid ligand: syntheses, topological structures and properties","CrystEngComm","2014","16","21","4382","","10.1039/c4ce00105b","","","0.71073","MoKα","","0.0601","0.0438","","","0.1169","0.1277","","","","","","1.09","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215763","4.6927","0.0003","13.1132","0.001","14.7084","0.0014","90","","90.09","0.006","90","","905.1","0.12","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-hydroxy-3[1-(3,4,5-trimethoxy-benzylimino)-ethyl]chromen-2-one","","- C21 H21 N O6 -","- C21 H21 N O6 -","- C42 H42 N2 O12 -","2","1","","Małecka, Magdalena; Budzisz, Elzbieta","A structural framework of biologically active coumarin derivatives: crystal structure and Hirshfeld surface analysis","CrystEngComm","2014","16","29","6654","","10.1039/c4ce00499j","","","0.71073","MoKα","","0.0574","0.0337","","","0.0536","0.0564","","","","","","0.8","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215764","11.4149","0.0003","15.5812","0.0003","15.0592","0.0004","90","","126.999","0.002","90","","2139.09","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-hydroxy-3-[phenyl-(3,4,5-tromethoxy-bezylimino)-methyl] chromen-2-one","","- C26 H23 N O6 -","- C26 H23 N O6 -","- C104 H92 N4 O24 -","4","1","","Małecka, Magdalena; Budzisz, Elzbieta","A structural framework of biologically active coumarin derivatives: crystal structure and Hirshfeld surface analysis","CrystEngComm","2014","16","29","6654","","10.1039/c4ce00499j","","","0.71073","MoKα","","0.0555","0.0331","","","0.0689","0.0721","","","","","","0.861","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215765","8.166","0.003","17.642","0.003","10.775","0.004","90","","117.06","0.02","90","","1382.4","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-hydroxy-3-[(2-imidazol-1-yl-ethylimino)-methyl]-chromen-2-one","","- C16 H15 N3 O3 -","- C16 H15 N3 O3 -","- C64 H60 N12 O12 -","4","1","","Małecka, Magdalena; Budzisz, Elzbieta","A structural framework of biologically active coumarin derivatives: crystal structure and Hirshfeld surface analysis","CrystEngComm","2014","16","29","6654","","10.1039/c4ce00499j","","","0.6","synchrotron","","0.0366","0.0355","","","0.0977","0.0986","","","","","","1.031","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215766","8.4362","0.0005","10.7119","0.0007","19.9504","0.0017","94.185","0.006","102.2","0.006","94.855","0.005","1748.2","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H40 Br2 Cd N4 O12 -","- C30 H40 Br2 Cd N4 O12 -","- C60 H80 Br4 Cd2 N8 O24 -","2","1","","Fu, Kai; Ren, Cai-Xia; Chen, Cheng; Cai, Li-Xuan; Tan, Bin; Zhang, Jie","Auxiliary ligand-controlled photochromism and decolourization of two bipyridinium-based metal‒organic hybrid materials with various water clusters","CrystEngComm","2014","16","23","5134","","10.1039/c4ce00295d","","","0.71073","MoKα","","0.0724","0.058","","","0.1523","0.1614","","","","","","1.065","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215767","9.324","0.002","11.882","0.003","12.235","0.003","70.286","0.01","75.784","0.012","68.281","0.011","1174.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H26 Br Cd N2 O10 -","- C19 H26 Br Cd N2 O10 -","- C38 H52 Br2 Cd2 N4 O20 -","2","1","","Fu, Kai; Ren, Cai-Xia; Chen, Cheng; Cai, Li-Xuan; Tan, Bin; Zhang, Jie","Auxiliary ligand-controlled photochromism and decolourization of two bipyridinium-based metal‒organic hybrid materials with various water clusters","CrystEngComm","2014","16","23","5134","","10.1039/c4ce00295d","","","0.71073","MoKα","","0.0633","0.0579","","","0.179","0.1847","","","","","","1.006","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215768","4.8042","0.0002","14.8701","0.0005","15.6243","0.0005","67.284","0.003","85.298","0.003","88.19","0.003","1026.14","0.07","295","2","295","2","","","","","","","","4","P -1","-P 1","2","Tetraglycine","Glycyl-glycyl-glycyl-glycine","","- C8 H14 N4 O5 -","- C8 H14 N4 O5 -","- C32 H56 N16 O20 -","4","2","","Smith, Aaron J.; Ali, Farukh I.; Soldatov, Dmitriy V.","Glycine homopeptides: the effect of the chain length on the crystal structure and solid state reactivity","CrystEngComm","2014","16","31","7196","","10.1039/C4CE00630E","","","1.54184","CuKα","","0.0404","0.0391","","","0.1101","0.1116","","","","","","1.018","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215769","4.7995","0.0003","14.9108","0.0015","17.6905","0.0019","90.203","0.008","94.866","0.007","91.976","0.007","1260.7","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","Pentaglycine","Glycyl-glycyl-glycyl-glycyl-glycine","","- C10 H17 N5 O6 -","- C10 H17 N5 O6 -","- C40 H68 N20 O24 -","4","2","","Smith, Aaron J.; Ali, Farukh I.; Soldatov, Dmitriy V.","Glycine homopeptides: the effect of the chain length on the crystal structure and solid state reactivity","CrystEngComm","2014","16","31","7196","","10.1039/C4CE00630E","","","1.54184","CuKα","","0.1074","0.0858","","","0.235","0.2538","","","","","","1.047","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215779","14.3171","0.0003","17.6113","0.0003","20.4106","0.0003","90","","90","","90","","5146.38","0.16","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H56 Ag4 I12 N8 -","- C20 H56 Ag4 I12 N8 -","- C80 H224 Ag16 I48 N32 -","4","0.5","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.0484","0.0361","","","0.0785","0.0852","","","","","","1.043","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215780","7.7685","0.0003","14.0322","0.0004","12.8393","0.0004","90","","94.638","0.003","90","","1395.02","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H32 Ag2 I6 N4 O2 -","- C10 H32 Ag2 I6 N4 O2 -","- C20 H64 Ag4 I12 N8 O4 -","2","0.5","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.0373","0.0292","","","0.0597","0.0638","","","","","","1.044","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215781","11.43","0.002","8.641","0.0017","14.858","0.003","90","","109.533","0.003","90","","1383","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H32 Ag2 I6 N4 O2 -","- C10 H28 Ag2 I6 N4 O2 -","- C20 H56 Ag4 I12 N8 O4 -","2","0.5","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.0384","0.0292","","","0.0778","0.1124","","","","","","1.222","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215782","13.5726","0.0005","25.6551","0.0011","7.9367","0.0003","90","","93.767","0.004","90","","2757.64","0.19","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C13 H38 Ag10 I12 N2 O4 S4 -","- C13 H10 Ag10 I12 N2 O4 S4 -","- C26 H20 Ag20 I24 N4 O8 S8 -","2","0.5","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.0722","0.0516","","","0.1076","0.1185","","","","","","1.045","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215783","8.856","0.0008","9.3709","0.0009","12.7384","0.0012","90","","90","","90","","1057.14","0.17","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C5 H13 Ag I2 N2 -","- C5 H10 Ag I2 N2 -","- C20 H40 Ag4 I8 N8 -","4","0.5","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.08","0.0798","","","0.1857","0.1859","","","","","","1.342","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215784","21.0624","0.0007","23.7188","0.0007","24.3861","0.0007","90","","90","","90","","12182.7","0.6","293","2","293","2","","","","","","","","7","I b c a","-I 2b 2c","73","","","","- C9 H26 Ag4 I6 N2 O2 S2 -","- C9 H14 Ag4 I6 N2 O2 S2 -","- C144 H224 Ag64 I96 N32 O32 S32 -","16","1","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.0702","0.0455","","","0.0939","0.1041","","","","","","1.07","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215785","10.5218","0.0005","8.1301","0.0004","16.0861","0.0007","90","","97.522","0.004","90","","1364.22","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H13 Ag2 I3 N2 -","- C5 H13 Ag2 I3 N2 -","- C20 H52 Ag8 I12 N8 -","4","1","","Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong","Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties","CrystEngComm","2014","16","24","5280","","10.1039/c3ce42579g","","","0.71073","MoKα","","0.0577","0.0391","","","0.0838","0.0967","","","","","","1.038","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215786","8.1241","0.0003","30.3843","0.001","15.6616","0.0005","90","","90","","90","","3866","0.2","110","2","110","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C27 H23 La2 N5 O14 -","- C27 H23 La2 N5 O14 -","- C108 H92 La8 N20 O56 -","4","0.5","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.051","0.0434","","","0.1085","0.1113","","","","","","1.08","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215787","8.1162","0.0004","30.2842","0.0014","15.6709","0.0007","90","","90","","90","","3851.8","0.3","110","2","110","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C27 H23 Ce2 N5 O14 -","- C27 H23 Ce2 N5 O14 -","- C108 H92 Ce8 N20 O56 -","4","0.5","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.0478","0.0401","","","0.1004","0.1028","","","","","","1.087","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215788","8.5085","0.0004","16.0156","0.0008","27.9393","0.0014","90","","90","","90","","3807.3","0.3","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H23 N5 O14 Tb2 -","- C27 H23 N5 O14 Tb2 -","- C108 H92 N20 O56 Tb8 -","4","1","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.0513","0.0418","","","0.1008","0.105","","","","","","1.06","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215789","14.2109","0.0005","17.6868","0.0006","14.211","0.0005","90","","118.306","0.002","90","","3144.8","0.2","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H14 Br4 Co2 N4 O9 -","- C24 H14 Br4 Co2 N4 O9 -","- C96 H56 Br16 Co8 N16 O36 -","4","1","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.0463","0.0373","","","0.1034","0.1068","","","","","","1.089","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215790","12.0504","0.0003","9.9837","0.0002","24.8139","0.0005","90","","101.298","0.001","90","","2927.45","0.11","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H6 Br2 Cd N2 O4 -","- C12 H6 Br2 Cd N2 O4 -","- C96 H48 Br16 Cd8 N16 O32 -","8","1","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.0275","0.0233","","","0.0457","0.0468","","","","","","1.084","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215791","13.2579","0.0005","11.438","0.0003","28.745","0.001","90","","99.887","0.002","90","","4294.3","0.2","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 Mn3 N6 O15 -","- C31 H30 Mn3 N6 O15 -","- C124 H120 Mn12 N24 O60 -","4","1","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.081","0.0668","","","0.1727","0.1797","","","","","","1.043","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215792","10.8285","0.0004","11.1933","0.0004","14.799","0.0006","90","","90","","90","","1793.74","0.12","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 N3 O6 Zn -","- C15 H21 N3 O6 Zn -","- C60 H84 N12 O24 Zn4 -","4","1","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.032","0.0283","","","0.0639","0.0651","","","","","","1.042","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215793","9.2879","0.0003","11.9733","0.0003","16.3513","0.0005","90","","101.709","0.0016","90","","1780.54","0.09","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H21 Cd N3 O6 -","- C15 H21 Cd N3 O6 -","- C60 H84 Cd4 N12 O24 -","4","2","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.0398","0.0328","","","0.0653","0.0685","","","","","","1.061","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215794","8.0234","0.0001","30.2439","0.0005","15.328","0.0002","90","","90","","90","","3719.48","0.09","110","2","110","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C27 H23 N5 O14 Sm2 -","- C27 H23 N5 O14 Sm2 -","- C108 H92 N20 O56 Sm8 -","4","0.5","","Nandi, Goutam; Thakuria, Ranjit; Titi, Hatem M.; Patra, Ranjan; Goldberg, Israel","Synthesis, structure, topology and magnetic properties of new coordination polymers based on 5(‒Br/‒COOH)-substituted nicotinic acid","CrystEngComm","2014","16","24","5244","","10.1039/c4ce00300d","","","0.71073","MoKα","","0.034","0.0294","","","0.0758","0.0781","","","","","","1","","","","has coordinates,has disorder","180488","2020-10-21","18:00:00",""
"7215795","8.127","0.0016","10.346","0.002","10.659","0.002","62.22","0.03","83.15","0.03","79.28","0.03","778.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H19 Cl N2 O7 -","- C11 H19 Cl N2 O7 -","- C22 H38 Cl2 N4 O14 -","2","1","","Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang","Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies","CrystEngComm","2014","16","24","5319","","10.1039/c4ce00150h","","","0.71073","MoKα","","0.2074","0.1638","","","0.4369","0.4776","","","","","","1.861","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215796","11.802","0.002","15.408","0.003","13.991","0.003","90","","90.28","0.03","90","","2544.2","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H33 B F4.5 N O6 -","- C22 H33 B F4.5 N O6 -","- C88 H132 B4 F18 N4 O24 -","4","1","","Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang","Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies","CrystEngComm","2014","16","24","5319","","10.1039/c4ce00150h","","","0.71073","MoKα","","0.1698","0.0992","","","0.286","0.3369","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215797","12.222","0.002","14.09","0.003","13.8","0.003","90","","98.09","0.03","90","","2352.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H30 Cl2 N2 O10 -","- C17 Cl2 N2 O10 -","- C68 Cl8 N8 O40 -","4","1","","Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang","Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies","CrystEngComm","2014","16","24","5319","","10.1039/c4ce00150h","","","0.71073","MoKα","","0.2458","0.2083","","","0.5162","0.5438","","","","","","3.505","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7215798","8.6838","0.0017","14.33","0.003","9.2084","0.0018","90","","103.72","0.03","90","","1113.2","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C19 H31 B F2 N O8 -","- C19 H31 B F2 N O8 -","- C38 H62 B2 F4 N2 O16 -","2","1","","Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang","Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies","CrystEngComm","2014","16","24","5319","","10.1039/c4ce00150h","","","0.71073","MoKα","","0.0952","0.0537","","","0.1117","0.1283","","","","","","1.023","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215799","17.415","0.004","8.8817","0.0018","23.87","0.005","90","","97.56","0.03","90","","3660","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C H B F N O -","- C1.18033 B0.131148 F0.52459 N0.196721 O0.459016 -","- C72 B8 F32 N12 O28 -","61","15.25","","Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang","Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies","CrystEngComm","2014","16","24","5319","","10.1039/c4ce00150h","","","0.71073","MoKα","","0.5173","0.4559","","","0.7919","0.8207","","","","","","3.32","","","","has coordinates","180488","2020-10-21","18:00:00",""
"7215800","8.763","0.0018","14.503","0.003","15.775","0.003","90","","98.41","0.03","90","","1983.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 B F4 N O5 -","- C16 H26 B F4 N O5 -","- C64 H104 B4 F16 N4 O20 -","4","1","","Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang","Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies","CrystEngComm","2014","16","24","5319","","10.1039/c4ce00150h","","","0.71073","MoKα","","0.1713","0.1006","","","0.2804","0.3355","","","","","","1.08","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215801","15.6904","0.0006","21.8223","0.0008","15.8024","0.0006","90","","113.256","0.001","90","","4971.1","0.3","120","0.2","120.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H63 N3 O13 S2 -","- C50 H61 N3 O13 S2 -","- C200 H244 N12 O52 S8 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.2219","0.0752","","","0.151","0.1891","","","","","","0.865","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215802","7.3589","0.0003","20.83","0.0009","11.2706","0.0005","90","","91.727","0.003","90","","1726.84","0.13","120","0.2","123.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 B F4 N O2 -","- C17 H20 B F4 N O2 -","- C68 H80 B4 F16 N4 O8 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.1481","0.079","","","0.1786","0.2012","","","","","","1.043","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215803","7.106","0.002","22.507","0.007","11.576","0.003","90","","90.143","0.008","90","","1851.4","0.9","120","0.2","120.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 F6 N O2 P -","- C17 H20 F6 N O2 P -","- C68 H80 F24 N4 O8 P4 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.1368","0.0632","","","0.1223","0.1431","","","","","","0.972","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215804","14.2243","0.001","14.419","0.0009","22.4404","0.0015","90","","104.933","0.004","90","","4447.1","0.5","100","0.2","100.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 N4 O9 -","- C23 H22 N4 O9 -","- C184 H176 N32 O72 -","8","2","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","1.54178","CuKα","","0.111","0.084","","","0.2049","0.2272","","","","","","1.046","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215805","11.737","0.001","26.623","0.002","8.2528","0.0007","90","","109.714","0.003","90","","2427.6","0.3","120","0.2","123.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 N4 O9 -","- C26 H25 N4 O9 -","- C104 H100 N16 O36 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.1808","0.0808","","","0.1869","0.2235","","","","","","0.914","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215806","8.9861","0.0004","9.0343","0.0004","40.1047","0.0017","90","","90","","90","","3255.8","0.2","120","0.2","120.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C41 H40 B N O2 -","- C41 H40 B N O2 -","- C164 H160 B4 N4 O8 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.1312","0.0732","","","0.113","0.1282","","","","","","0.962","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215807","7.3008","0.0003","20.8807","0.0006","11.3281","0.0004","90","","91.918","0.002","90","","1725.95","0.11","120","0.2","123.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 B F4 N O2 -","- C17 H20 B F4 N O2 -","- C68 H80 B4 F16 N4 O8 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.0996","0.0572","","","0.1336","0.1478","","","","","","1.045","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215808","7.319","0.002","20.852","0.007","11.302","0.004","90","","91.835","0.005","90","","1724","1","170.2","0.2","170.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 B F4 N O2 -","- C17 H20 B F4 N O2 -","- C68 H80 B4 F16 N4 O8 -","4","1","","Kuz'mina, Lyudmila G.; Vedernikov, Artem I.; Churakov, Andrei V.; Lermontova, Elmira Kh.; Howard, Judith A. K.; Alfimov, Michael V.; Gromov, Sergey P.","Influence of the anion nature on styryl dye crystal packing and feasibility of the direct and back [2 + 2] photocycloaddition reactions without single crystal degradation","CrystEngComm","2014","16","24","5364","","10.1039/c4ce00266k","","","0.71073","MoKα","","0.083","0.0601","","","0.1668","0.1791","","","","","","1.093","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215809","16.3042","0.0011","22.6007","0.0008","17.1913","0.0009","90","","115.29","0.007","90","","5727.6","0.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C90 H84 Co2 N30 O42 Si W12 -","- C90 H80 Co2 N30 O42 Si W12 -","- C180 H160 Co4 N60 O84 Si2 W24 -","2","0.5","","Luo, Yu-Hui; Yu, Xiao-Yang; Zhang, Hong","Two unprecedented entangled coordination polymers based on α-{SiW12O40}4−","CrystEngComm","2014","16","29","6664","","10.1039/c4ce00550c","","","0.71073","MoKα","","0.1189","0.0682","","","0.1111","0.1338","","","","","","1.078","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215810","12.6869","0.0007","22.7919","0.0014","28.5112","0.0019","90","","90","","90","","8244.3","0.9","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C54 H54 Cu2 N18 O43 Si W12 -","- C54 H50 Cu2 N18 O43 Si W12 -","- C216 H200 Cu8 N72 O172 Si4 W48 -","4","0.5","","Luo, Yu-Hui; Yu, Xiao-Yang; Zhang, Hong","Two unprecedented entangled coordination polymers based on α-{SiW12O40}4−","CrystEngComm","2014","16","29","6664","","10.1039/c4ce00550c","","","0.71073","MoKα","","0.0978","0.0834","","","0.1566","0.1636","","","","","","1.06","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215811","39.799","0.002","31.5266","0.0009","22.974","0.0011","90","","117.023","0.006","90","","25679","2","100","2","100","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C304 H496 Gd7 N80 Na7 O254 S32 -","- C304 H276 Gd7 N80 Na7 O254 S32 -","- C608 H552 Gd14 N160 Na14 O508 S64 -","2","0.25","","Ling, Irene; Skelton, Brian W.; Sobolev, Alexandre N.; Alias, Yatimah; Raston, Colin L.","Manipulating the conformation and interplay of p-sulfonated calix[4]arenes by lower rim tri-substitution with N′-cyanocarbamimidate groups","CrystEngComm","2014","16","23","5159","","10.1039/c4ce00336e","","","0.71073","MoKα","","0.2253","0.142","","","0.2837","0.3217","","","","","","1.178","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215828","3.9459","0.0002","22.7301","0.0008","11.1951","0.0005","90","","107.725","0.004","90","","956.43","0.08","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","","Näther, Christian; Jess, Inke; Bahrenburg, Julia; Bank, Dennis; Temps, Friedrich","Trimorphism of N-(3-pyridyl)-benzamide","CrystEngComm","2014","16","25","5633","","10.1039/c4ce00495g","","","0.71073","MoKα","","0.0514","0.0419","","","0.1043","0.1101","","","","","","1.048","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215829","4.0274","0.0003","22.705","0.0016","11.2415","0.0006","90","","107.874","0.007","90","","978.33","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(3-Pyridyl)-Benzamide","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","","Näther, Christian; Jess, Inke; Bahrenburg, Julia; Bank, Dennis; Temps, Friedrich","Trimorphism of N-(3-pyridyl)-benzamide","CrystEngComm","2014","16","25","5633","","10.1039/c4ce00495g","","","0.71073","MoKα","","0.0666","0.0453","","","0.1059","0.1167","","","","","","1.031","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215830","5.2575","0.0006","22.8695","0.0016","7.9917","0.0009","90","","90.61","0.013","90","","960.84","0.17","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","N-(3-Pyridyl)-Benzamide","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","2","","Näther, Christian; Jess, Inke; Bahrenburg, Julia; Bank, Dennis; Temps, Friedrich","Trimorphism of N-(3-pyridyl)-benzamide","CrystEngComm","2014","16","25","5633","","10.1039/c4ce00495g","","","0.71073","MoKα","","0.0661","0.0585","","","0.1514","0.1591","","","","","","1.11","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215831","24.078","0.002","5.2381","0.0002","15.9279","0.0013","90","","109.382","0.009","90","","1895","0.3","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-(3-Pyridyl)-Benzamide","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C96 H80 N16 O8 -","8","1","","Näther, Christian; Jess, Inke; Bahrenburg, Julia; Bank, Dennis; Temps, Friedrich","Trimorphism of N-(3-pyridyl)-benzamide","CrystEngComm","2014","16","25","5633","","10.1039/c4ce00495g","","","0.71073","MoKα","","0.0644","0.0465","","","0.1109","0.1214","","","","","","1.03","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215832","24.1282","0.0015","5.2571","0.0002","16.125","0.0011","90","","109.197","0.005","90","","1931.6","0.2","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-(3-Pyridyl)-Benzamide","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C96 H80 N16 O8 -","8","1","","Näther, Christian; Jess, Inke; Bahrenburg, Julia; Bank, Dennis; Temps, Friedrich","Trimorphism of N-(3-pyridyl)-benzamide","CrystEngComm","2014","16","25","5633","","10.1039/c4ce00495g","","","0.71073","MoKα","","0.0738","0.0538","","","0.1043","0.1119","","","","","","1.11","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215833","15.026","0.009","15.473","0.009","15.512","0.009","108.495","0.005","117.49","","96.862","0.006","2879","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H42 Cl2 Cu3 Eu N4 O22 -","- C48 H42 Cl2 Cu3 Eu N4 O22 -","- C96 H84 Cl4 Cu6 Eu2 N8 O44 -","2","1","","Fang, Wei-Hui; Yang, Guo-Yu","Bilayer architecture based on hexanuclear heterometal cluster units","CrystEngComm","2014","16","29","6790","","10.1039/c4ce00747f","","","0.71073","MoKα","","0.1172","0.0882","","","0.2165","0.2465","","","","","","1.048","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215834","14.0612","0.0002","16.1146","0.0002","15.5087","0.0002","90","","103.837","0.002","90","","3412.15","0.08","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H16 In O8 -","- C28 H16 In O8 -","- C112 H64 In4 O32 -","4","1","","Qian, Jinjie; Jiang, Feilong; Su, Kongzhao; Li, Qipeng; Zhou, Kang; Wu, Mingyan; Yuan, Daqiang; Hong, Maochun","Sorption comparison of two indium‒organic framework isomers with syn‒anti configurations","CrystEngComm","2014","16","32","7434","","10.1039/C4CE00712C","","","1.54184","CuKα","","0.0382","0.036","","","0.1226","0.1251","","","","","","1.014","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215835","10.7454","0.0001","10.7454","0.0001","14.4927","0.0005","90","","90","","90","","1673.38","0.06","173","2","173","2","","","","","","","","4","P -4 2 c","P -4 2c","112","","","","- C7 H4 In0.25 O2 -","- C7 H4 In0.25 O2 -","- C56 H32 In2 O16 -","8","1","","Qian, Jinjie; Jiang, Feilong; Su, Kongzhao; Li, Qipeng; Zhou, Kang; Wu, Mingyan; Yuan, Daqiang; Hong, Maochun","Sorption comparison of two indium‒organic framework isomers with syn‒anti configurations","CrystEngComm","2014","16","32","7434","","10.1039/C4CE00712C","","","1.54184","CuKα","","0.0577","0.0511","","","0.1688","0.1815","","","","","","1.118","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215836","7.958","0.0016","9.157","0.0018","10.069","0.002","76.71","0.03","84.84","0.03","67.98","0.03","662","0.3","100","2","100","","","","","","","","","7","P -1","-P 1","2","","","","- C22 H20 Ag2 F6 N4 O6 S2 -","- C22 H20 Ag2 F6 N4 O6 S2 -","- C22 H20 Ag2 F6 N4 O6 S2 -","1","0.5","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.7108","synchrotron","","0.0211","0.0208","","","0.0494","0.0496","","","","","","1.186","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215837","25.839","0.006","11.48","0.003","24.597","0.008","90","","113.623","0.013","90","","6685","3","123","2","123.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C53 H58 Ag4 F12 N8 O15 S4 -","- C53 H58 Ag4 F12 N8 O15 S4 -","- C212 H232 Ag16 F48 N32 O60 S16 -","4","0.5","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.71073","MoKα","","0.1189","0.0589","","","0.1224","0.1506","","","","","","0.984","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215838","8.2084","0.0004","10.3939","0.0004","12.6354","0.0006","71.597","0.002","77.611","0.003","86.597","0.002","999.03","0.08","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H22 Ag F6 N2 O2 P -","- C16 H22 Ag F6 N2 O2 P -","- C32 H44 Ag2 F12 N4 O4 P2 -","2","1","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.71073","MoKα","","0.0604","0.0397","","","0.0679","0.0755","","","","","","1.034","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215839","8.289","0.0017","9.838","0.002","11.203","0.002","102.51","0.03","102.92","0.03","93.06","0.03","864.3","0.3","100","2","100","","","","","","","","","7","P -1","-P 1","2","","","","- C28 H32 Ag2 F6 N4 O8 S2 -","- C28 H32 Ag2 F6 N4 O8 S2 -","- C28 H32 Ag2 F6 N4 O8 S2 -","1","0.5","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.7108","Synchrotron","","0.0385","0.0352","","","0.0895","0.0916","","","","","","1.051","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215840","13.631","0.0008","16.7804","0.0008","10.9261","0.0006","90","","115.623","0.002","90","","2253.4","0.2","123","2","123","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C21 H20 Ag F3 N4 O3 S -","- C21 H20 Ag F3 N4 O3 S -","- C84 H80 Ag4 F12 N16 O12 S4 -","4","1","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.71073","MoKα","","0.0468","0.0396","","","0.0833","0.0875","","","","","","1.023","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215841","6.5627","0.0005","8.2007","0.0007","8.5966","0.0007","83.164","0.004","71.318","0.003","71.589","0.003","415.77","0.06","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H20 N4 -","- C20 H20 N4 -","- C20 H20 N4 -","1","0.5","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.71073","MoKα","","0.0704","0.0517","","","0.1247","0.1372","","","","","","1.109","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215842","6.1328","0.0005","7.1872","0.0006","10.0545","0.0009","78.816","0.005","74.898","0.005","79.084","0.006","415.21","0.06","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H20 N4 -","- C20 H20 N4 -","- C20 H20 N4 -","1","0.5","","Beeching, Lianna J.; Hawes, Chris S.; Turner, David R.; Batten, Stuart R.","The influence of anion, ligand geometry and stoichiometry on the structure and dimensionality of a series of AgI-bis(cyanobenzyl)piperazine coordination polymers","CrystEngComm","2014","16","28","6459","","10.1039/c4ce00816b","","","0.71073","MoKα","","0.0741","0.05","","","0.1049","0.1158","","","","","","1.07","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215843","38.973","0.008","11.992","0.002","17.704","0.004","90","","105.94","0.03","90","","7956","3","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H32 Cu2 I2 N2 P2 -","- C42 H32 Cu2 I2 N2 P2 -","- C336 H256 Cu16 I16 N16 P16 -","8","1","","Wei, Feng; Liu, Xiaochen; Liu, Zhiwei; Bian, Zuqiang; Zhao, Yongliang; Huang, Chunhui","Structural and photophysical study of copper iodide complex with P^N or P^N^P ligand","CrystEngComm","2014","16","24","5338","","10.1039/c4ce00315b","","","0.71073","MoKα","","0.0382","0.0336","","","0.0743","0.0761","","","","","","1.358","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215844","10.1854","0.0012","13.224","0.003","28.904","0.006","90","","90","","90","","3893.1","1.3","148","2","148","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H36 Cu3 I3 N2 P2 -","- C38 H36 Cu3 I3 N2 P2 -","- C152 H144 Cu12 I12 N8 P8 -","4","1","","Wei, Feng; Liu, Xiaochen; Liu, Zhiwei; Bian, Zuqiang; Zhao, Yongliang; Huang, Chunhui","Structural and photophysical study of copper iodide complex with P^N or P^N^P ligand","CrystEngComm","2014","16","24","5338","","10.1039/c4ce00315b","","","0.71073","MoKα","","0.0431","0.0356","","","0.0632","0.0656","","","","","","1.238","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215845","15.983","0.003","11.391","0.002","16.357","0.003","90","","108.82","0.03","90","","2818.8","1","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H27 Cu I N P2 -","- C31 H27 Cu I N P2 -","- C124 H108 Cu4 I4 N4 P8 -","4","1","","Wei, Feng; Liu, Xiaochen; Liu, Zhiwei; Bian, Zuqiang; Zhao, Yongliang; Huang, Chunhui","Structural and photophysical study of copper iodide complex with P^N or P^N^P ligand","CrystEngComm","2014","16","24","5338","","10.1039/c4ce00315b","","","0.71073","MoKα","","0.0543","0.0357","","","0.045","0.0475","","","","","","1.377","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215846","23.986","0.005","13.948","0.003","21.765","0.004","90","","109.18","0.03","90","","6877","3","133","2","133","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H43 Cu2 I2 N P2 -","- C23 H43 Cu2 I2 N P2 -","- C184 H344 Cu16 I16 N8 P16 -","8","1","","Wei, Feng; Liu, Xiaochen; Liu, Zhiwei; Bian, Zuqiang; Zhao, Yongliang; Huang, Chunhui","Structural and photophysical study of copper iodide complex with P^N or P^N^P ligand","CrystEngComm","2014","16","24","5338","","10.1039/c4ce00315b","","","0.71073","MoKα","","0.0501","0.0377","","","0.0605","0.0618","","","","","","1.692","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215847","15.3727","0.0011","16.4442","0.0012","14.2397","0.0011","90","","122.25","0.001","90","","3044.3","0.4","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H43 Cu3 I3 N P2 -","- C23 H43 Cu3 I3 N P2 -","- C92 H172 Cu12 I12 N4 P8 -","4","0.5","","Wei, Feng; Liu, Xiaochen; Liu, Zhiwei; Bian, Zuqiang; Zhao, Yongliang; Huang, Chunhui","Structural and photophysical study of copper iodide complex with P^N or P^N^P ligand","CrystEngComm","2014","16","24","5338","","10.1039/c4ce00315b","","","0.71073","MoKα","","0.0339","0.0295","","","0.0641","0.0664","","","","","","1.248","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7215848","9.1258","0.0003","11.138","0.0004","11.3262","0.0004","77.317","0.003","68.681","0.004","79.25","0.003","1039.05","0.07","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H23 La N O9 S3 -","- C12 H19 La N O9 S3 -","- C24 H38 La2 N2 O18 S6 -","2","1","","Zhuang, Gui-lin; Tan, Li; Chen, Wu-lin; Bai, Jia-qi; Zhong, Xing; Wang, Jian-guo","Synthesis, properties, and magnetism‒structure relationship of lanthanide-based metal‒organic frameworks with (ethylenedithio)acetic acid","CrystEngComm","2014","16","30","6963","","10.1039/C4CE00573B","","","0.71073","MoKα","","0.0279","0.0262","","","0.0721","0.0738","","","","","","1.015","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215849","9.14","0.0005","11.1538","0.0003","11.2716","0.0006","77.261","0.003","68.453","0.005","78.843","0.003","1034.43","0.09","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H23 N Nd O9 S3 -","- C12 H19 N Nd O9 S3 -","- C24 H38 N2 Nd2 O18 S6 -","2","1","","Zhuang, Gui-lin; Tan, Li; Chen, Wu-lin; Bai, Jia-qi; Zhong, Xing; Wang, Jian-guo","Synthesis, properties, and magnetism‒structure relationship of lanthanide-based metal‒organic frameworks with (ethylenedithio)acetic acid","CrystEngComm","2014","16","30","6963","","10.1039/C4CE00573B","","","0.71073","MoKα","","0.0307","0.0269","","","0.0706","0.0728","","","","","","1.108","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215850","9.1686","0.0005","11.1145","0.0007","11.1899","0.0008","77.156","0.006","68.195","0.006","78.35","0.005","1023.21","0.12","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H23 Eu N O9 S3 -","- C12 H19 Eu N O9 S3 -","- C24 H38 Eu2 N2 O18 S6 -","2","1","","Zhuang, Gui-lin; Tan, Li; Chen, Wu-lin; Bai, Jia-qi; Zhong, Xing; Wang, Jian-guo","Synthesis, properties, and magnetism‒structure relationship of lanthanide-based metal‒organic frameworks with (ethylenedithio)acetic acid","CrystEngComm","2014","16","30","6963","","10.1039/C4CE00573B","","","0.71073","MoKα","","0.056","0.041","","","0.0825","0.0884","","","","","","1.054","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215851","9.1742","0.0005","11.1153","0.0005","11.1714","0.0005","77.009","0.004","68.082","0.005","78.222","0.004","1020.66","0.09","288","2","288","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H23 Gd N O9 S3 -","- C12 H23 Gd N O9 S3 -","- C24 H46 Gd2 N2 O18 S6 -","2","1","","Zhuang, Gui-lin; Tan, Li; Chen, Wu-lin; Bai, Jia-qi; Zhong, Xing; Wang, Jian-guo","Synthesis, properties, and magnetism‒structure relationship of lanthanide-based metal‒organic frameworks with (ethylenedithio)acetic acid","CrystEngComm","2014","16","30","6963","","10.1039/C4CE00573B","","","0.71073","MoKα","","0.0319","0.0288","","","0.0767","0.0793","","","","","","1.03","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215852","8.2735","0.0004","8.6746","0.0005","13.565","0.0007","103.465","0.005","95.601","0.004","117.312","0.005","817.36","0.09","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H18 La O9 S3 -","- C9 H18 La O9 S3 -","- C18 H36 La2 O18 S6 -","2","1","","Zhuang, Gui-lin; Tan, Li; Chen, Wu-lin; Bai, Jia-qi; Zhong, Xing; Wang, Jian-guo","Synthesis, properties, and magnetism‒structure relationship of lanthanide-based metal‒organic frameworks with (ethylenedithio)acetic acid","CrystEngComm","2014","16","30","6963","","10.1039/C4CE00573B","","","0.71073","MoKα","","0.0342","0.0309","","","0.0676","0.0706","","","","","","0.972","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215853","5.496","0.0009","12.831","0.002","17.881","0.003","90","","93.872","0.003","90","","1258.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H18 N O4 -","- C12 H18 N O4 -","- C48 H72 N4 O16 -","4","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.0991","0.0791","","","0.223","0.2435","","","","","","1.083","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215854","9.6944","0.0004","17.9372","0.0007","18.6161","0.0006","90","","91.427","0.003","90","","3236.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 N2 O8 -","- C22 H24 N2 O8 -","- C132 H144 N12 O48 -","6","1.5","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.1007","0.0781","","","0.225","0.254","","","","","","1.069","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215855","7.3345","0.0007","10.9381","0.0011","15.0352","0.0015","90","","92.804","0.002","90","","1204.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N2 O5 -","- C11 H13 N2 O5 -","- C44 H52 N8 O20 -","4","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.0712","0.0597","","","0.1634","0.1768","","","","","","1.042","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215856","14.65","0.007","12.512","0.006","14.649","0.007","90","","93.13","","90","","2681","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 N2 O6 -","- C30 H28 N2 O6 -","- C120 H112 N8 O24 -","4","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.0929","0.0573","","","0.1806","0.2065","","","","","","1.091","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215857","7.8574","0.0013","8.3711","0.0011","11.1437","0.0013","88.282","0.002","72.163","0.001","84.647","0.002","694.7","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H13 N2 O7 -","- C12 H13 N2 O7 -","- C24 H26 N4 O14 -","2","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.0692","0.0612","","","0.1773","0.1872","","","","","","1.071","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215858","7.5343","0.0014","8.9454","0.0017","12.885","0.003","99.769","0.004","103.689","0.004","108.465","0.003","771.6","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H18 N2 O4 -","- C16 H18 N2 O4 -","- C32 H36 N4 O8 -","2","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.0967","0.0873","","","0.2292","0.2474","","","","","","1.053","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215859","7.4101","0.0006","10.2133","0.0009","15.0232","0.0016","90","","95.937","0.009","90","","1130.88","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 N O4 -","- C12 H12 N O4 -","- C48 H48 N4 O16 -","4","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.0641","0.0527","","","0.1532","0.1611","","","","","","1.047","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215860","9.3995","0.0012","17.904","0.002","11.3775","0.0013","90","","93.243","0.002","90","","1911.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H24 N3 O3 -","- C19 H24 N3 O3 -","- C76 H96 N12 O12 -","4","1","","Wang, Lei; Xue, Ruiyu; Li, Yuanxin; Zhao, Yiran; Liu, Faqian; Huang, Keke","Hydrogen-bonding patterns in a series of multi-component molecular solids formed by 2,3,5,6-tetramethylpyrazine with selected carboxylic acids","CrystEngComm","2014","16","30","7074","","10.1039/C4CE00749B","","","0.71073","MoKα","","0.1075","0.0712","","","0.1963","0.2241","","","","","","0.996","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215861","8.4229","0.0005","11.1372","0.0006","17.7581","0.0011","79.11","0.003","79.382","0.004","84.189","0.003","1604.02","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C65.4 H56.8 Cl4 N12 O3 Zn2 -","- C65.4 H53.6 Cl4 N12 O3 Zn2 -","- C65.4 H53.6 Cl4 N12 O3 Zn2 -","1","0.5","","Bray, David J.; Clegg, Jack. K.; Jolliffe, Katrina A.; Lindoy, Leonard F.","Cobalt(ii), iron(ii), zinc(ii) and palladium(ii) complexes of di-topic 4′-{4-[bis(2-pyridyl)aminomethyl]phenyl}-2,2′:6′,2′′-terpyridine. Synthetic and X-ray structural studies","CrystEngComm","2014","16","28","6476","","10.1039/c4ce00414k","","","0.71073","MoKα","","0.1128","0.0583","","","0.1542","0.1841","","","","","","1.02","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7215862","8.265","0.001","11.174","0.001","16.397","0.002","91.485","0.005","91.295","0.005","94.105","0.005","1509.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.25 H25.5 Cl2.5 Co N6 O0.5 -","- C32.25 H24.5 Cl2.5 Co N6 O0.5 -","- C64.5 H49 Cl5 Co2 N12 O -","2","1","","Bray, David J.; Clegg, Jack. K.; Jolliffe, Katrina A.; Lindoy, Leonard F.","Cobalt(ii), iron(ii), zinc(ii) and palladium(ii) complexes of di-topic 4′-{4-[bis(2-pyridyl)aminomethyl]phenyl}-2,2′:6′,2′′-terpyridine. Synthetic and X-ray structural studies","CrystEngComm","2014","16","28","6476","","10.1039/c4ce00414k","","","0.71073","MoKα","","0.0565","0.0377","","","0.0949","0.1063","","","","","","1.055","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7215863","13.7825","0.0009","14.8655","0.001","18.2258","0.0011","70.21","0.002","79.959","0.003","64.388","0.003","3166.7","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H30 N6 O4 Zn -","- C36 H30 N6 O4 Zn -","- C144 H120 N24 O16 Zn4 -","4","2","","Bray, David J.; Clegg, Jack. K.; Jolliffe, Katrina A.; Lindoy, Leonard F.","Cobalt(ii), iron(ii), zinc(ii) and palladium(ii) complexes of di-topic 4′-{4-[bis(2-pyridyl)aminomethyl]phenyl}-2,2′:6′,2′′-terpyridine. Synthetic and X-ray structural studies","CrystEngComm","2014","16","28","6476","","10.1039/c4ce00414k","","","0.71073","MoKα","","0.0725","0.0437","","","0.1052","0.1179","","","","","","1.03","","","","has coordinates","192777","2020-10-21","18:00:00",""
"7215864","13.964","0.002","14.768","0.002","31.254","0.004","90","","102.32","0.009","90","","6296.8","1.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H53 F12 Fe N12 O2.5 P2 -","- C64 H48 F12 Fe N12 O2.5 P2 -","- C256 H192 F48 Fe4 N48 O10 P8 -","4","1","","Bray, David J.; Clegg, Jack. K.; Jolliffe, Katrina A.; Lindoy, Leonard F.","Cobalt(ii), iron(ii), zinc(ii) and palladium(ii) complexes of di-topic 4′-{4-[bis(2-pyridyl)aminomethyl]phenyl}-2,2′:6′,2′′-terpyridine. Synthetic and X-ray structural studies","CrystEngComm","2014","16","28","6476","","10.1039/c4ce00414k","","","0.71073","MoKα","","0.1074","0.0571","","","0.1345","0.1599","","","","","","1.035","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7215865","9.1075","0.001","33.618","0.004","11.0207","0.0012","90","","107.945","0.002","90","","3210.1","0.6","150","2","150","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C65.5 H57 Cl2.5 F3 Fe N12 O12.5 P0.5 -","- C65.5 H55 Cl2.5 F3 Fe N12 O12.5 P0.5 -","- C131 H110 Cl5 F6 Fe2 N24 O25 P -","2","1","","Bray, David J.; Clegg, Jack. K.; Jolliffe, Katrina A.; Lindoy, Leonard F.","Cobalt(ii), iron(ii), zinc(ii) and palladium(ii) complexes of di-topic 4′-{4-[bis(2-pyridyl)aminomethyl]phenyl}-2,2′:6′,2′′-terpyridine. Synthetic and X-ray structural studies","CrystEngComm","2014","16","28","6476","","10.1039/c4ce00414k","","","0.71073","MoKα","","0.1352","0.0823","","","0.2049","0.2357","","","","","","1.004","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215866","12.4067","0.0009","12.7587","0.001","12.7752","0.001","119.538","0.001","118.76","0.0009","90.313","0.001","1462.2","0.2","100","2","100","2","","","","","","","","7","P 1","P 1","1","","","","- C52 H52 Cd F12 N20 O4 P2 -","- C52 H52 Cd F12 N20 O4 P2 -","- C52 H52 Cd F12 N20 O4 P2 -","1","1","","Khanna, Shruti; Verma, Sandeep","Crystal engineering with a purine rare tautomer: structures and luminescence properties","CrystEngComm","2014","16","29","6680","","10.1039/c4ce00611a","","","0.71073","MoKα","","0.0833","0.0604","","","0.1291","0.1893","","","","","","1.166","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215867","10.1946","0.0014","11.962","0.0017","12.8764","0.0018","91.286","0.002","90.548","0.002","109.725","0.003","1477.5","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C13.5 H16 Cd0.25 N5.5 O3.5 -","- C13.5 H16 Cd0.25 N5.5 O3.5 -","- C54 H64 Cd N22 O14 -","4","2","","Khanna, Shruti; Verma, Sandeep","Crystal engineering with a purine rare tautomer: structures and luminescence properties","CrystEngComm","2014","16","29","6680","","10.1039/c4ce00611a","","","0.71073","MoKα","","0.072","0.0484","","","0.1039","0.1652","","","","","","1.107","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215868","10.1883","0.0006","10.9694","0.0007","15.1248","0.0009","70.455","0.001","75.248","0.001","89.571","0.001","1534.82","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H13 Cd0.5 Cl1.5 N5 O2.5 -","- C13 H13 Cd0.5 Cl1.5 N5 O2.5 -","- C52 H52 Cd2 Cl6 N20 O10 -","4","2","","Khanna, Shruti; Verma, Sandeep","Crystal engineering with a purine rare tautomer: structures and luminescence properties","CrystEngComm","2014","16","29","6680","","10.1039/c4ce00611a","","","0.71073","MoKα","","0.0675","0.057","","","0.1575","0.1727","","","","","","1.058","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215869","9.8188","0.0012","11.2793","0.0013","16.186","0.002","109.391","0.003","92.323","0.002","97.053","0.002","1671.8","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H38 Cd N10 O8 -","- C31 H38 Cd N10 O8 -","- C62 H76 Cd2 N20 O16 -","2","1","","Khanna, Shruti; Verma, Sandeep","Crystal engineering with a purine rare tautomer: structures and luminescence properties","CrystEngComm","2014","16","29","6680","","10.1039/c4ce00611a","","","0.71073","MoKα","","0.0478","0.0394","","","0.096","0.1288","","","","","","1.188","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215870","11.7717","0.0003","18.0229","0.0004","13.5418","0.0005","90","","105.695","0.003","90","","2765.91","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 Cd N4 S4 -","- C28 H26 Cd N4 S4 -","- C112 H104 Cd4 N16 S16 -","4","1","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Drew, Michael. G. B.; Singh, Nanhai","Influence of ligand environments on the structures and luminescence properties of homoleptic cadmium(ii) pyridyl functionalized dithiocarbamates","CrystEngComm","2014","16","29","6765","","10.1039/c4ce00510d","","","0.71073","MoKα","","0.0743","0.0454","","","0.0949","0.105","","","","","","1.026","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215871","11.41","0.003","18.178","0.003","13.445","0.002","90","","106.57","0.02","90","","2672.8","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 Cd N6 S4 -","- C26 H24 Cd N6 S4 -","- C104 H96 Cd4 N24 S16 -","4","1","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Drew, Michael. G. B.; Singh, Nanhai","Influence of ligand environments on the structures and luminescence properties of homoleptic cadmium(ii) pyridyl functionalized dithiocarbamates","CrystEngComm","2014","16","29","6765","","10.1039/c4ce00510d","","","0.71073","MoKα","","0.0647","0.0404","","","0.0779","0.0859","","","","","","1.017","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215872","10.565","0.0005","9.85","0.0005","25.1585","0.0018","90","","90","","90","","2618.1","0.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H22 Cd N4 O2 S4 -","- C24 H22 Cd N4 O2 S4 -","- C96 H88 Cd4 N16 O8 S16 -","4","0.5","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Drew, Michael. G. B.; Singh, Nanhai","Influence of ligand environments on the structures and luminescence properties of homoleptic cadmium(ii) pyridyl functionalized dithiocarbamates","CrystEngComm","2014","16","29","6765","","10.1039/c4ce00510d","","","0.71073","MoKα","","0.0632","0.041","","","0.0817","0.0899","","","","","","1.077","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215873","11.4651","0.0009","12.8858","0.001","18.191","0.0011","90","","90","","90","","2687.5","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H22 Cd N4 S6 -","- C24 H22 Cd N4 S6 -","- C96 H88 Cd4 N16 S24 -","4","0.5","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Drew, Michael. G. B.; Singh, Nanhai","Influence of ligand environments on the structures and luminescence properties of homoleptic cadmium(ii) pyridyl functionalized dithiocarbamates","CrystEngComm","2014","16","29","6765","","10.1039/c4ce00510d","","","0.71073","MoKα","","0.0448","0.0346","","","0.0823","0.0868","","","","","","1.097","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215874","12.3203","0.0018","12.758","0.002","13.4692","0.0019","109.13","0.016","96.998","0.012","107.782","0.015","1845.8","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H70 Cd2 N14 O2 S8 -","- C70 H70 Cd2 N14 O2 S8 -","- C70 H70 Cd2 N14 O2 S8 -","1","0.5","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Drew, Michael. G. B.; Singh, Nanhai","Influence of ligand environments on the structures and luminescence properties of homoleptic cadmium(ii) pyridyl functionalized dithiocarbamates","CrystEngComm","2014","16","29","6765","","10.1039/c4ce00510d","","","0.71073","MoKα","","0.1033","0.0576","","","0.1452","0.1672","","","","","","0.998","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215875","12.2619","0.001","14.0531","0.0016","14.1351","0.0012","111.871","0.009","101.167","0.007","97.391","0.008","2163","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H84 Cd3 N6 O6 S12 -","- C84 H84 Cd3 N6 O6 S12 -","- C84 H84 Cd3 N6 O6 S12 -","1","0.5","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Drew, Michael. G. B.; Singh, Nanhai","Influence of ligand environments on the structures and luminescence properties of homoleptic cadmium(ii) pyridyl functionalized dithiocarbamates","CrystEngComm","2014","16","29","6765","","10.1039/c4ce00510d","","","0.71073","MoKα","","0.1264","0.0621","","","0.1534","0.1869","","","","","","0.954","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215880","5.5482","0.0002","12.026","0.0005","8.5725","0.0003","90","","104.639","0.0024","90","","553.41","0.04","298","2","298","2","","","","","","","Polymorph Screening","5","P 1 21 1","P 2yb","4","zalcitabine hydrochloride","2',3'-dideoxycytidine hydrochloride","","- C9 H14 Cl N3 O3 -","- C9 H14 Cl N3 O3 -","- C18 H28 Cl2 N6 O6 -","2","1","","Martins, Felipe Terra; Corrêa, Rodrigo S.; Batista, Alzir Azevedo; Ellena, Javier","Quasi-enantiomeric single-nucleoside and quasi-racemic two-nucleoside hydrochloride salts and ruthenium complexes of cytidine and 2′,3′-dideoxycytidine analogs unveiling the negligible structure-driving role of the 2′,3′-moieties","CrystEngComm","2014","16","30","7013","","10.1039/C4CE00678J","","x-ray","0.71073","MoKα","","0.044","0.0407","","","0.1048","0.1083","","","","","","1.074","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215881","5.4672","0.002","11.978","0.0029","8.5397","0.002","90","","105.327","0.0018","90","","539.3","0.3","100","2","100","2","","","","","","","Polymorph Screening","5","P 1 21 1","P 2yb","4","zalcitabine hydrochloride","2',3'-dideoxycytidine hydrochloride","","- C9 H14 Cl N3 O3 -","- C9 H14 Cl N3 O3 -","- C18 H28 Cl2 N6 O6 -","2","1","","Martins, Felipe Terra; Corrêa, Rodrigo S.; Batista, Alzir Azevedo; Ellena, Javier","Quasi-enantiomeric single-nucleoside and quasi-racemic two-nucleoside hydrochloride salts and ruthenium complexes of cytidine and 2′,3′-dideoxycytidine analogs unveiling the negligible structure-driving role of the 2′,3′-moieties","CrystEngComm","2014","16","30","7013","","10.1039/C4CE00678J","","x-ray","0.71073","MoKα","","0.0413","0.0403","","","0.1035","0.1053","","","","","","1.068","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215882","6.692","0.001","8.886","0.001","10.412","0.001","105.22","0.01","99.04","0.01","107.5","0.01","550.72","0.13","100","2","100","2","","","","","","","Polymorph Screening","6","P 1","P 1","1","lamivudine zalcitabine hydrochloride","4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-(1H)-pyrimidin-2-one hydrochloride 2',3'-dideoxycytidine hydrochloride co-crystal","","- C17 H26 Cl2 N6 O6 S -","- C17 H26 Cl2 N6 O6 S -","- C17 H26 Cl2 N6 O6 S -","1","1","","Martins, Felipe Terra; Corrêa, Rodrigo S.; Batista, Alzir Azevedo; Ellena, Javier","Quasi-enantiomeric single-nucleoside and quasi-racemic two-nucleoside hydrochloride salts and ruthenium complexes of cytidine and 2′,3′-dideoxycytidine analogs unveiling the negligible structure-driving role of the 2′,3′-moieties","CrystEngComm","2014","16","30","7013","","10.1039/C4CE00678J","","x-ray","0.71073","MoKα","","0.0792","0.0656","","","0.1453","0.1558","","","","","","1.099","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215883","9.8","0.005","16.008","0.005","34.268","0.005","90","","90","","90","","5376","3","293","2","293","2","","","","","","","synthesis as described","8","P 21 21 21","P 2ac 2ab","19","Compound X","","","- C57 H56 Cl N5 O9 P2 Ru S -","- C57 H56 Cl N5 O9 P2 Ru S -","- C228 H224 Cl4 N20 O36 P8 Ru4 S4 -","4","1","","Martins, Felipe Terra; Corrêa, Rodrigo S.; Batista, Alzir Azevedo; Ellena, Javier","Quasi-enantiomeric single-nucleoside and quasi-racemic two-nucleoside hydrochloride salts and ruthenium complexes of cytidine and 2′,3′-dideoxycytidine analogs unveiling the negligible structure-driving role of the 2′,3′-moieties","CrystEngComm","2014","16","30","7013","","10.1039/C4CE00678J","","x-ray","0.71073","MoKα","","0.1054","0.0692","","","0.1495","0.1655","","","","","","1.032","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215884","10.432","0.001","20.6","0.003","27.012","0.005","90","","98.2","0.05","90","","5745.5","1.6","293","2","293","2","","","","","","","synthesis as described","7","P 1 21 1","P 2yb","4","ctd_cwbpy","","","- C114.5 H115 Cl2 N10 O21 P4 Ru2 -","- C114.5 H115 Cl2 N10 O21 P4 Ru2 -","- C229 H230 Cl4 N20 O42 P8 Ru4 -","2","1","","Martins, Felipe Terra; Corrêa, Rodrigo S.; Batista, Alzir Azevedo; Ellena, Javier","Quasi-enantiomeric single-nucleoside and quasi-racemic two-nucleoside hydrochloride salts and ruthenium complexes of cytidine and 2′,3′-dideoxycytidine analogs unveiling the negligible structure-driving role of the 2′,3′-moieties","CrystEngComm","2014","16","30","7013","","10.1039/C4CE00678J","","x-ray","0.71073","MoKα","","0.0767","0.0469","","","0.108","0.1184","","","","","","1.001","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215885","15.0914","0.0002","16.7363","0.0003","13.0708","0.0003","90","","90","","90","","3301.35","0.11","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C30 H35 N6 O13 Tb -","- C30 H35 N6 O13 Tb -","- C120 H140 N24 O52 Tb4 -","4","1","","Yang, Qing-Yuan; Pan, Mei; Wei, Shi-Chao; Hsu, Chien-Wei; Lehn, Jean-Marie; Su, Cheng-Yong","Photoluminescent 3D lanthanide MOFs with a rare (10,3)-d net based on a new tripodal organic linker","CrystEngComm","2014","16","28","6469","","10.1039/c4ce00586d","","","1.54178","CuKα","","0.0354","0.0297","","","0.0655","0.0666","","","","","","1.052","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215886","15.1122","0.0002","16.7251","0.0002","13.2575","0.0002","90","","90","","90","","3350.87","0.08","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C30 H35 Ce N6 O13 -","- C30 H35 Ce N6 O13 -","- C120 H140 Ce4 N24 O52 -","4","1","","Yang, Qing-Yuan; Pan, Mei; Wei, Shi-Chao; Hsu, Chien-Wei; Lehn, Jean-Marie; Su, Cheng-Yong","Photoluminescent 3D lanthanide MOFs with a rare (10,3)-d net based on a new tripodal organic linker","CrystEngComm","2014","16","28","6469","","10.1039/c4ce00586d","","","1.54178","CuKα","","0.0318","0.0289","","","0.0683","0.0692","","","","","","0.997","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215887","5.05836","0.00011","7.1121","0.0003","45.2723","0.0017","90","","90","","90","","1628.7","0.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","S-naproxen L-alanine","(+)-(S)-2-(6-methoxynaphthalen-2-yl) propanoic acid (S)-2-Aminopropionic acid","","- C17 H21 N O5 -","- C17 H21 N O5 -","- C68 H84 N4 O20 -","4","1","","Tumanova, Natalia; Tumanov, Nikolay; Robeyns, Koen; Filinchuk, Yaroslav; Wouters, Johan; Leyssens, Tom","Structural insight into cocrystallization with zwitterionic co-formers: cocrystals of S-naproxen","CrystEngComm","2014","16","35","8185","","10.1039/C4CE00353E","","x-ray","0.68239","","","0.0512","0.05","","","0.1338","0.1349","","","","","","1.096","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215888","5.3366","0.0004","6.9013","0.0006","44.227","0.004","90","","90","","90","","1628.9","0.2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","S-naproxen D-alanine","(+)-(S)-2-(6-methoxynaphthalen-2-yl) propanoic acid (R)-2-Aminopropionic acid","","- C17 H21 N O5 -","- C17 H21 N O5 -","- C68 H84 N4 O20 -","4","1","","Tumanova, Natalia; Tumanov, Nikolay; Robeyns, Koen; Filinchuk, Yaroslav; Wouters, Johan; Leyssens, Tom","Structural insight into cocrystallization with zwitterionic co-formers: cocrystals of S-naproxen","CrystEngComm","2014","16","35","8185","","10.1039/C4CE00353E","","x-ray","0.71073","MoKα","","0.1001","0.0833","","","0.2141","0.2249","","","","","","1.139","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215889","5.88418","0.00016","11.3844","0.0003","34.6863","0.0009","90","","90","","90","","2323.56","0.11","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","S-naproxen D-tryptophan monohydrate","(+)-(S)-2-(6-methoxynaphthalen-2-yl) propanoic acid (2R)-2-amino-3-(1H-indol-3-yl)propanoic acid monohydrate","","- C25 H28 N2 O6 -","- C25 H28 N2 O6 -","- C100 H112 N8 O24 -","4","1","","Tumanova, Natalia; Tumanov, Nikolay; Robeyns, Koen; Filinchuk, Yaroslav; Wouters, Johan; Leyssens, Tom","Structural insight into cocrystallization with zwitterionic co-formers: cocrystals of S-naproxen","CrystEngComm","2014","16","35","8185","","10.1039/C4CE00353E","","x-ray","0.71073","MoKα","","0.0688","0.046","","","0.0901","0.0992","","","","","","1.033","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215890","9.4508","0.0004","5.9725","0.0002","18.9525","0.0007","90","","103.814","0.002","90","","1038.83","0.07","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","S-naproxen D-tyrosine","(+)-(S)-2-(6-methoxynaphthalen-2-yl)propanoic acid (R)-2-Amino-3-(4-hydroxyphenyl)propanoic acid","","- C23 H25 N O6 -","- C23 H25 N O6 -","- C46 H50 N2 O12 -","2","1","","Tumanova, Natalia; Tumanov, Nikolay; Robeyns, Koen; Filinchuk, Yaroslav; Wouters, Johan; Leyssens, Tom","Structural insight into cocrystallization with zwitterionic co-formers: cocrystals of S-naproxen","CrystEngComm","2014","16","35","8185","","10.1039/C4CE00353E","powder diffraction","x-ray","0.823065","","","","","","","","","","8.9902","32.9759","","","","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215891","7.339","0.005","3.915","0.003","22.078","0.014","90","","99.08","0.009","90","","626.4","0.8","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H6 Br2 S2 -","- C14 H6 Br2 S2 -","- C28 H12 Br4 S4 -","2","0.5","","Vyas, Vijay S.; Gutzler, Rico; Nuss, Jürgen; Kern, Klaus; Lotsch, Bettina V.","Optical gap in herringbone and π-stacked crystals of [1]benzothieno[3,2-b]benzothiophene and its brominated derivative","CrystEngComm","2014","16","32","7389","","10.1039/C4CE00752B","","x-ray","0.71073","MoKα","","0.0966","0.092","","","0.2529","0.2555","","","","","","1.187","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215892","11.8009","0.0018","5.8622","0.0009","7.9331","0.0012","90","","105.974","0.003","90","","527.61","0.14","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 S2 -","- C14 H8 S2 -","- C28 H16 S4 -","2","0.5","","Vyas, Vijay S.; Gutzler, Rico; Nuss, Jürgen; Kern, Klaus; Lotsch, Bettina V.","Optical gap in herringbone and π-stacked crystals of [1]benzothieno[3,2-b]benzothiophene and its brominated derivative","CrystEngComm","2014","16","32","7389","","10.1039/C4CE00752B","","x-ray","0.71073","MoKα","","0.0298","0.0263","","","0.0717","0.0745","","","","","","1.087","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215893","9.615","0.0003","21.122","0.0009","13.152","0.0004","90","","91.126","0.003","90","","2670.5","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 Cd3 N14 O12 -","- C40 H52 Cd3 N14 O12 -","- C80 H104 Cd6 N28 O24 -","2","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Ma, Jian-Fang; Liu, Ying-Ying","Tuning the void volume in a series of isomorphic porous metal‒organic frameworks by varying the solvent size and length of organic ligands","CrystEngComm","2014","16","24","5450","","10.1039/c4ce00347k","","","0.71069","MoKα","","0.0569","0.0482","","","0.1681","0.1783","","","","","","1.005","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215894","9.628","0.0004","21.337","0.0007","13.208","0.0004","90","","91.953","0.003","90","","2711.78","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H52 Cd3 N14 O12 -","- C44 H34 Cd3 N14 O12 -","- C88 H68 Cd6 N28 O24 -","2","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Ma, Jian-Fang; Liu, Ying-Ying","Tuning the void volume in a series of isomorphic porous metal‒organic frameworks by varying the solvent size and length of organic ligands","CrystEngComm","2014","16","24","5450","","10.1039/c4ce00347k","","","0.71069","MoKα","","0.0445","0.0356","","","0.0792","0.085","","","","","","1.08","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215895","9.638","0.0012","15.443","0.0015","18.717","0.0016","90","","90","","90","","2785.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 Cd3 N18 O12 -","- C44 H56 Cd3 N18 O12 -","- C88 H112 Cd6 N36 O24 -","2","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Ma, Jian-Fang; Liu, Ying-Ying","Tuning the void volume in a series of isomorphic porous metal‒organic frameworks by varying the solvent size and length of organic ligands","CrystEngComm","2014","16","24","5450","","10.1039/c4ce00347k","","","0.71069","MoKα","","0.0624","0.0427","","","0.0853","0.0953","","","","","","1.007","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215896","10.974","0.0005","22.669","0.0013","14.106","0.0007","90","","96.637","0.004","90","","3485.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H72 Cd3 N32 O7 -","- C48 H72 Cd3 N32 O7 -","- C96 H144 Cd6 N64 O14 -","2","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Ma, Jian-Fang; Liu, Ying-Ying","Tuning the void volume in a series of isomorphic porous metal‒organic frameworks by varying the solvent size and length of organic ligands","CrystEngComm","2014","16","24","5450","","10.1039/c4ce00347k","","","0.71069","MoKα","","0.118","0.0599","","","0.1079","0.1343","","","","","","1.027","","","","has coordinates,has disorder","180489","2020-10-21","18:00:00",""
"7215897","11.029","0.0004","22.762","0.0007","14.48","0.0004","90","","97.147","0.003","90","","3606.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H72 Cd3 N32 O7 -","- C54 H70 Cd3 N32 O7 -","- C108 H140 Cd6 N64 O14 -","2","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Ma, Jian-Fang; Liu, Ying-Ying","Tuning the void volume in a series of isomorphic porous metal‒organic frameworks by varying the solvent size and length of organic ligands","CrystEngComm","2014","16","24","5450","","10.1039/c4ce00347k","","","0.71069","MoKα","","0.0808","0.0457","","","0.0877","0.1053","","","","","","1.051","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215898","11.054","0.0005","22.723","0.001","14.666","0.0007","90","","96.8","0.004","90","","3657.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H76 Cd3 N38 O6 -","- C54 H76 Cd3 N38 O6 -","- C108 H152 Cd6 N76 O12 -","2","0.5","","He, Yuan-Chun; Guo, Jiao; Zhang, Hong-Mei; Ma, Jian-Fang; Liu, Ying-Ying","Tuning the void volume in a series of isomorphic porous metal‒organic frameworks by varying the solvent size and length of organic ligands","CrystEngComm","2014","16","24","5450","","10.1039/c4ce00347k","","","0.71069","MoKα","","0.0506","0.0375","","","0.08","0.0877","","","","","","1.041","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215899","26.674","0.002","26.674","0.002","18.4694","0.002","90","","90","","120","","11380.5","1.7","100","2","100","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C10 H7 Co N5 O2 -","- C10 H7 Co N5 O2 -","- C240 H168 Co24 N120 O48 -","24","1","","Panda, Tamas; Gupta, Krishna M.; Jiang, Jianwen; Banerjee, Rahul","Enhancement of CO2 uptake in iso-reticular Co based zeolitic imidazolate frameworks via metal replacement","CrystEngComm","2014","16","22","4677","","10.1039/c3ce42075b","","","0.71073","MoKα","","0.163","0.0992","","","0.2938","0.33","","","","","","0.884","","","","has coordinates","180489","2020-10-21","18:00:00",""
"7215900","26.113","0.002","26.113","0.002","19.6459","0.0014","90","","90","","120","","11601.6","1.5","100","2","100","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- C10 H5 Cl2 Co N5 O2 -","- C10 H5 Cl2 Co N5 O2 -","- C240 H120 Cl48 Co24 N120 O48 -","24","1","","Panda, Tamas; Gupta, Krishna M.; Jiang, Jianwen; Banerjee, Rahul","Enhancement of CO2 uptake in iso-reticular Co based zeolitic imidazolate frameworks via metal replacement","CrystEngComm","2014","16","22","4677","","10.1039/c3ce42075b","","","0.71073","MoKα","","0.1765","0.0997","","","0.2862","0.334","","","","","","0.979","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215901","25.9949","0.0012","25.9949","0.0012","19.7757","0.0011","90","","90","","120","","11572.8","1","100","2","100","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- C10 H5 Br2 Co N5 O2 -","- C10 H5 Br2 Co N5 O2 -","- C240 H120 Br48 Co24 N120 O48 -","24","1","","Panda, Tamas; Gupta, Krishna M.; Jiang, Jianwen; Banerjee, Rahul","Enhancement of CO2 uptake in iso-reticular Co based zeolitic imidazolate frameworks via metal replacement","CrystEngComm","2014","16","22","4677","","10.1039/c3ce42075b","","","0.71073","MoKα","","0.1975","0.0995","","","0.2545","0.3115","","","","","","0.702","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215902","16.963","0.003","13.596","0.002","12.654","0.002","90","","106.632","0.002","90","","2796.3","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H15 F15 N4 O3 -","- C27 H15 F15 N4 O3 -","- C108 H60 F60 N16 O12 -","4","1","","Saha, Subrata; Akhuli, Bidyut; Ravikumar, I.; Lakshminarayanan, P. S.; Ghosh, Pradyut","Recognition of fluoride in fluorophenyl attached tripodal amide receptors: structural evidence of solvent capped encapsulation of anion in a C3v-symmetric tripodal cleft","CrystEngComm","2014","16","22","4796","","10.1039/c3ce42440e","","","0.71073","MoKα","","0.0599","0.0359","","","0.0846","0.0973","","","","","","1.021","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215903","10.891","0.0017","17.196","0.003","14.431","0.002","90","","103.322","0.004","90","","2629.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H18 F12 N4 O3 -","- C27 H18 F12 N4 O3 -","- C108 H72 F48 N16 O12 -","4","1","","Saha, Subrata; Akhuli, Bidyut; Ravikumar, I.; Lakshminarayanan, P. S.; Ghosh, Pradyut","Recognition of fluoride in fluorophenyl attached tripodal amide receptors: structural evidence of solvent capped encapsulation of anion in a C3v-symmetric tripodal cleft","CrystEngComm","2014","16","22","4796","","10.1039/c3ce42440e","","","0.71073","MoKα","","0.0533","0.0391","","","0.1005","0.1123","","","","","","1.012","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215904","11.8227","0.0009","13.8754","0.001","15.4686","0.0011","86.231","0.001","76.249","0.001","86.874","0.001","2457.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H52 Cl3 F16 N5 O3 -","- C44 H52 Cl3 F16 N5 O3 -","- C88 H104 Cl6 F32 N10 O6 -","2","1","","Saha, Subrata; Akhuli, Bidyut; Ravikumar, I.; Lakshminarayanan, P. S.; Ghosh, Pradyut","Recognition of fluoride in fluorophenyl attached tripodal amide receptors: structural evidence of solvent capped encapsulation of anion in a C3v-symmetric tripodal cleft","CrystEngComm","2014","16","22","4796","","10.1039/c3ce42440e","","","0.71073","MoKα","","0.0612","0.039","","","0.0866","0.0974","","","","","","1.025","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215905","14.4149","0.0008","16.8287","0.001","22.6106","0.0012","90","","101.373","0.002","90","","5377.3","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H52 Cl4 F15 N5 O3 -","- C44 H52 Cl4 F15 N5 O3 -","- C176 H208 Cl16 F60 N20 O12 -","4","1","","Saha, Subrata; Akhuli, Bidyut; Ravikumar, I.; Lakshminarayanan, P. S.; Ghosh, Pradyut","Recognition of fluoride in fluorophenyl attached tripodal amide receptors: structural evidence of solvent capped encapsulation of anion in a C3v-symmetric tripodal cleft","CrystEngComm","2014","16","22","4796","","10.1039/c3ce42440e","","","0.71073","MoKα","","0.1168","0.0987","","","0.2871","0.3073","","","","","","1.009","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215906","8.053","0.0003","9.722","0.0004","16.051","0.0004","90","","96.788","0.002","90","","1247.84","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 N6 O6 Pd S2 -","- C22 H16 N6 O6 Pd S2 -","- C44 H32 N12 O12 Pd2 S4 -","2","0.5","","Pérez, José; Serrano, J. Luis; da Silva, Ivan; Espinosa, Arturo; Pérez, Eduardo; García, Luis","Ligand hierarchy on driving the crystal packing. Effect of supramolecular interactions on solid-state conformations adopted by saccharinate Pd(ii) complexes","CrystEngComm","2014","16","30","7124","","10.1039/C4CE00518J","","","0.71073","MoKα","","0.0772","0.0397","","","0.1023","0.1269","","","","","","1.041","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215907","8.3977","0.0014","11.2186","0.0018","12.207","0.002","90","","108.288","0.005","90","","1091.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C9 H10 N O3 Pd0.5 S2 -","- C9 H10 N O3 Pd0.5 S2 -","- C36 H40 N4 O12 Pd2 S8 -","4","1","","Pérez, José; Serrano, J. Luis; da Silva, Ivan; Espinosa, Arturo; Pérez, Eduardo; García, Luis","Ligand hierarchy on driving the crystal packing. Effect of supramolecular interactions on solid-state conformations adopted by saccharinate Pd(ii) complexes","CrystEngComm","2014","16","30","7124","","10.1039/C4CE00518J","","","0.71073","MoKα","","0.0606","0.0567","","","0.1692","0.1752","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215908","22.245","0.002","13.6954","0.0014","7.5899","0.0008","90","","90","","90","","2312.3","0.4","293","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C18 H22 N2 O8 Pd S4 -","- C18 H22 N2 O8 Pd S4 -","- C72 H88 N8 O32 Pd4 S16 -","4","0.5","","Pérez, José; Serrano, J. Luis; da Silva, Ivan; Espinosa, Arturo; Pérez, Eduardo; García, Luis","Ligand hierarchy on driving the crystal packing. Effect of supramolecular interactions on solid-state conformations adopted by saccharinate Pd(ii) complexes","CrystEngComm","2014","16","30","7124","","10.1039/C4CE00518J","","","0.71073","MoKα","","0.0418","0.0396","","","0.0993","0.1004","","","","","","1.065","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215909","12.03223","0.00012","14.00604","0.00015","9.78155","0.0001","90","","110.872","0.0013","90","","1540.25","0.03","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N6 O8 Pd S2 -","- C26 H20 N6 O8 Pd S2 -","- C52 H40 N12 O16 Pd2 S4 -","2","0.5","","Pérez, José; Serrano, J. Luis; da Silva, Ivan; Espinosa, Arturo; Pérez, Eduardo; García, Luis","Ligand hierarchy on driving the crystal packing. Effect of supramolecular interactions on solid-state conformations adopted by saccharinate Pd(ii) complexes","CrystEngComm","2014","16","30","7124","","10.1039/C4CE00518J","powder diffraction","","0.8269","synchrotron","","","","","","","","","3.7832","2.6442","","","","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215910","9.67234","0.0001","14.37138","0.00015","8.18547","0.0001","90","","92.7327","0.0001","90","","1136.53","0.02","298","","298","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C20 H20 N6 O6 Pd -","- C20 H20 N6 O6 Pd -","- C40 H40 N12 O12 Pd2 -","2","0.5","","Pérez, José; Serrano, J. Luis; da Silva, Ivan; Espinosa, Arturo; Pérez, Eduardo; García, Luis","Ligand hierarchy on driving the crystal packing. Effect of supramolecular interactions on solid-state conformations adopted by saccharinate Pd(ii) complexes","CrystEngComm","2014","16","30","7124","","10.1039/C4CE00518J","powder diffraction","","0.8269","synchrotron","","","","","","","","","4.3496","2.5756","","","","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215911","16.24","0.0007","13.6625","0.0005","14.8867","0.0007","90","","111.728","0.005","90","","3068.4","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22.5 H30.5 Ag2 Fe N8.5 O3 -","- C20 H20 Ag2 Fe N8 -","- C80 H80 Ag8 Fe4 N32 -","4","0.5","","Li, Jin-Yan; Ni, Zhao-Ping; Yan, Zheng; Zhang, Ze-Min; Chen, Yan-Cong; Liu, Wei; Tong, Ming-Liang","Cyanide-bridged bimetallic 3D Hoffman-like coordination polymers with tunable magnetic behaviour","CrystEngComm","2014","16","28","6444","","10.1039/c4ce00342j","","","1.54178","CuKα","","0.0484","0.0448","","","0.1139","0.1162","","","","","","1.075","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215912","16.3171","0.0009","13.8577","0.0005","14.8466","0.0009","90","","111.744","0.006","90","","3118.2","0.3","225","2","225","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22.5 H30.5 Ag2 Fe N8.5 O3 -","- C20 H20 Ag2 Fe N8 -","- C80 H80 Ag8 Fe4 N32 -","4","0.5","","Li, Jin-Yan; Ni, Zhao-Ping; Yan, Zheng; Zhang, Ze-Min; Chen, Yan-Cong; Liu, Wei; Tong, Ming-Liang","Cyanide-bridged bimetallic 3D Hoffman-like coordination polymers with tunable magnetic behaviour","CrystEngComm","2014","16","28","6444","","10.1039/c4ce00342j","","","1.54178","CuKα","","0.0586","0.0528","","","0.1419","0.1476","","","","","","1.071","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215913","16.622","0.002","13.9014","0.001","15.434","0.003","90","","112.586","0.017","90","","3292.8","0.9","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22.5 H30.5 Ag2 Fe N8.5 O3 -","- C20 H20 Ag2 Fe N8 -","- C80 H80 Ag8 Fe4 N32 -","4","0.5","","Li, Jin-Yan; Ni, Zhao-Ping; Yan, Zheng; Zhang, Ze-Min; Chen, Yan-Cong; Liu, Wei; Tong, Ming-Liang","Cyanide-bridged bimetallic 3D Hoffman-like coordination polymers with tunable magnetic behaviour","CrystEngComm","2014","16","28","6444","","10.1039/c4ce00342j","","","1.54178","CuKα","","0.0828","0.0682","","","0.1835","0.1961","","","","","","1.138","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215914","16.4515","0.0008","14.2025","0.0007","14.2637","0.0007","90","","112.084","0.001","90","","3088.2","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 Au2 Fe N9 O2.5 -","- C20 H20 Au2 Fe N8 -","- C80 H80 Au8 Fe4 N32 -","4","0.5","","Li, Jin-Yan; Ni, Zhao-Ping; Yan, Zheng; Zhang, Ze-Min; Chen, Yan-Cong; Liu, Wei; Tong, Ming-Liang","Cyanide-bridged bimetallic 3D Hoffman-like coordination polymers with tunable magnetic behaviour","CrystEngComm","2014","16","28","6444","","10.1039/c4ce00342j","","","0.71073","MoKα","","0.052","0.0434","","","0.0971","0.1023","","","","","","1.102","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215915","16.7493","0.0016","14.8047","0.0014","14.5137","0.0012","90","","113.493","0.003","90","","3300.6","0.5","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 Au2 Fe N9 O2.5 -","- C20 H20 Au2 Fe N8 -","- C80 H80 Au8 Fe4 N32 -","4","0.5","","Li, Jin-Yan; Ni, Zhao-Ping; Yan, Zheng; Zhang, Ze-Min; Chen, Yan-Cong; Liu, Wei; Tong, Ming-Liang","Cyanide-bridged bimetallic 3D Hoffman-like coordination polymers with tunable magnetic behaviour","CrystEngComm","2014","16","28","6444","","10.1039/c4ce00342j","","","0.71073","MoKα","","0.0972","0.066","","","0.1731","0.1921","","","","","","1.125","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7215916","11.5168","0.0011","10.1374","0.0008","9.6121","0.0009","90","","103.266","0.003","90","","1092.27","0.17","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Fe N8 Ni -","- C20 H20 Fe N8 Ni -","- C40 H40 Fe2 N16 Ni2 -","2","0.5","","Li, Jin-Yan; Ni, Zhao-Ping; Yan, Zheng; Zhang, Ze-Min; Chen, Yan-Cong; Liu, Wei; Tong, Ming-Liang","Cyanide-bridged bimetallic 3D Hoffman-like coordination polymers with tunable magnetic behaviour","CrystEngComm","2014","16","28","6444","","10.1039/c4ce00342j","","","0.71073","MoKα","","0.0701","0.0396","","","0.0846","0.0989","","","","","","0.982","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215917","15.7239","0.0019","16.158","0.002","40.866","0.01","90","","90","","90","","10383","3","296","2","296","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C15 H11 Co N2 O6 S2 -","- C15 H11 Co N2 O6 S2 -","- C240 H176 Co16 N32 O96 S32 -","16","0.5","","Sanda, Suresh; Goswami, Soumyabrata; Jena, Himanshu Sekhar; Parshamoni, Srinivasulu; Konar, Sanjit","A family of three magnetic metal organic frameworks: their synthesis, structural, magnetic and vapour adsorption study","CrystEngComm","2014","16","22","4742","","10.1039/c3ce42451k","","","0.71073","MoKα","","0.0848","0.0846","","","0.2473","0.2475","","","","","","1.117","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215918","8.315","0.002","10.205","0.003","20.279","0.005","90","","113.12","0.012","90","","1582.6","0.7","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H18 Cu N4 O10 S4 -","- C30 H18 Cu N4 O10 S4 -","- C60 H36 Cu2 N8 O20 S8 -","2","0.5","","Sanda, Suresh; Goswami, Soumyabrata; Jena, Himanshu Sekhar; Parshamoni, Srinivasulu; Konar, Sanjit","A family of three magnetic metal organic frameworks: their synthesis, structural, magnetic and vapour adsorption study","CrystEngComm","2014","16","22","4742","","10.1039/c3ce42451k","","","0.71073","MoKα","","0.0582","0.0567","","","0.1696","0.1713","","","","","","1.009","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215919","15.8979","0.0012","15.7892","0.0012","20.3288","0.0016","90","","106.324","0.008","90","","4897.1","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H18 N4 Ni2 O25 S4 -","- C34 H18 N4 Ni2 O25 S4 -","- C136 H72 N16 Ni8 O100 S16 -","4","0.5","","Sanda, Suresh; Goswami, Soumyabrata; Jena, Himanshu Sekhar; Parshamoni, Srinivasulu; Konar, Sanjit","A family of three magnetic metal organic frameworks: their synthesis, structural, magnetic and vapour adsorption study","CrystEngComm","2014","16","22","4742","","10.1039/c3ce42451k","","","0.71073","MoKα","","0.1013","0.0931","","","0.2556","0.2606","","","","","","1.162","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215920","6.0904","0.0015","10.3943","0.0015","13.5423","0.0019","73.19","0.05","79.7","0.05","78.31","0.06","797","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Cytosine tribromoacetate","","","- C10 Br3 N6 O4 -","- C10 Br3 N6 O4 -","- C20 Br6 N12 O8 -","2","1","","Chakraborty, Shaunak; Ganguly, Somnath; Desiraju, Gautam R.","Synthon transferability probed with IR spectroscopy: cytosine salts as models for salts of lamivudine","CrystEngComm","2014","16","22","4732","","10.1039/c3ce42156b","","","0.71073","MoKα","","0.0841","0.0703","","","0.1747","0.2127","","","","","","1.189","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215921","12.8936","0.0011","6.6821","0.0005","17.1763","0.0013","90","","108.031","0.002","90","","1407.17","0.19","296","2","296","2","","","","","","","","4","P 1 2 1","P 2y","3","","","","- C10 N3 O7.5 S -","- C10 N3 O7.5 S -","- C40 N12 O30 S4 -","4","2","","Chakraborty, Shaunak; Ganguly, Somnath; Desiraju, Gautam R.","Synthon transferability probed with IR spectroscopy: cytosine salts as models for salts of lamivudine","CrystEngComm","2014","16","22","4732","","10.1039/c3ce42156b","","","0.71073","MoKα","","0.1282","0.1174","","","0.3467","0.3622","","","","","","1.687","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215922","6.7021","0.0015","9.134","0.002","37.734","0.01","90","","90","","90","","2310","0.9","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 N6 O10 S2 -","- C18 H24 N6 O10 S2 -","- C72 H96 N24 O40 S8 -","4","1","","Chakraborty, Shaunak; Ganguly, Somnath; Desiraju, Gautam R.","Synthon transferability probed with IR spectroscopy: cytosine salts as models for salts of lamivudine","CrystEngComm","2014","16","22","4732","","10.1039/c3ce42156b","","","0.71073","MoKα","","0.0672","0.0588","","","0.1465","0.1631","","","","","","1.092","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215923","6.944","0.0007","28.891","0.003","6.9559","0.0008","90","","95.357","0.004","90","","1389.4","0.3","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H34 N6 O10 S2 -","- C23 H34 N6 O10 S2 -","- C46 H68 N12 O20 S4 -","2","1","","Chakraborty, Shaunak; Ganguly, Somnath; Desiraju, Gautam R.","Synthon transferability probed with IR spectroscopy: cytosine salts as models for salts of lamivudine","CrystEngComm","2014","16","22","4732","","10.1039/c3ce42156b","","","0.71073","MoKα","","0.0452","0.0412","","","0.1043","0.1176","","","","","","1.105","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215924","8.3066","0.0004","9.3439","0.0004","11.7372","0.0005","79.248","0.002","70.499","0.002","75.926","0.002","827.41","0.07","296","2","296","2","","","","","","","","4","P -1","-P 1","2","Pr_mal_fumarate","","","- C10 H14 O15 Pr2 -","- C10 H14 O15 Pr2 -","- C20 H28 O30 Pr4 -","2","1","","Sushrutha, S. R.; Natarajan, Srinivasan","Rare-earth carboxylates, [Ln2(iii)(μ3-OH)(C4H4O5)2(C4H2O4)]·2H2O [Ln = Ce, Pr and Nd]: synthesis, structure and properties","CrystEngComm","2014","16","22","4774","","10.1039/c3ce42311e","","","0.71073","MoKα","","0.0315","0.0276","","","0.0763","0.0792","","","","","","1.065","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215925","8.2557","0.0005","9.3918","0.0006","11.6162","0.0008","80.241","0.006","70.487","0.006","75.339","0.005","817.73","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","pr_mal_fumarate_ht","","","- C10 H9 O13 Pr2 -","- C10 H9 O13 Pr2 -","- C20 H18 O26 Pr4 -","2","1","","Sushrutha, S. R.; Natarajan, Srinivasan","Rare-earth carboxylates, [Ln2(iii)(μ3-OH)(C4H4O5)2(C4H2O4)]·2H2O [Ln = Ce, Pr and Nd]: synthesis, structure and properties","CrystEngComm","2014","16","22","4774","","10.1039/c3ce42311e","","","0.71073","MoKα","","0.0365","0.0314","","","0.078","0.0823","","","","","","1.028","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215926","8.2494","0.0004","9.311","0.0004","11.6959","0.0006","79.306","0.004","70.324","0.004","76.048","0.004","815.58","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Nd_mal_fumarate","","","- C10 H10 Nd2 O15 -","- C10 H10 Nd2 O15 -","- C20 H20 Nd4 O30 -","2","1","","Sushrutha, S. R.; Natarajan, Srinivasan","Rare-earth carboxylates, [Ln2(iii)(μ3-OH)(C4H4O5)2(C4H2O4)]·2H2O [Ln = Ce, Pr and Nd]: synthesis, structure and properties","CrystEngComm","2014","16","22","4774","","10.1039/c3ce42311e","","","0.71073","MoKα","","0.0278","0.0243","","","0.0578","0.06","","","","","","1.021","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215927","7.341","0.0005","7.4478","0.0004","24.44","0.003","96.237","0.007","90.714","0.007","103.836","0.005","1288.8","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","TBPO.4-nitrobenzoic acid","","","- C27 H24 N4 O9 -","- C27 H24 N4 O9 -","- C54 H48 N8 O18 -","2","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.154","0.0569","","","0.1024","0.1421","","","","","","0.972","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215928","15.3106","0.0011","11.2938","0.0007","14.6971","0.0007","90","","99.163","0.006","90","","2508.9","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H24 N4 O5 -","- C29 H24 N4 O5 -","- C116 H96 N16 O20 -","4","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.71073","MoKα","","0.1305","0.0551","","","0.1218","0.1584","","","","","","0.997","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215929","6.2766","0.0009","7.8957","0.0013","17.992","0.003","100.669","0.013","93.653","0.012","95.958","0.013","868.4","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","TBPO.4-hydroxybenzoic acid","","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C40 H40 N4 O8 -","2","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.1378","0.0728","","","0.1627","0.2071","","","","","","0.995","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215930","7.3004","0.0009","10.1353","0.0013","20.884","0.002","99.943","0.009","90.989","0.009","108.782","0.012","1436.6","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","BPO.alpha-cyanocoumaric acid","","","- C33 H28 N4 O7 -","- C33 H28 N4 O7 -","- C66 H56 N8 O14 -","2","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.1791","0.1181","","","0.3032","0.3593","","","","","","1.061","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215931","6.4902","0.0017","7.288","0.002","16.056","0.003","88.34","0.02","78.438","0.019","73.56","0.03","713.3","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","BPO.4-hydroxybenzoic acid","","","- C17 H14 N2 O4 -","- C17 H14 N2 O4 -","- C34 H28 N4 O8 -","2","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.1789","0.0616","","","0.1182","0.1693","","","","","","0.972","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215932","13.3286","0.0004","10.7445","0.0003","12.3344","0.0004","90","","102.018","0.003","90","","1727.68","0.09","298","2","298","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C20 H15 N3 O4 -","- C20 H15 N3 O4 -","- C80 H60 N12 O16 -","4","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.037","0.0338","","","0.0851","0.0883","","","","","","1.035","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215933","6.8052","0.0004","9.9004","0.0007","12.1414","0.001","111.542","0.007","93.418","0.006","98.055","0.006","747.87","0.1","150","","150","","","","","","","","","4","P -1","-P 1","2","BPO.4-hydroxybenzoic acid.H2O","","","- C17 H16 N2 O5 -","- C17 H16 N2 O5 -","- C34 H32 N4 O10 -","2","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.0458","0.0379","","","0.0935","0.1003","","","","","","1.061","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215934","7.6894","0.0005","19.34","0.001","10.691","0.0006","90","","101.843","0.005","90","","1556.05","0.16","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BPO.p-coumaric acid","","","- C19 H16 N2 O4 -","- C19 H16 N2 O4 -","- C76 H64 N8 O16 -","4","1","","Saraswatula, Viswanadha G.; Bhat, Mukhtar A.; Gurunathan, Pradeep Kumar; Saha, Binoy K.","Comparison of pyridyl and pyridyl N-oxide groups as acceptor in hydrogen bonding with carboxylic acid","CrystEngComm","2014","16","22","4715","","10.1039/c3ce42449a","","","0.7107","MoKα","","0.0841","0.0462","","","0.0945","0.1104","","","","","","1.036","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215935","22.305","0.002","12.0112","0.0012","15.3336","0.0015","90","","100.953","0.002","90","","4033.2","0.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","chlorodimethyl sulfonylhydrazone","chlorodimethyl sulfonylhydrazone","","- C21 H19 Cl N2 O2 S -","- C21 H19 Cl N2 O2 S -","- C168 H152 Cl8 N16 O16 S8 -","8","1","","Thakuria, Ranjit; Nath, Naba K.; Roy, Saikat; Nangia, Ashwini","Polymorphism and isostructurality in sulfonylhydrazones","CrystEngComm","2014","16","22","4681","","10.1039/c3ce42301h","","","0.71073","MoKα","","0.0663","0.0514","","","0.127","0.136","","","","","","1.039","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215936","11.726","0.005","15.488","0.007","22.317","0.01","90","","90","","90","","4053","3","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","chlorodimethyl sulfonylhydrazone","chlorodimethyl sulfonylhydrazone","","- C21 H19 Cl N2 O2 S -","- C21 H19 Cl N2 O2 S -","- C168 H152 Cl8 N16 O16 S8 -","8","1","","Thakuria, Ranjit; Nath, Naba K.; Roy, Saikat; Nangia, Ashwini","Polymorphism and isostructurality in sulfonylhydrazones","CrystEngComm","2014","16","22","4681","","10.1039/c3ce42301h","","","0.71073","MoKα","","0.0631","0.0451","","","0.1141","0.1268","","","","","","1.05","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215937","11.939","0.002","15.261","0.003","21.322","0.004","90","","90","","90","","3884.9","1.2","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","fluorodimethyl sulfonylhydrazone","fluorodimethyl sulfonylhydrazone","","- C21 H19 F N2 O2 S -","- C21 H19 F N2 O2 S -","- C168 H152 F8 N16 O16 S8 -","8","1","","Thakuria, Ranjit; Nath, Naba K.; Roy, Saikat; Nangia, Ashwini","Polymorphism and isostructurality in sulfonylhydrazones","CrystEngComm","2014","16","22","4681","","10.1039/c3ce42301h","","","0.71073","MoKα","","0.055","0.0428","","","0.1138","0.1233","","","","","","1.048","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215938","11.6335","0.0016","11.6089","0.0016","15.843","0.002","90","","96.67","0.002","90","","2125.1","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","methyldiiodo sulfonylhydrazone","methyldiiodo sulfonylhydrazone","","- C20 H16 I2 N2 O2 S -","- C20 H16 I2 N2 O2 S -","- C80 H64 I8 N8 O8 S4 -","4","1","","Thakuria, Ranjit; Nath, Naba K.; Roy, Saikat; Nangia, Ashwini","Polymorphism and isostructurality in sulfonylhydrazones","CrystEngComm","2014","16","22","4681","","10.1039/c3ce42301h","","","0.71073","MoKα","","0.0447","0.039","","","0.1003","0.1047","","","","","","1.064","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215939","23.334","0.008","11.594","0.004","15.6","0.005","90","","103.035","0.005","90","","4112","2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","tribromo sulfonylhydrazone","tribromo sulfonylhydrazone","","- C19 H13 Br3 N2 O2 S -","- C19 H13 Br3 N2 O2 S -","- C152 H104 Br24 N16 O16 S8 -","8","1","","Thakuria, Ranjit; Nath, Naba K.; Roy, Saikat; Nangia, Ashwini","Polymorphism and isostructurality in sulfonylhydrazones","CrystEngComm","2014","16","22","4681","","10.1039/c3ce42301h","","","0.71073","MoKα","","0.0793","0.0399","","","0.0836","0.1011","","","","","","1.003","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215940","22.655","0.004","11.6004","0.0018","15.428","0.003","90","","101.926","0.003","90","","3967.1","1.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","trichloro sulfonylhydrazone","trichloro sulfonylhydrazone","","- C19 H13 Cl3 N2 O2 S -","- C19 H13 Cl3 N2 O2 S -","- C152 H104 Cl24 N16 O16 S8 -","8","1","","Thakuria, Ranjit; Nath, Naba K.; Roy, Saikat; Nangia, Ashwini","Polymorphism and isostructurality in sulfonylhydrazones","CrystEngComm","2014","16","22","4681","","10.1039/c3ce42301h","","","0.71073","MoKα","","0.092","0.0516","","","0.1124","0.1297","","","","","","1.016","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215941","9.236","0.002","8.784","0.002","29.629","0.007","90","","96.361","0.008","90","","2389","0.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H26 Cl6 Cu2 I2 N4 O8 -","- C36 H24 Cu2 I2 N4 O8 -","- C72 H48 Cu4 I4 N8 O16 -","2","0.5","","Mukherjee, Gargi; Biradha, Kumar","1D, 2D and 3D coordination polymers of 1,3-phenylene diisonicotinate with Cu(i)/Cu(ii): Cu2I2 building block, anion influence and guest inclusions","CrystEngComm","2014","16","22","4701","","10.1039/c4ce00123k","","","0.71073","MoKα","","0.1812","0.1241","","","0.2452","0.2529","","","","","","2.005","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215942","9.608","0.002","8.3895","0.0018","30.122","0.006","90","","97.841","0.006","90","","2405.3","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H34 Cu2 I2 N6 O12 -","- C48 H34 Cu2 I2 N6 O12 -","- C96 H68 Cu4 I4 N12 O24 -","2","0.5","","Mukherjee, Gargi; Biradha, Kumar","1D, 2D and 3D coordination polymers of 1,3-phenylene diisonicotinate with Cu(i)/Cu(ii): Cu2I2 building block, anion influence and guest inclusions","CrystEngComm","2014","16","22","4701","","10.1039/c4ce00123k","","","0.71073","MoKα","","0.103","0.0985","","","0.2364","0.2384","","","","","","1.065","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215943","9.47","0.003","8.587","0.003","30.417","0.009","90","","100.186","0.012","90","","2434.5","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H34 Cu2 I2 N6 O8 -","- C50 H34 Cu2 I2 N6 O8 -","- C100 H68 Cu4 I4 N12 O16 -","2","0.5","","Mukherjee, Gargi; Biradha, Kumar","1D, 2D and 3D coordination polymers of 1,3-phenylene diisonicotinate with Cu(i)/Cu(ii): Cu2I2 building block, anion influence and guest inclusions","CrystEngComm","2014","16","22","4701","","10.1039/c4ce00123k","","","0.71073","MoKα","","0.1764","0.1335","","","0.2975","0.3166","","","","","","1.011","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215944","9.6255","0.0019","8.448","0.0017","29.784","0.006","90","","94.921","0.007","90","","2413","0.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H34 Br2 Cu2 I2 N4 O8 -","- C48 H34 Br2 Cu2 I2 N4 O8 -","- C96 H68 Br4 Cu4 I4 N8 O16 -","2","0.5","","Mukherjee, Gargi; Biradha, Kumar","1D, 2D and 3D coordination polymers of 1,3-phenylene diisonicotinate with Cu(i)/Cu(ii): Cu2I2 building block, anion influence and guest inclusions","CrystEngComm","2014","16","22","4701","","10.1039/c4ce00123k","","","0.71073","MoKα","","0.1002","0.0672","","","0.2009","0.2177","","","","","","1.397","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215945","17.615","0.003","15.56","0.002","19.211","0.003","90","","115.087","0.004","90","","4768.8","1.3","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C37 H29 Cl3 Cu F12 N4 O10 P2 -","- C37 H24 Cl3 Cu F12 N4 O10 P2 -","- C148 H96 Cl12 Cu4 F48 N16 O40 P8 -","4","0.5","","Mukherjee, Gargi; Biradha, Kumar","1D, 2D and 3D coordination polymers of 1,3-phenylene diisonicotinate with Cu(i)/Cu(ii): Cu2I2 building block, anion influence and guest inclusions","CrystEngComm","2014","16","22","4701","","10.1039/c4ce00123k","","","0.71073","MoKα","","0.1104","0.0806","","","0.2175","0.2448","","","","","","0.977","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215946","16.835","0.008","9.707","0.005","39.767","0.019","90","","90.522","0.01","90","","6498","6","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C108 H106 Cl6 Cu3 N12 O65 -","- C108 H72 Cu3 N12 O27 -","- C216 H144 Cu6 N24 O54 -","2","0.5","","Mukherjee, Gargi; Biradha, Kumar","1D, 2D and 3D coordination polymers of 1,3-phenylene diisonicotinate with Cu(i)/Cu(ii): Cu2I2 building block, anion influence and guest inclusions","CrystEngComm","2014","16","22","4701","","10.1039/c4ce00123k","","","0.71073","MoKα","","0.126","0.0956","","","0.2194","0.234","","","","","","1.183","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215947","11.0728","0.0004","8.7248","0.0004","14.6199","0.0007","90","","109.072","0.002","90","","1334.87","0.1","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Theophylline, Resorcinol cocrystal monohydrate","","- C13 H16 N4 O5 -","- C13 H16 N4 O5 -","- C52 H64 N16 O20 -","4","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.0628","0.0291","","","0.0849","0.1215","","","","","","1.252","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215948","6.7236","0.0003","23.2123","0.0009","9.2933","0.0003","90","","98.822","0.002","90","","1433.25","0.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Theophylline, phluroglucinol cocrystal monohydrate","","- C13 H16 N4 O6 -","- C13 H16 N4 O6 -","- C52 H64 N16 O24 -","4","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.1262","0.0617","","","0.1474","0.1872","","","","","","0.967","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215949","9.8095","0.0015","13.369","0.002","23.858","0.004","90","","90","","90","","3128.8","0.9","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Theophylline Orcinol cocrystal dihydrate","","- C14 H20 N4 O6 -","- C14 H20 N4 O6 -","- C112 H160 N32 O48 -","8","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.0491","0.0381","","","0.1076","0.133","","","","","","1.152","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215950","14.8098","0.0005","6.6905","0.0002","15.8509","0.0006","90","","94.469","0.002","90","","1565.81","0.09","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Theophylline, 2,6-Dihydroxybenzoic acid salt hydrate","","- C14 H16 N4 O7 -","- C14 H16 N4 O7 -","- C56 H64 N16 O28 -","4","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.1017","0.0575","","","0.167","0.2069","","","","","","1.046","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215951","7.3213","0.0002","8.0238","0.0002","12.6902","0.0002","81.646","0.001","85.601","0.001","82.156","0.001","729.44","0.03","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Theophylline, 3,5-Dihydroxybenzoic acid cocrystal","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C28 H28 N8 O12 -","2","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.0688","0.0486","","","0.1381","0.1646","","","","","","1.073","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215952","8.094","0.0005","8.5956","0.0005","11.5891","0.0005","103.168","0.003","105.023","0.005","105.32","0.004","712.05","0.08","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Theophylline 3,4-Dihydroxybenzoic acid cocrystal","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C28 H28 N8 O12 -","2","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.14","0.0753","","","0.2037","0.2776","","","","","","1.082","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215953","7.2792","0.0007","8.7135","0.0009","24.272","0.002","90","","96.128","0.004","90","","1530.7","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Theophylline Cinnamic acid cocrystal","","- C16 H16 N4 O4 -","- C16 H16 N4 O4 -","- C64 H64 N16 O16 -","4","1","","Sarma, Bipul; Saikia, Basanta","Hydrogen bond synthon competition in the stabilization of theophylline cocrystals","CrystEngComm","2014","16","22","4753","","10.1039/c3ce42332h","","","0.71073","MoKα","","0.1228","0.0777","","","0.2043","0.2414","","","","","","0.996","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215954","8.5707","0.0011","9.8985","0.0012","14.2812","0.0017","104.986","0.005","102.291","0.005","91.286","0.005","1139.7","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 N4 O9 Zn2 -","- C16 H16 N4 O9 Zn2 -","- C32 H32 N8 O18 Zn4 -","2","1","","Bhattacharya, Biswajit; Saha, Debraj; Maity, Dilip Kumar; Dey, Rajdip; Ghoshal, Debajyoti","Syntheses, X-ray structures, gas adsorption and luminescent properties of three coordination polymers of Zn(ii) dicarboxylates mixed with a linear, neutral, and rigid N,N′-donor ligand","CrystEngComm","2014","16","22","4783","","10.1039/c3ce42441c","","","0.71073","MoKα","","0.0571","0.0484","","","0.1722","0.1803","","","","","","1.116","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215955","5.2333","0.0001","9.158","0.0003","14.8415","0.0004","84.191","0.001","85.964","0.002","79.848","0.001","695.57","0.03","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H12 N2 O6 Zn -","- C10 H12 N2 O6 Zn -","- C20 H24 N4 O12 Zn2 -","2","1","","Bhattacharya, Biswajit; Saha, Debraj; Maity, Dilip Kumar; Dey, Rajdip; Ghoshal, Debajyoti","Syntheses, X-ray structures, gas adsorption and luminescent properties of three coordination polymers of Zn(ii) dicarboxylates mixed with a linear, neutral, and rigid N,N′-donor ligand","CrystEngComm","2014","16","22","4783","","10.1039/c3ce42441c","","","0.71073","MoKα","","0.0435","0.0415","","","0.1361","0.1373","","","","","","1.22","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215956","10.9188","0.0004","11.5059","0.0004","13.0695","0.0004","109.415","0.002","95.197","0.002","97.024","0.002","1521.76","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H18 N8 O9 Zn2 -","- C28 H18 N8 O9 Zn2 -","- C56 H36 N16 O18 Zn4 -","2","1","","Bhattacharya, Biswajit; Saha, Debraj; Maity, Dilip Kumar; Dey, Rajdip; Ghoshal, Debajyoti","Syntheses, X-ray structures, gas adsorption and luminescent properties of three coordination polymers of Zn(ii) dicarboxylates mixed with a linear, neutral, and rigid N,N′-donor ligand","CrystEngComm","2014","16","22","4783","","10.1039/c3ce42441c","","","0.71073","MoKα","","0.0535","0.0433","","","0.1143","0.1209","","","","","","1.046","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215957","7.7589","0.001","9.2634","0.0012","17.83","0.002","90.403","0.008","90.275","0.009","97.322","0.009","1271","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Felodipine : 4,4'-bipyridine (1:1)","","- C28 H27 Cl2 N3 O4 -","- C28 H27 Cl2 N3 O4 -","- C56 H54 Cl4 N6 O8 -","2","1","","Surov, Artem O.; Solanko, Katarzyna A.; Bond, Andrew D.; Bauer-Brandl, Annette; Perlovich, German L.","Polymorphism of felodipine co-crystals with 4,4′-bipyridine","CrystEngComm","2014","16","29","6603","","10.1039/c4ce00756e","","","0.71073","MoKα","","0.1542","0.0957","","","0.2379","0.2641","","","","","","1.131","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215958","10.4207","0.0009","10.6061","0.0009","11.2328","0.0009","67.167","0.004","73.749","0.004","81.109","0.005","1097","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Felodipine : 4,4'-bipyridine (2:1)","","","- C46 H46 Cl4 N4 O8 -","- C46 H46 Cl4 N4 O8 -","- C46 H46 Cl4 N4 O8 -","1","0.5","","Surov, Artem O.; Solanko, Katarzyna A.; Bond, Andrew D.; Bauer-Brandl, Annette; Perlovich, German L.","Polymorphism of felodipine co-crystals with 4,4′-bipyridine","CrystEngComm","2014","16","29","6603","","10.1039/c4ce00756e","","","0.71073","MoKα","","0.1065","0.0719","","","0.1928","0.2191","","","","","","1.059","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215959","36.197","0.003","36.436","0.003","8.0228","0.0006","90","","90","","90","","10581.1","1.5","150","2","150","2","","","","","","","","5","F d d 2","F 2 -2d","43","","Felodipine : 4,4'-bipyridine (1:1)","","- C28 H27 Cl2 N3 O4 -","- C28 H27 Cl2 N3 O4 -","- C448 H432 Cl32 N48 O64 -","16","1","","Surov, Artem O.; Solanko, Katarzyna A.; Bond, Andrew D.; Bauer-Brandl, Annette; Perlovich, German L.","Polymorphism of felodipine co-crystals with 4,4′-bipyridine","CrystEngComm","2014","16","29","6603","","10.1039/c4ce00756e","","","0.71073","MoKα","","0.067","0.046","","","0.0992","0.1077","","","","","","1.049","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215960","8.863","0.001","23.742","0.002","8.907","0.001","90","","116.86","0.01","90","","1672.1","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H48 Cl2 Mg N4 O8 -","- C22 H48 Cl2 Mg N4 O8 -","- C44 H96 Cl4 Mg2 N8 O16 -","2","1","","Grepioni, Fabrizia; Wouters, Johan; Braga, Dario; Nanna, Saverio; Fours, Baptiste; Coquerel, Gérard; Longfils, Geraldine; Rome, Sandrine; Aerts, Luc; Quéré, Luc","Ionic co-crystals of racetams: solid-state properties enhancement of neutral active pharmaceutical ingredients via addition of Mg2+ and Ca2+ chlorides","CrystEngComm","2014","16","26","5887","","10.1039/c4ce00409d","","","1.54178","CuKα","","0.0695","0.0528","","","0.1382","0.1503","","","","","","1.052","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215961","5.9825","0.0011","9.0582","0.0017","34.096","0.006","90","","90","","90","","1847.7","0.6","293","2","293","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C11 H24 Ca Cl2 N2 O4 -","- C11 H24 Ca Cl2 N2 O4 -","- C44 H96 Ca4 Cl8 N8 O16 -","4","1","","Grepioni, Fabrizia; Wouters, Johan; Braga, Dario; Nanna, Saverio; Fours, Baptiste; Coquerel, Gérard; Longfils, Geraldine; Rome, Sandrine; Aerts, Luc; Quéré, Luc","Ionic co-crystals of racetams: solid-state properties enhancement of neutral active pharmaceutical ingredients via addition of Mg2+ and Ca2+ chlorides","CrystEngComm","2014","16","26","5887","","10.1039/c4ce00409d","","x-ray","0.71073","MoKα","","0.0443","0.0377","","","0.0861","0.0886","","","","","","1.092","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215962","8.85","0.002","8.85","0.002","34.827","0.005","90","","90","","120","","2362.3","0.8","293","2","293","2","","","","","","","","7","P 32 2 1","P 32 2""","154","","","","- C20 H36 Cl2 F4 Mg N4 O8 -","- C20 H36 Cl2 F4 Mg N4 O8 -","- C60 H108 Cl6 F12 Mg3 N12 O24 -","3","0.5","","Grepioni, Fabrizia; Wouters, Johan; Braga, Dario; Nanna, Saverio; Fours, Baptiste; Coquerel, Gérard; Longfils, Geraldine; Rome, Sandrine; Aerts, Luc; Quéré, Luc","Ionic co-crystals of racetams: solid-state properties enhancement of neutral active pharmaceutical ingredients via addition of Mg2+ and Ca2+ chlorides","CrystEngComm","2014","16","26","5887","","10.1039/c4ce00409d","","","1.54178","CuKα","","0.0827","0.0498","","","0.1276","0.147","","","","","","1.046","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215963","5.9482","0.0008","9.0116","0.0008","17.114","0.002","90","","99.35","0.012","90","","905.17","0.18","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","co-crystals","","","- C10 H18 Ca Cl2 F2 N2 O4 -","- C10 H18 Ca Cl2 F2 N2 O4 -","- C20 H36 Ca2 Cl4 F4 N4 O8 -","2","1","","Grepioni, Fabrizia; Wouters, Johan; Braga, Dario; Nanna, Saverio; Fours, Baptiste; Coquerel, Gérard; Longfils, Geraldine; Rome, Sandrine; Aerts, Luc; Quéré, Luc","Ionic co-crystals of racetams: solid-state properties enhancement of neutral active pharmaceutical ingredients via addition of Mg2+ and Ca2+ chlorides","CrystEngComm","2014","16","26","5887","","10.1039/c4ce00409d","","","0.71073","MoKα","","0.1012","0.0795","","","0.1603","0.1704","","","","","","1.124","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215964","11.0697","0.0006","22.2083","0.0011","19.5333","0.0011","90","","90","","90","","4802.1","0.4","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C41 H45 N11 O13 Zn2 -","- C41 H45 N11 O13 Zn2 -","- C164 H180 N44 O52 Zn8 -","4","1","","Nagaraja, C. M.; Ugale, Bharat; Chanthapally, Anjana","Construction of 2D interwoven and 3D interpenetrated metal‒organic frameworks of Zn(ii) by varying N,N′-donor spacers","CrystEngComm","2014","16","22","4805","","10.1039/c3ce42454e","","","0.71073","MoKα","","0.0956","0.0661","","","0.1738","0.1906","","","","","","1.063","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215965","22.219","0.0013","5.5243","0.0003","18.4719","0.001","90","","115.962","0.002","90","","2038.5","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 N2 O8 Zn -","- C18 H22 N2 O8 Zn -","- C72 H88 N8 O32 Zn4 -","4","0.5","","Nagaraja, C. M.; Ugale, Bharat; Chanthapally, Anjana","Construction of 2D interwoven and 3D interpenetrated metal‒organic frameworks of Zn(ii) by varying N,N′-donor spacers","CrystEngComm","2014","16","22","4805","","10.1039/c3ce42454e","","","0.71073","MoKα","","0.0231","0.0225","","","0.0576","0.0581","","","","","","1.07","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215966","16","0.005","5.452","0.005","22.025","0.005","90","0.005","107.704","0.005","90","0.005","1830.3","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N4 O4 Zn -","- C20 H18 N4 O4 Zn -","- C80 H72 N16 O16 Zn4 -","4","0.5","","Nagaraja, C. M.; Ugale, Bharat; Chanthapally, Anjana","Construction of 2D interwoven and 3D interpenetrated metal‒organic frameworks of Zn(ii) by varying N,N′-donor spacers","CrystEngComm","2014","16","22","4805","","10.1039/c3ce42454e","","","0.71073","MoKα","","0.023","0.0227","","","0.06","0.0602","","","","","","1.089","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215967","10.7575","0.0004","15.318","0.0006","29.3906","0.0013","81.112","0.001","87.711","0.001","84.536","0.001","4761.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C94 H86 N20 O18 Zn4 -","- C94 H86 N20 O18 Zn4 -","- C188 H172 N40 O36 Zn8 -","2","1","","Nagaraja, C. M.; Ugale, Bharat; Chanthapally, Anjana","Construction of 2D interwoven and 3D interpenetrated metal‒organic frameworks of Zn(ii) by varying N,N′-donor spacers","CrystEngComm","2014","16","22","4805","","10.1039/c3ce42454e","","","0.71073","MoKα","","0.1001","0.0525","","","0.1147","0.1337","","","","","","1.064","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215968","8.5561","0.0017","8.656","0.0018","24.424","0.005","93.654","0.003","95.997","0.003","91.067","0.004","1794.7","0.6","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C74 H88 Cd2 N12 O10 -","- C74 H84 Cd2 N12 O10 -","- C74 H84 Cd2 N12 O10 -","1","1","","Ahmad, Musheer; Katoch, Rajesh; Garg, Ashish; Bharadwaj, Parimal K.","A novel 3D 10-fold interpenetrated homochiral coordination polymer: large spontaneous polarization, dielectric loss and emission studies","CrystEngComm","2014","16","22","4766","","10.1039/c3ce42628a","","","0.71073","MoKα","","0.0762","0.0614","","","0.1382","0.1495","","","","","","1.024","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215969","15.0954","0.0006","11.5689","0.0004","10.6232","0.0004","90","","110.192","0.004","90","","1741.19","0.12","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H26 Co2 N2 O8 P2 -","- C12 H26 Co2 N2 O8 P2 -","- C48 H104 Co8 N8 O32 P8 -","4","1","","Patzschke, Christin; Forsyth, Craig M.; Batten, Stuart R.; Chaffee, Alan L.","Formation of a non-porous cobalt-phosphonate framework by small pH change in the preparation of the microporous STA-16(Co)","CrystEngComm","2014","16","28","6296","","10.1039/c4ce00509k","","","0.71073","MoKα","","0.0405","0.0356","","","0.0853","0.0892","","","","","","1.037","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215970","12.9496","0.0016","12.9821","0.0016","20.789","0.003","84.935","0.002","82.643","0.002","77.463","0.001","3376.9","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C116 H178 Co N4 O38 S12 -","- C116 H178 Co N4 O38 S12 -","- C116 H178 Co N4 O38 S12 -","1","0.5","","Drachnik, Amanda M.; Kumari, Harshita; Barnes, Charles L.; Deakyne, Carol A.; Atwood, Jerry L.","Encapsulation of manganese and cobalt complexes within resorcin[4]arene dimers","CrystEngComm","2014","16","31","7172","","10.1039/C4CE00556B","","","0.71073","MoKα","","0.1398","0.0982","","","0.2317","0.2735","","","","","","1.044","","","","has coordinates,has disorder","180490","2020-10-21","18:00:00",""
"7215971","12.3562","0.0003","12.5049","0.0003","19.3386","0.0004","89.472","0.001","80.7","0.001","79.3","0.001","2896.85","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H156 Co N2 O32 S10 -","- C100 H156 Co N2 O32 S10 -","- C100 H156 Co N2 O32 S10 -","1","0.5","","Drachnik, Amanda M.; Kumari, Harshita; Barnes, Charles L.; Deakyne, Carol A.; Atwood, Jerry L.","Encapsulation of manganese and cobalt complexes within resorcin[4]arene dimers","CrystEngComm","2014","16","31","7172","","10.1039/C4CE00556B","","","1.54178","CuKα","","0.0626","0.0584","","","0.1619","0.1659","","","","","","1.078","","","","has coordinates,has disorder","180490","2020-10-21","18:00:00",""
"7215972","12.3466","0.0017","12.604","0.0017","18.908","0.003","89.008","0.002","81.577","0.002","78.725","0.002","2854.3","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H156 Mn N2 O32 S10 -","- C100 H156 Mn N2 O32 S10 -","- C100 H156 Mn N2 O32 S10 -","1","0.5","","Drachnik, Amanda M.; Kumari, Harshita; Barnes, Charles L.; Deakyne, Carol A.; Atwood, Jerry L.","Encapsulation of manganese and cobalt complexes within resorcin[4]arene dimers","CrystEngComm","2014","16","31","7172","","10.1039/C4CE00556B","","","0.71073","MoKα","","0.1416","0.0674","","","0.1544","0.1929","","","","","","0.98","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215973","8.8478","0.0004","13.3523","0.0006","14.1584","0.0006","67.987","0.001","77.114","0.001","74.612","0.001","1480.77","0.11","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Succinylsulfathiazole plymorph I","","","- C13 H13 N3 O5 S2 -","- C13 H13 N3 O5 S2 -","- C52 H52 N12 O20 S8 -","4","2","","Bag, Partha Pratim; Kothur, Raghuram Reddy; Malla Reddy, C.","Tautomeric preference in polymorphs and pseudopolymorphs of succinylsulfathiazole: fast evaporation screening and thermal studies","CrystEngComm","2014","16","22","4706","","10.1039/c3ce42159g","","","0.71073","MoKα","","0.0399","0.0344","","","0.1132","0.1223","","","","","","0.873","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215974","11.351","0.003","8.577","0.002","16.684","0.003","90","","107.483","0.005","90","","1549.3","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Succinylsulfathiazole plymorph II","","","- C13 H13 N3 O5 S2 -","- C13 H13 N3 O5 S2 -","- C52 H52 N12 O20 S8 -","4","1","","Bag, Partha Pratim; Kothur, Raghuram Reddy; Malla Reddy, C.","Tautomeric preference in polymorphs and pseudopolymorphs of succinylsulfathiazole: fast evaporation screening and thermal studies","CrystEngComm","2014","16","22","4706","","10.1039/c3ce42159g","","","0.71073","MoKα","","0.0798","0.0428","","","0.117","0.1495","","","","","","0.895","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215975","16.19","0.006","5.146","0.0014","19.449","0.007","90","","94.028","0.017","90","","1616.4","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Succinylsulfathiazole mono hydrate","","","- C13 H15 N3 O6 S2 -","- C13 H15 N3 O6 S2 -","- C52 H60 N12 O24 S8 -","4","1","","Bag, Partha Pratim; Kothur, Raghuram Reddy; Malla Reddy, C.","Tautomeric preference in polymorphs and pseudopolymorphs of succinylsulfathiazole: fast evaporation screening and thermal studies","CrystEngComm","2014","16","22","4706","","10.1039/c3ce42159g","","","0.71073","MoKα","","0.0503","0.0391","","","0.1016","0.1123","","","","","","1.018","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215976","8.5229","0.0004","14.5887","0.0007","15.2327","0.0007","64.777","0.001","78.161","0.001","82.086","0.001","1674.27","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Succinylsulfathiazole acetone solvate","","","- C29 H32 N6 O11 S4 -","- C29 H32 N6 O11 S4 -","- C58 H64 N12 O22 S8 -","2","1","","Bag, Partha Pratim; Kothur, Raghuram Reddy; Malla Reddy, C.","Tautomeric preference in polymorphs and pseudopolymorphs of succinylsulfathiazole: fast evaporation screening and thermal studies","CrystEngComm","2014","16","22","4706","","10.1039/c3ce42159g","","","0.71073","MoKα","","0.0781","0.0718","","","0.1465","0.151","","","","","","1.044","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215977","8.7032","0.0002","14.5604","0.0005","15.5676","0.0005","64.602","0.002","77.24","0.002","83.635","0.002","1737.79","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Succinylsulfathiazole tetrahydrofuran solvate","","","- C30 H34 N6 O11 S4 -","- C30 H34 N6 O11 S4 -","- C60 H68 N12 O22 S8 -","2","1","","Bag, Partha Pratim; Kothur, Raghuram Reddy; Malla Reddy, C.","Tautomeric preference in polymorphs and pseudopolymorphs of succinylsulfathiazole: fast evaporation screening and thermal studies","CrystEngComm","2014","16","22","4706","","10.1039/c3ce42159g","","","0.71073","MoKα","","0.0753","0.044","","","0.125","0.1522","","","","","","0.882","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215979","31.788","0.002","18.353","0.002","34.619","0.004","90","","107.82","","90","","19228","3","200","2","200","2","","","","","","","","5","C 1 c 1","C -2yc","9","Compound 1a","","","- C179 H165 Cl6 N33 O22 -","- C179 H141 Cl6 N33 O22 -","- C716 H564 Cl24 N132 O88 -","4","1","","Chaudhari, Abhijeet K.; Sharma, Amitosh; Mukherjee, Soumya; Joarder, Biplab; Ghosh, Sujit K.","Capsule voided nanospace confinement in a π-stacked supramolecular organic solid","CrystEngComm","2014","16","22","4691","","10.1039/c3ce42509f","","","0.71073","MoKα","","0.2711","0.1279","","","0.3014","0.3864","","","","","","0.998","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215980","15.93","0.006","13.588","0.005","6.663","0.002","90","","97.392","0.005","90","","1430.3","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 N O11 Pr -","- C9 H15 N O11 Pr -","- C36 H60 N4 O44 Pr4 -","4","1","","Liu, Yi-Ting; Du, Yuan-Qi; Wu, Xiao; Zheng, Zhi-Peng; Lin, Xiao-Ming; Zhu, Li-Cai; Cai, Yue-Peng","A series of lanthanide complexes based on pyridine-3,5-dicarboxylate and succinate ligands: syntheses, structures and properties","CrystEngComm","2014","16","29","6797","","10.1039/c4ce00417e","","","0.71073","MoKα","","0.064","0.0504","","","0.1322","0.1435","","","","","","1.062","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215981","15.9131","0.0014","13.5396","0.0011","6.6475","0.0006","90","","97.662","0.001","90","","1419.5","0.2","296","2","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 Eu N O11 -","- C9 H15 Eu N O11 -","- C36 H60 Eu4 N4 O44 -","4","1","","Liu, Yi-Ting; Du, Yuan-Qi; Wu, Xiao; Zheng, Zhi-Peng; Lin, Xiao-Ming; Zhu, Li-Cai; Cai, Yue-Peng","A series of lanthanide complexes based on pyridine-3,5-dicarboxylate and succinate ligands: syntheses, structures and properties","CrystEngComm","2014","16","29","6797","","10.1039/c4ce00417e","","","0.71073","MoKα","","0.0387","0.031","","","0.0764","0.0812","","","","","","1.021","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215982","15.8734","0.0012","13.4525","0.001","6.6309","0.0005","90","","97.862","0.001","90","","1402.63","0.18","296","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 N O11 Tb -","- C9 H15 N O11 Tb -","- C36 H60 N4 O44 Tb4 -","4","1","","Liu, Yi-Ting; Du, Yuan-Qi; Wu, Xiao; Zheng, Zhi-Peng; Lin, Xiao-Ming; Zhu, Li-Cai; Cai, Yue-Peng","A series of lanthanide complexes based on pyridine-3,5-dicarboxylate and succinate ligands: syntheses, structures and properties","CrystEngComm","2014","16","29","6797","","10.1039/c4ce00417e","","","0.71073","MoKα","","0.0239","0.0227","","","0.0618","0.0626","","","","","","1.052","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215983","15.8585","0.0014","13.419","0.0011","6.6158","0.0006","90","","97.925","0.001","90","","1394.4","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 Er N O11 -","- C9 H15 Er N O11 -","- C36 H60 Er4 N4 O44 -","4","1","","Liu, Yi-Ting; Du, Yuan-Qi; Wu, Xiao; Zheng, Zhi-Peng; Lin, Xiao-Ming; Zhu, Li-Cai; Cai, Yue-Peng","A series of lanthanide complexes based on pyridine-3,5-dicarboxylate and succinate ligands: syntheses, structures and properties","CrystEngComm","2014","16","29","6797","","10.1039/c4ce00417e","","","0.71073","MoKα","","0.0462","0.0374","","","0.1002","0.1085","","","","","","1.0237","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215984","5.3448","0.0006","8.9517","0.001","15.6623","0.0018","104.912","0.001","93.036","0.001","97.157","0.001","715.65","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H13 N O10 Yb -","- C9 H13 N O10 Yb -","- C18 H26 N2 O20 Yb2 -","2","1","","Liu, Yi-Ting; Du, Yuan-Qi; Wu, Xiao; Zheng, Zhi-Peng; Lin, Xiao-Ming; Zhu, Li-Cai; Cai, Yue-Peng","A series of lanthanide complexes based on pyridine-3,5-dicarboxylate and succinate ligands: syntheses, structures and properties","CrystEngComm","2014","16","29","6797","","10.1039/c4ce00417e","","","0.71073","MoKα","","0.0261","0.0245","","","0.0607","0.0616","","","","","","1.068","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215985","5.34","0.0008","8.953","0.0014","15.655","0.002","104.76","0.002","93.015","0.002","97.273","0.002","715.11","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H13 Lu N O10 -","- C9 H13 Lu N O10 -","- C18 H26 Lu2 N2 O20 -","2","1","","Liu, Yi-Ting; Du, Yuan-Qi; Wu, Xiao; Zheng, Zhi-Peng; Lin, Xiao-Ming; Zhu, Li-Cai; Cai, Yue-Peng","A series of lanthanide complexes based on pyridine-3,5-dicarboxylate and succinate ligands: syntheses, structures and properties","CrystEngComm","2014","16","29","6797","","10.1039/c4ce00417e","","","0.71073","MoKα","","0.0284","0.0271","","","0.0775","0.0783","","","","","","1.056","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215986","8.1481","0.0003","10.7263","0.0003","13.4085","0.0004","86.933","0.002","84.68","0.003","81.508","0.003","1153.1","0.06","120","","120","","","","","","","","see text","4","P -1","-P 1","2","","","","- C27 H30 N2 O2 -","- C27 H30 N2 O2 -","- C54 H60 N4 O4 -","2","1","","Ahipa, T. N.; Kumar, Vijith; Shankar Rao, D. S.; Prasad, Subbarao Krishna; Adhikari, Airody Vasudeva","New 4-(2-(4-alkoxyphenyl)-6-methoxypyridin-4-yl)benzonitriles: synthesis, liquid crystalline behavior and photo physical properties","CrystEngComm","2014","16","25","5573","","10.1039/c4ce00128a","","x-ray","0.71073","MoKα","","0.0523","0.0416","","","0.1026","0.1094","","","","","","1.059","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7215987","8.978","0.003","10.677","0.003","10.877","0.003","99.677","0.009","95.437","0.009","103.089","0.008","991.5","0.5","296","2","296","2","","","","","","","see text","4","P -1","-P 1","2","","","","- C23 H22 N2 O2 -","- C23 H22 N2 O2 -","- C46 H44 N4 O4 -","2","1","","Ahipa, T. N.; Kumar, Vijith; Shankar Rao, D. S.; Prasad, Subbarao Krishna; Adhikari, Airody Vasudeva","New 4-(2-(4-alkoxyphenyl)-6-methoxypyridin-4-yl)benzonitriles: synthesis, liquid crystalline behavior and photo physical properties","CrystEngComm","2014","16","25","5573","","10.1039/c4ce00128a","","x-ray","0.71073","MoKα","","0.1079","0.0537","","","0.1352","0.159","","","","","","0.994","","","","has coordinates","180490","2020-10-21","18:00:00",""
"7216001","9.4258","0.0019","10.052","0.002","15.309","0.003","97.47","0.03","105.32","0.03","103.94","0.03","1328.4","0.6","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H28 N2 O4 Zn -","- C32 H28 N2 O4 Zn -","- C64 H56 N4 O8 Zn2 -","2","1","","Ge, Yu; Li, Ni-Ya; Ji, Xue-Ying; Wang, Jun-Feng; Liu, Dong; Tang, Xiao-Yan","Assembly of a series of zinc coordination polymers based on 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and 1,3-benzenedicarboxylate derivatives","CrystEngComm","2014","16","29","6621","","10.1039/c4ce00696h","","","0.71073","MoKα","","0.0438","0.0395","","","0.1114","0.1154","","","","","","1.069","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216002","9.907","0.002","10.421","0.002","16.142","0.003","81.18","0.03","75.18","0.03","81.78","0.03","1582.6","0.6","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H57 Cl2 N5 O8 Zn2 -","- C66 H57 Cl2 N5 O8 Zn2 -","- C66 H57 Cl2 N5 O8 Zn2 -","1","0.5","","Ge, Yu; Li, Ni-Ya; Ji, Xue-Ying; Wang, Jun-Feng; Liu, Dong; Tang, Xiao-Yan","Assembly of a series of zinc coordination polymers based on 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and 1,3-benzenedicarboxylate derivatives","CrystEngComm","2014","16","29","6621","","10.1039/c4ce00696h","","","0.71073","MoKα","","0.067","0.0513","","","0.1301","0.141","","","","","","1.037","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216003","10.791","0.002","17.717","0.003","9.7094","0.0019","90","","92.49","0.03","90","","1854.5","0.6","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 N2 O6 Zn -","- C20 H15 N2 O6 Zn -","- C80 H60 N8 O24 Zn4 -","4","1","","Ge, Yu; Li, Ni-Ya; Ji, Xue-Ying; Wang, Jun-Feng; Liu, Dong; Tang, Xiao-Yan","Assembly of a series of zinc coordination polymers based on 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and 1,3-benzenedicarboxylate derivatives","CrystEngComm","2014","16","29","6621","","10.1039/c4ce00696h","","","0.71073","MoKα","","0.0646","0.057","","","0.1657","0.1741","","","","","","1.077","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216004","16.096","0.003","7.6958","0.0015","16.148","0.003","90","","99.06","0.03","90","","1975.3","0.7","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N2 O6 Zn -","- C20 H21 N2 O6 Zn -","- C80 H84 N8 O24 Zn4 -","4","1","","Ge, Yu; Li, Ni-Ya; Ji, Xue-Ying; Wang, Jun-Feng; Liu, Dong; Tang, Xiao-Yan","Assembly of a series of zinc coordination polymers based on 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and 1,3-benzenedicarboxylate derivatives","CrystEngComm","2014","16","29","6621","","10.1039/c4ce00696h","","","0.71073","MoKα","","0.0915","0.0791","","","0.227","0.2498","","","","","","1.038","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216005","18.621","0.004","9.7191","0.0019","17.267","0.004","90","","98.76","0.03","90","","3088.5","1.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H28 N2 O7 Zn2 -","- C33 H28 N2 O7 Zn2 -","- C132 H112 N8 O28 Zn8 -","4","1","","Ge, Yu; Li, Ni-Ya; Ji, Xue-Ying; Wang, Jun-Feng; Liu, Dong; Tang, Xiao-Yan","Assembly of a series of zinc coordination polymers based on 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and 1,3-benzenedicarboxylate derivatives","CrystEngComm","2014","16","29","6621","","10.1039/c4ce00696h","","","0.71073","MoKα","","0.1085","0.0792","","","0.21","0.2447","","","","","","0.991","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216039","12.6883","0.0011","37.728","0.003","29.351","0.003","90","","90.03","0.001","90","","14050","2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C152 H114 N42 Ni4 O8 -","- C152 H114 N42 Ni4 O8 -","- C608 H456 N168 Ni16 O32 -","4","1","","Mendiratta, Shruti; Usman, Muhammad; Luo, Tzuoo-Tsair; Lee, Shang-Fan; Lin, Ying-Chih; Lu, Kuang-Lieh","Guest dependent dielectric properties of nickel(ii)-based supramolecular networks","CrystEngComm","2014","16","28","6309","","10.1039/c4ce00218k","","","0.71073","MoKα","","0.1339","0.0752","","","0.1759","0.2003","","","","","","1.037","","","","has coordinates,has disorder","180491","2020-10-21","18:00:00",""
"7216040","12.2568","0.0002","15.712","0.0003","20.7876","0.0004","90","","90","","90","","4003.25","0.13","200","2","200","2","","","","","","","","6","P n a b","-P 2bc 2n","60","","","","- C42 H34 Cl2 N12 Ni O2 -","- C42 H34 Cl2 N12 Ni O2 -","- C168 H136 Cl8 N48 Ni4 O8 -","4","0.5","","Mendiratta, Shruti; Usman, Muhammad; Luo, Tzuoo-Tsair; Lee, Shang-Fan; Lin, Ying-Chih; Lu, Kuang-Lieh","Guest dependent dielectric properties of nickel(ii)-based supramolecular networks","CrystEngComm","2014","16","28","6309","","10.1039/c4ce00218k","","","0.71073","MoKα","","0.0548","0.0422","","","0.1205","0.1306","","","","","","1.134","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216041","18.825","0.004","8.3912","0.0016","9.2901","0.0018","90","","94.064","0.003","90","","1463.8","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H18 Mn O10 P2 -","- C8 H14 Mn O10 P2 -","- C32 H56 Mn4 O40 P8 -","4","0.5","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0385","0.0355","","","0.0941","0.0963","","","","","","1.093","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216042","6.8159","0.0018","9.734","0.003","13.799","0.004","96.523","0.004","95.78","0.004","91.06","0.004","904.5","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H26 Co O14 P2 -","- C8 H26 Co O14 P2 -","- C16 H52 Co2 O28 P4 -","2","1","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0592","0.0456","","","0.1124","0.1208","","","","","","1.041","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216043","12.363","0.002","7.8134","0.0013","15.311","0.003","90","","93.942","0.004","90","","1475.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H38 Co O20 P4 -","- C16 H34 Co O20 P4 -","- C32 H68 Co2 O40 P8 -","2","0.5","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.1145","0.0592","","","0.1266","0.1552","","","","","","1.014","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216044","6.7912","0.0011","9.6878","0.0016","13.786","0.002","96.736","0.002","95.816","0.005","91.082","0.005","895.7","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H26 Ni O14 P2 -","- C8 H26 Ni O14 P2 -","- C16 H52 Ni2 O28 P4 -","2","1","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0681","0.0444","","","0.0941","0.1016","","","","","","0.922","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216045","5.1671","0.001","6.3007","0.0012","10.029","0.003","75.102","0.005","84.496","0.01","76.61","0.003","306.72","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H14 Cu O8 P2 -","- C8 H14 Cu O8 P2 -","- C8 H14 Cu O8 P2 -","1","0.5","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0471","0.0379","","","0.0937","0.0998","","","","","","1.072","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216046","12.3549","0.0013","7.8244","0.0008","15.3271","0.0016","90","","93.924","0.002","90","","1478.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H38 O20 P4 Zn -","- C16 H34 O20 P4 Zn -","- C32 H68 O40 P8 Zn2 -","2","0.5","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0783","0.0454","","","0.1014","0.1153","","","","","","1.013","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216047","19.781","0.004","6.7881","0.0015","9.4449","0.0019","90","","90.463","0.003","90","","1268.2","0.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H14 Cd O8 P2 -","- C8 H14 Cd O8 P2 -","- C32 H56 Cd4 O32 P8 -","4","0.5","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0365","0.0331","","","0.0824","0.0849","","","","","","1.075","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216048","7.6143","0.0012","22.461","0.004","7.7097","0.0012","90","","90","","90","","1318.5","0.4","296","2","296","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C8 H14 O8 P2 Zn -","- C8 H14 O8 P2 Zn -","- C32 H56 O32 P8 Zn4 -","4","0.5","","Tang, Si-Fu; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo","Tuning the structure of metal phosphonates using uncoordinating methyl group: syntheses, structures and properties of a series of metal diphosphonates","CrystEngComm","2014","16","30","7043","","10.1039/C4CE00375F","","","0.71073","MoKα","","0.0367","0.0322","","","0.0925","0.0953","","","","","","1.089","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216049","5.7837","0.0003","6.0328","0.0003","12.3406","0.0006","90","","90","","90","","430.59","0.04","293.1","","293.1","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H7 N O2 -","- C3 H7 N O2 -","- C12 H28 N4 O8 -","4","1","","Kimura, Fumiko; Oshima, Wataru; Matsumoto, Hiroko; Uekusa, Hidehiro; Aburaya, Kazuaki; Maeyama, Masataka; Kimura, Tsunehisa","Single crystal structure analysis via magnetically oriented microcrystal arrays","CrystEngComm","2014","16","29","6630","","10.1039/c4ce00839a","","","1.54187","CuKα","","","0.0662","","","","0.1718","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216050","5.0868","0.0003","13.0628","0.0008","10.9758","0.0007","90","","90.99","0.007","90","","729.21","0.08","296","","296","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C12 H22 O11 -","- C12 H22 O11 -","- C24 H44 O22 -","2","1","","Kimura, Fumiko; Oshima, Wataru; Matsumoto, Hiroko; Uekusa, Hidehiro; Aburaya, Kazuaki; Maeyama, Masataka; Kimura, Tsunehisa","Single crystal structure analysis via magnetically oriented microcrystal arrays","CrystEngComm","2014","16","29","6630","","10.1039/c4ce00839a","","","1.54187","CuKα","","","0.1062","","","","0.3323","","","","","","1.143","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216051","7.5958","0.0002","19.748","0.0014","11.251","0.0003","90","","90","","90","","1687.67","0.14","296","","296","","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- C24 H18 -","- C24 H18 -","- C96 H72 -","4","1","","Kimura, Fumiko; Oshima, Wataru; Matsumoto, Hiroko; Uekusa, Hidehiro; Aburaya, Kazuaki; Maeyama, Masataka; Kimura, Tsunehisa","Single crystal structure analysis via magnetically oriented microcrystal arrays","CrystEngComm","2014","16","29","6630","","10.1039/c4ce00839a","","","1.54187","CuKα","","","0.0993","","","","0.3082","","","","","","1.031","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216052","6.7745","0.0011","6.8452","0.0016","21.531","0.004","88.152","0.016","82.974","0.012","60.518","0.009","862.2","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- B11 Ba2 H7 O22 -","- B11 Ba2 H7 O22 -","- B22 Ba4 H14 O44 -","2","1","","Deng, Ting-Ting; Gao, Yan-E; Zhang, Li-Xia; Gu, Xiang-Yu; Tian, Han-Rui; Liu, Yi; Feng, Yun-Long; Cheng, Jian-Wen","Incorporating [GaB4O11(OH)]8− clusters to construct luminescent galloborate with open-framework layers","CrystEngComm","2014","16","25","5689","","10.1039/c4ce00485j","","","0.71073","MoKα","","0.0364","0.0261","","","0.0554","0.0604","","","","","","1.025","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216053","7.108","0.0014","7.1372","0.0012","9.878","0.003","106.885","0.017","91.569","0.017","119.185","0.011","409.99","0.18","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- B4 Ba Ga H3 O10 -","- B4 Ba Ga H3 O10 -","- B8 Ba2 Ga2 H6 O20 -","2","1","","Deng, Ting-Ting; Gao, Yan-E; Zhang, Li-Xia; Gu, Xiang-Yu; Tian, Han-Rui; Liu, Yi; Feng, Yun-Long; Cheng, Jian-Wen","Incorporating [GaB4O11(OH)]8− clusters to construct luminescent galloborate with open-framework layers","CrystEngComm","2014","16","25","5689","","10.1039/c4ce00485j","","","0.71073","MoKα","","0.0479","0.0324","","","0.0651","0.0866","","","","","","1.154","","","","has coordinates","180491","2020-10-21","18:00:00",""
"7216121","8.362","0.002","9.211","0.003","14.892","0.004","100.999","0.019","94.355","0.017","97.503","0.017","1110.3","0.5","270","2","270","2","","","","","","","","5","P -1","-P 1","2","[Ni(bpta)(CH3COO)2(H2O)].H2O","","","- C20 H31 N3 Ni O6 -","- C20 H31 N3 Ni O6 -","- C40 H62 N6 Ni2 O12 -","2","1","","Khullar, Sadhika; Gupta, Vijay; Mandal, Sanjay K.","Tuning the formation of dicarboxylate linker-assisted supramolecular 1D chains and squares of Ni(ii) using coordination and hydrogen bonds","CrystEngComm","2014","16","25","5705","","10.1039/c4ce00434e","","","0.71073","","","0.0601","0.04","","","0.0933","0.1031","","","","","","0.974","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216122","13.9083","0.0006","17.7966","0.0007","18.4094","0.0008","90","","90","","90","","4556.7","0.3","140","2","140","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","[Ni(bpta)(H2O)2(adc)].2H2O","","","- C20 H29 N3 Ni O8 -","- C20 H29 N3 Ni O8 -","- C160 H232 N24 Ni8 O64 -","8","1","","Khullar, Sadhika; Gupta, Vijay; Mandal, Sanjay K.","Tuning the formation of dicarboxylate linker-assisted supramolecular 1D chains and squares of Ni(ii) using coordination and hydrogen bonds","CrystEngComm","2014","16","25","5705","","10.1039/c4ce00434e","","","0.71073","MoKα","","0.065","0.0374","","","0.0777","0.088","","","","","","1.013","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216123","9.1706","0.0009","14.658","0.0012","16.5447","0.0016","75.264","0.005","83.445","0.006","87.664","0.006","2136.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","[Ni4(bpta)4(fumarate)4(H2O)4].4H2O","","","- C80 H108 N12 Ni4 O24 -","- C80 H108 N12 Ni4 O24 -","- C80 H108 N12 Ni4 O24 -","1","0.5","","Khullar, Sadhika; Gupta, Vijay; Mandal, Sanjay K.","Tuning the formation of dicarboxylate linker-assisted supramolecular 1D chains and squares of Ni(ii) using coordination and hydrogen bonds","CrystEngComm","2014","16","25","5705","","10.1039/c4ce00434e","","","0.71073","MoKα","","0.0955","0.0452","","","0.0863","0.1123","","","","","","0.897","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216124","14.593","0.0013","9.6778","0.0007","17.2357","0.0015","90","","90","","90","","2434.2","0.4","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","[Ni(bpta)(succinate)(H2O)2].3H2O","","","- C20 H35 N3 Ni O9 -","- C20 H35 N3 Ni O9 -","- C80 H140 N12 Ni4 O36 -","4","1","","Khullar, Sadhika; Gupta, Vijay; Mandal, Sanjay K.","Tuning the formation of dicarboxylate linker-assisted supramolecular 1D chains and squares of Ni(ii) using coordination and hydrogen bonds","CrystEngComm","2014","16","25","5705","","10.1039/c4ce00434e","","","0.71073","MoKa","","0.0467","0.0354","","","0.0684","0.0734","","","","","","0.968","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216165","10.33","0.001","20.786","0.001","12.908","0.001","90","","100.697","0.001","90","","2723.4","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H19 N4 O6 Tb -","- C31 H19 N4 O6 Tb -","- C124 H76 N16 O24 Tb4 -","4","1","","Jia, Li; Hui, Yan-Chun; Li, Zongsheng; Sun, Hao-Ling; Wang, Zhenqiang","Luminescent lanthanide-2-phenylpyrimidine-carboxylate frameworks: structure and luminescence tuning","CrystEngComm","2014","16","28","6483","","10.1039/c4ce00360h","","","0.71073","MoKα","","0.0335","0.0255","","","0.0608","0.0639","","","","","","1.051","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216166","8.942","0.001","10.033","0.001","12.792","0.001","79.834","0.001","79.463","0.001","86.005","0.001","1109.74","0.19","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H15 Eu N4 O6.5 -","- C25 H14 Eu N4 O6.5 -","- C50 H28 Eu2 N8 O13 -","2","1","","Jia, Li; Hui, Yan-Chun; Li, Zongsheng; Sun, Hao-Ling; Wang, Zhenqiang","Luminescent lanthanide-2-phenylpyrimidine-carboxylate frameworks: structure and luminescence tuning","CrystEngComm","2014","16","28","6483","","10.1039/c4ce00360h","","","0.71073","MoKα","","0.0318","0.0283","","","0.0711","0.0764","","","","","","1.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216167","7.626","0.001","13.117","0.001","16.103","0.001","99.972","0.001","99.69","0.001","98.667","0.001","1536.8","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H24 N6 O7 Tb -","- C35 H24 N6 O7 Tb -","- C70 H48 N12 O14 Tb2 -","2","1","","Jia, Li; Hui, Yan-Chun; Li, Zongsheng; Sun, Hao-Ling; Wang, Zhenqiang","Luminescent lanthanide-2-phenylpyrimidine-carboxylate frameworks: structure and luminescence tuning","CrystEngComm","2014","16","28","6483","","10.1039/c4ce00360h","","","0.71073","MoKα","","0.036","0.0322","","","0.0841","0.0924","","","","","","1.075","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216168","7.666","0.001","13.178","0.001","16.123","0.001","100.232","0.001","99.576","0.001","98.785","0.001","1552.4","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H24 Eu N6 O7 -","- C35 H24 Eu N6 O7 -","- C70 H48 Eu2 N12 O14 -","2","1","","Jia, Li; Hui, Yan-Chun; Li, Zongsheng; Sun, Hao-Ling; Wang, Zhenqiang","Luminescent lanthanide-2-phenylpyrimidine-carboxylate frameworks: structure and luminescence tuning","CrystEngComm","2014","16","28","6483","","10.1039/c4ce00360h","","","0.71073","MoKα","","0.0362","0.0311","","","0.0828","0.091","","","","","","1.041","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216169","10.09","0.001","14.133","0.001","15.143","0.001","70.273","0.001","71.654","0.001","76.327","0.001","1908.8","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H29 N8 O6 Tb -","- C45 H29 N8 O6 Tb -","- C90 H58 N16 O12 Tb2 -","2","1","","Jia, Li; Hui, Yan-Chun; Li, Zongsheng; Sun, Hao-Ling; Wang, Zhenqiang","Luminescent lanthanide-2-phenylpyrimidine-carboxylate frameworks: structure and luminescence tuning","CrystEngComm","2014","16","28","6483","","10.1039/c4ce00360h","","","0.71073","MoKα","","0.0445","0.035","","","0.087","0.1008","","","","","","1.04","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216170","10.066","0.005","14.037","0.008","15.093","0.008","70.602","0.008","71.933","0.007","76.487","0.008","1891.9","1.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H29 Eu N8 O6 -","- C45 H29 Eu N8 O6 -","- C90 H58 Eu2 N16 O12 -","2","1","","Jia, Li; Hui, Yan-Chun; Li, Zongsheng; Sun, Hao-Ling; Wang, Zhenqiang","Luminescent lanthanide-2-phenylpyrimidine-carboxylate frameworks: structure and luminescence tuning","CrystEngComm","2014","16","28","6483","","10.1039/c4ce00360h","","","0.71073","MoKα","","0.0613","0.0473","","","0.1321","0.1484","","","","","","1.089","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216172","12.889","0.002","14.4316","0.0018","13.6143","0.0019","90","","105.888","0.01","90","","2435.6","0.6","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C20 H22 N2 Na2 O8 Pd -","- C20 H22 N2 Na2 O8 Pd -","- C80 H88 N8 Na8 O32 Pd4 -","4","0.5","","Fortea-Pérez, Francisco R.; Marino, Nadia; Armentano, Donatella; De Munno, Giovanni; Julve, Miguel; Stiriba, Salah-Eddine","Solid-state cis‒trans isomerism in bis(oxamato)palladate(ii) complexes: synthesis, structural studies and catalytic activity","CrystEngComm","2014","16","30","6971","","10.1039/C4CE00669K","","","0.71073","MoKα","","0.0189","0.0164","","","0.0537","0.0697","","","","","","1.332","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216173","16.317","0.002","25.271","0.002","13.9855","0.0014","90","","124.893","0.006","90","","4730.1","0.9","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C40 H42 K4 N4 O15 Pd2 -","- C40 H42 K4 N4 O15 Pd2 -","- C160 H168 K16 N16 O60 Pd8 -","4","1","","Fortea-Pérez, Francisco R.; Marino, Nadia; Armentano, Donatella; De Munno, Giovanni; Julve, Miguel; Stiriba, Salah-Eddine","Solid-state cis‒trans isomerism in bis(oxamato)palladate(ii) complexes: synthesis, structural studies and catalytic activity","CrystEngComm","2014","16","30","6971","","10.1039/C4CE00669K","","","0.71073","MoKα","","0.0203","0.0199","","","0.049","0.0493","","","","","","1.046","","","","has coordinates,has disorder","180492","2020-10-21","18:00:00",""
"7216174","16.4305","0.001","25.181","0.0019","14.1936","0.0007","90","","124.878","0.002","90","","4817.6","0.5","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C40 H42 N4 O15 Pd2 Rb4 -","- C40 H36 N4 O15 Pd2 Rb4 -","- C160 H144 N16 O60 Pd8 Rb16 -","4","1","","Fortea-Pérez, Francisco R.; Marino, Nadia; Armentano, Donatella; De Munno, Giovanni; Julve, Miguel; Stiriba, Salah-Eddine","Solid-state cis‒trans isomerism in bis(oxamato)palladate(ii) complexes: synthesis, structural studies and catalytic activity","CrystEngComm","2014","16","30","6971","","10.1039/C4CE00669K","","","0.71073","MoKα","","0.0647","0.0628","","","0.1924","0.1973","","","","","","1.063","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216175","24.874","0.005","24.355","0.005","26.539","0.005","90","","90","","90","","16077","6","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C60 H74 Cs6 N6 O28 Pd3 -","- C60 H54 Cs6 N6 O28 Pd3 -","- C480 H432 Cs48 N48 O224 Pd24 -","8","1","","Fortea-Pérez, Francisco R.; Marino, Nadia; Armentano, Donatella; De Munno, Giovanni; Julve, Miguel; Stiriba, Salah-Eddine","Solid-state cis‒trans isomerism in bis(oxamato)palladate(ii) complexes: synthesis, structural studies and catalytic activity","CrystEngComm","2014","16","30","6971","","10.1039/C4CE00669K","","","0.71073","MoKα","","0.1011","0.0681","","","0.2282","0.2592","","","","","","1.075","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216176","16.4083","0.0006","22.4457","0.0012","13.474","0.0004","90","","124.48","0.001","90","","4090.6","0.3","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C20 H20 N2 Na2 O7 Pd -","- C20 H18 N2 Na2 O7 Pd -","- C160 H144 N16 Na16 O56 Pd8 -","8","2","","Fortea-Pérez, Francisco R.; Marino, Nadia; Armentano, Donatella; De Munno, Giovanni; Julve, Miguel; Stiriba, Salah-Eddine","Solid-state cis–trans isomerism in bis(oxamato)palladate(ii) complexes: synthesis, structural studies and catalytic activity","CrystEngComm","2014","16","30","6971","","10.1039/C4CE00669K","","","0.71073","MoKα","","0.0294","0.0286","","","0.0747","0.0812","","","","","","1.08","","","","has coordinates","287753","2023-11-23","09:34:45",""
"7216177","7.7195","0.0005","8.2128","0.0005","26.4533","0.0017","90","","90","","90","","1677.11","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 N2 O8 -","- C14 H20 N2 O8 -","- C56 H80 N8 O32 -","4","1","","Karmakar, Anirban; Oliver, Clive L.; Platero-Prats, Ana E.; Laurila, Elina; Öhrström, Lars","Crystal structures and hydrogen bond analysis of five amino acid conjugates of terephthalic and benzene-1,2,3-tricarboxylic acids","CrystEngComm","2014","16","35","8243","","10.1039/C4CE00605D","","","0.71073","MoKα","","0.1123","0.0678","","","0.1084","0.121","","","","","","1.084","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216178","6.9544","0.0005","11.7552","0.0008","26.8723","0.0019","90","","90","","90","","2196.8","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H30 N2 O7 -","- C20 H30 N2 O7 -","- C80 H120 N8 O28 -","4","1","","Karmakar, Anirban; Oliver, Clive L.; Platero-Prats, Ana E.; Laurila, Elina; Öhrström, Lars","Crystal structures and hydrogen bond analysis of five amino acid conjugates of terephthalic and benzene-1,2,3-tricarboxylic acids","CrystEngComm","2014","16","35","8243","","10.1039/C4CE00605D","","","0.71073","MoKα","","0.1196","0.0615","","","0.1383","0.1635","","","","","","1.016","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216179","12.374","0.003","7.6754","0.0015","12.714","0.003","90","","107.15","0.03","90","","1153.8","0.5","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H32 N2 O8 -","- C20 H32 N2 O8 -","- C40 H64 N4 O16 -","2","1","","Karmakar, Anirban; Oliver, Clive L.; Platero-Prats, Ana E.; Laurila, Elina; Öhrström, Lars","Crystal structures and hydrogen bond analysis of five amino acid conjugates of terephthalic and benzene-1,2,3-tricarboxylic acids","CrystEngComm","2014","16","35","8243","","10.1039/C4CE00605D","","","0.71073","MoKα","","0.0761","0.0489","","","0.1206","0.1456","","","","","","1.217","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216180","10.5665","0.001","7.6596","0.0007","12.8714","0.0011","90","","106.949","0.002","90","","996.5","0.16","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H28 N2 O8 -","- C18 H28 N2 O8 -","- C36 H56 N4 O16 -","2","1","","Karmakar, Anirban; Oliver, Clive L.; Platero-Prats, Ana E.; Laurila, Elina; Öhrström, Lars","Crystal structures and hydrogen bond analysis of five amino acid conjugates of terephthalic and benzene-1,2,3-tricarboxylic acids","CrystEngComm","2014","16","35","8243","","10.1039/C4CE00605D","","","0.71073","MoKα","","0.1041","0.0816","","","0.2045","0.2254","","","","","","1.027","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216181","18.3488","0.0005","18.3488","0.0005","11.1379","0.0006","90","","90","","120","","3247.5","0.2","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C18 H21.57 N3 O9.28 -","- C18 H21 N3 O9 -","- C108 H126 N18 O54 -","6","0.333333","","Karmakar, Anirban; Oliver, Clive L.; Platero-Prats, Ana E.; Laurila, Elina; Öhrström, Lars","Crystal structures and hydrogen bond analysis of five amino acid conjugates of terephthalic and benzene-1,2,3-tricarboxylic acids","CrystEngComm","2014","16","35","8243","","10.1039/C4CE00605D","","","0.71073","MoKα","","0.093","0.0889","","","0.2394","0.2413","","","","","","1.25","","","","has coordinates,has disorder","180492","2020-10-21","18:00:00",""
"7216182","24.552","0.005","17.135","0.003","19.302","0.004","90","","111.1","0.03","90","","7576","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C9 H66 Ge2 K2 Mo16 N6 O71 -","- C9 H33 Ge2 K Mo16 N6 O71 -","- C36 H132 Ge8 K4 Mo64 N24 O284 -","4","0.5","","Gao, Yan-Qing; Zhang, Zhi-Ming; Shen, Jian-Qiang; Jia, Yue; Liu, Zhu-Jun; Wang, En-Bo","Self-assembly and thermotropic liquid crystal properties of a hexavacant germanomolybdate: [Ge2Mo16O58]12−","CrystEngComm","2014","16","29","6784","","10.1039/c4ce00536h","","","0.71073","MoKα","","0.0646","0.0464","","","0.1322","0.144","","","","","","0.983","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216183","21.051","0.004","15.483","0.003","13.472","0.003","90","","103.62","0.03","90","","4267.5","1.6","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Ge2 H60 Mo16 Na12 O88 -","- Ge2 Mo16 Na12 O88 -","- Ge4 Mo32 Na24 O176 -","2","0.25","","Gao, Yan-Qing; Zhang, Zhi-Ming; Shen, Jian-Qiang; Jia, Yue; Liu, Zhu-Jun; Wang, En-Bo","Self-assembly and thermotropic liquid crystal properties of a hexavacant germanomolybdate: [Ge2Mo16O58]12−","CrystEngComm","2014","16","29","6784","","10.1039/c4ce00536h","","","0.71073","MoKα","","0.0453","0.0399","","","0.1212","0.1237","","","","","","1.091","","","","has coordinates,has disorder","180492","2020-10-21","18:00:00",""
"7216196","10.1044","0.0005","18.7022","0.0008","26.5462","0.0012","90","","98.448","0.002","90","","4962.1","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H52 Cl2 Hg2 N8 O12 -","- C36 H52 Cl2 Hg2 N8 O12 -","- C144 H208 Cl8 Hg8 N32 O48 -","4","0.5","","Pati, Anita; Athilakshmi, Jeyaraman; Ramkumar, Venkatachalam; Chand, Dillip Kumar","A two-dimensional polydodecameric water‒chloride cluster enfolding (Hg‒Cl‒Hg)+concealed cascade cryptate","CrystEngComm","2014","16","30","6827","","10.1039/C4CE00802B","","","0.71073","MoKα","","0.0509","0.0407","","","0.1012","0.1059","","","","","","1.098","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216197","16.052","0.009","21.298","0.012","8.932","0.005","90","","99.1","0.02","90","","3015","3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H76 Cl3 Hg2 N8 O2 -","- C54 H76 Cl3 Hg2 N8 O2 -","- C108 H152 Cl6 Hg4 N16 O4 -","2","0.5","","Pati, Anita; Athilakshmi, Jeyaraman; Ramkumar, Venkatachalam; Chand, Dillip Kumar","A two-dimensional polydodecameric water‒chloride cluster enfolding (Hg‒Cl‒Hg)+concealed cascade cryptate","CrystEngComm","2014","16","30","6827","","10.1039/C4CE00802B","","","0.71073","MoKα","","0.1549","0.0871","","","0.2432","0.3047","","","","","","1.025","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216198","7.019","0.003","28.604","0.003","5.964","0.003","90","","91.808","0.008","90","","1196.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 Cu N2 O4 -","- C13 H10 Cu N2 O4 -","- C52 H40 Cu4 N8 O16 -","4","1","","Pasán, Jorge; Sanchiz, Joaquín; Fabelo, Óscar; Cañadillas-Delgado, Laura; Déniz, Mariadel; Díaz-Gallifa, Pau; Martínez-Benito, Carla; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Influence of the coligand in the magnetic properties of a series of copper(ii)‒phenylmalonate complexes","CrystEngComm","2014","16","35","8106","","10.1039/C4CE00834K","","x-ray","0.71073","MoKα","","0.0742","0.06","","","0.128","0.1327","","","","","","1.214","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216199","6.9188","0.0008","31.18","0.012","6.2103","0.0011","90","","93.463","0.015","90","","1337.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 Cu N2 O4 -","- C15 H10 Cu N2 O4 -","- C60 H40 Cu4 N8 O16 -","4","1","","Pasán, Jorge; Sanchiz, Joaquín; Fabelo, Óscar; Cañadillas-Delgado, Laura; Déniz, Mariadel; Díaz-Gallifa, Pau; Martínez-Benito, Carla; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Influence of the coligand in the magnetic properties of a series of copper(ii)‒phenylmalonate complexes","CrystEngComm","2014","16","35","8106","","10.1039/C4CE00834K","","x-ray","0.71073","MoKα","","0.0865","0.0578","","","0.1369","0.1475","","","","","","1.013","","","","has coordinates","180492","2020-10-21","18:00:00",""
"7216200","6.3297","0.0002","31.7864","0.0011","6.939","0.0002","90","","92.732","0.003","90","","1394.53","0.08","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 Cu N2 O4 -","- C15 H10 Cu N2 O4 -","- C60 H40 Cu4 N8 O16 -","4","1","","Pasán, Jorge; Sanchiz, Joaquín; Fabelo, Óscar; Cañadillas-Delgado, Laura; Déniz, Mariadel; Díaz-Gallifa, Pau; Martínez-Benito, Carla; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Influence of the coligand in the magnetic properties of a series of copper(ii)‒phenylmalonate complexes","CrystEngComm","2014","16","35","8106","","10.1039/C4CE00834K","","x-ray","1.54184","CuKα","","0.038","0.0323","","","0.0827","0.0867","","","","","","1.028","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216201","6.2264","0.0011","30.6016","0.0017","6.9804","0.0012","90","","93.297","0.013","90","","1327.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Cl Cu N O4 -","- C14 H10 Cl Cu N O4 -","- C56 H40 Cl4 Cu4 N4 O16 -","4","1","","Pasán, Jorge; Sanchiz, Joaquín; Fabelo, Óscar; Cañadillas-Delgado, Laura; Déniz, Mariadel; Díaz-Gallifa, Pau; Martínez-Benito, Carla; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Influence of the coligand in the magnetic properties of a series of copper(ii)‒phenylmalonate complexes","CrystEngComm","2014","16","35","8106","","10.1039/C4CE00834K","","x-ray","0.71073","MoKα","","0.1535","0.0876","","","0.1791","0.196","","","","","","1.148","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216202","6.2413","0.0002","31.0345","0.0007","6.9777","0.0002","90","","93.573","0.002","90","","1348.92","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Br Cu N O4 -","- C14 H10 Br Cu N O4 -","- C56 H40 Br4 Cu4 N4 O16 -","4","1","","Pasán, Jorge; Sanchiz, Joaquín; Fabelo, Óscar; Cañadillas-Delgado, Laura; Déniz, Mariadel; Díaz-Gallifa, Pau; Martínez-Benito, Carla; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Influence of the coligand in the magnetic properties of a series of copper(ii)‒phenylmalonate complexes","CrystEngComm","2014","16","35","8106","","10.1039/C4CE00834K","","x-ray","1.54184","CuKα","","0.0604","0.0574","","","0.1675","0.1707","","","","","","1.184","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216203","6.2716","0.0002","31.968","0.0007","6.9916","0.0002","90","","93.949","0.002","90","","1398.42","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Cu I N O4 -","- C14 H10 Cu I N O4 -","- C56 H40 Cu4 I4 N4 O16 -","4","1","","Pasán, Jorge; Sanchiz, Joaquín; Fabelo, Óscar; Cañadillas-Delgado, Laura; Déniz, Mariadel; Díaz-Gallifa, Pau; Martínez-Benito, Carla; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Influence of the coligand in the magnetic properties of a series of copper(ii)‒phenylmalonate complexes","CrystEngComm","2014","16","35","8106","","10.1039/C4CE00834K","","x-ray","1.54184","CuKα","","0.0524","0.0491","","","0.1364","0.1392","","","","","","1.181","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216204","6.8019","0.0004","14.4384","0.0008","19.8727","0.0012","90.46","0.002","99.276","0.002","101.46","0.002","1886.13","0.19","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H18 N5 O4.5 S -","- C18 H18 N5 O4.5 S -","- C72 H72 N20 O18 S4 -","4","2","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.1543","0.0567","","","","0.0996","","","","","","0.949","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216205","8.151","0.0005","26.5997","0.0017","10.1579","0.0007","90","","113.394","0.003","90","","2021.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 N6 O4 S -","- C20 H20 N6 O4 S -","- C80 H80 N24 O16 S4 -","4","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.0798","0.0601","","","","0.1699","","","","","","1.146","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216206","6.9103","0.0001","22.1444","0.0005","25.1813","0.0005","90","","97.068","0.001","90","","3824.07","0.13","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C74 H71 N21 O16 S4 -","- C74 H71 N21 O16 S4 -","- C148 H142 N42 O32 S8 -","2","0.5","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.1322","0.0572","","","0.1219","0.1456","","","","","","0.978","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7216207","10.9928","0.0008","15.3135","0.0015","12.551","0.001","90","","112.039","0.004","90","","1958.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N5 O4 S -","- C19 H19 N5 O4 S -","- C76 H76 N20 O16 S4 -","4","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.1021","0.0567","","","0.1151","0.1309","","","","","","0.985","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216208","12.005","0.003","13.789","0.003","13.81","0.004","72.186","0.007","68.682","0.007","80.962","0.007","2024.8","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H19 N5 O4 S -","- C22 H19 N5 O4 S -","- C88 H76 N20 O16 S4 -","4","2","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.1858","0.0618","","","","0.102","","","","","","0.887","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216209","6.9267","0.0002","8.3356","0.0003","28.8177","0.001","86.485","0.002","84.209","0.002","76.271","0.001","1606.89","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H29 N9 O8 S2 -","- C32 H29 N9 O8 S2 -","- C64 H58 N18 O16 S4 -","2","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.0916","0.0616","","","0.1327","0.1457","","","","","","1.096","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216210","11.6101","0.0006","26.2908","0.0015","6.771","0.0003","90","","103.48","0.003","90","","2009.84","0.18","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 N6 O4 S -","- C21 H18 N6 O4 S -","- C84 H72 N24 O16 S4 -","4","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.0721","0.0546","","","","0.1538","","","","","","1.081","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216211","6.792","0.011","8.646","0.015","29.66","0.05","94.159","0.011","90.513","0.018","104.78","0.04","1679","5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H30 N8 O8 S2 -","- C34 H30 N8 O8 S2 -","- C68 H60 N16 O16 S4 -","2","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.6889","synchrotron","","0.2644","0.1739","","","","0.4876","","","","","","1.239","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216212","9.1504","0.0004","10.9678","0.0004","11.7747","0.0005","89.228","0.002","75.765","0.002","70.977","0.002","1080","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H15 Cl2 N3 O8 S -","- C21 H15 Cl2 N3 O8 S -","- C42 H30 Cl4 N6 O16 S2 -","2","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.0586","0.0376","","","0.0844","0.0909","","","","","","0.945","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216213","8.5627","0.0005","13.3395","0.0007","19.3963","0.0012","90","","100.925","0.003","90","","2175.3","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Cl2 N3 O8 S -","- C21 H15 Cl2 N3 O8 S -","- C84 H60 Cl8 N12 O32 S4 -","4","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.0797","0.0397","","","0.0678","0.0762","","","","","","0.922","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216214","7.0616","0.0008","11.6031","0.0013","13.2994","0.0017","71.351","0.005","84.932","0.005","78.919","0.005","1012.8","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H17 Cl N4 O6 S -","- C20 H17 Cl N4 O6 S -","- C40 H34 Cl2 N8 O12 S2 -","2","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.0896","0.045","","","","0.1065","","","","","","0.984","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216215","8.8422","0.0017","13.437","0.002","19.242","0.004","90","","100.518","0.011","90","","2247.8","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Br2 N3 O8 S -","- C21 H15 Br2 N3 O8 S -","- C84 H60 Br8 N12 O32 S4 -","4","1","","Thomas, Lynne H.; Klapwijk, Anneke R.; Wales, Craig; Wilson, Chick C.","Intermolecular hydrogen transfer and solubility tuning in multi-component molecular crystals of the API piroxicam","CrystEngComm","2014","16","26","5924","","10.1039/c4ce00246f","","","0.71073","MoKα","","0.049","0.0319","","","","0.0785","","","","","","0.935","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216216","8.0679","0.0009","16.014","0.0017","3.5224","0.0004","90","","101.112","0.001","90","","446.56","0.09","293","2","293","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Ca4 O10 Tm -","- B3 Ca4.021 O10 Tm1.005 -","- B6 Ca8.042 O20 Tm2.01 -","2","0.5","","Liu, Yanqing; Yu, Fapeng; Wang, Zhengping; Hou, Shuai; Yang, Lei; Xu, Xinguang; Zhao, Xian","Bulk growth and nonlinear optical properties of thulium calcium oxyborate single crystals","CrystEngComm","2014","16","30","7141","","10.1039/C4CE00869C","","","0.71069","MoKα","","0.0152","0.0152","","","0.0359","0.0359","","","","","","0.869","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216217","13.6451","0.0019","13.6451","0.0019","17.203","0.003","90","","90","","120","","2773.9","0.7","293","2","293","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","","","- C36 H90 Fe6 N6 O27 -","- C36 H72 Fe6 N6 O27 -","- C72 H144 Fe12 N12 O54 -","2","0.166667","","Liu, Sui-Jun; Han, Song-De; Jia, Ji-Min; Xue, Li; Cui, Yu; Zhang, Shu-Ming; Chang, Ze","Step-by-step synthesis of one Fe6 wheel and two Fe10 clusters derived from a multidentate triethanolamine ligand","CrystEngComm","2014","16","24","5212","","10.1039/c3ce42381f","","","0.71073","MoKα","","0.0674","0.0593","","","0.1388","0.1427","","","","","","1.189","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216218","37.09","0.02","11.39","0.007","29.307","0.016","90","","90.01","0.001","90","","12381","12","113","2","386","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H80 Fe10 N6 O34 -","- C42 H78 Fe10 N6 O34 -","- C336 H624 Fe80 N48 O272 -","8","1","","Liu, Sui-Jun; Han, Song-De; Jia, Ji-Min; Xue, Li; Cui, Yu; Zhang, Shu-Ming; Chang, Ze","Step-by-step synthesis of one Fe6 wheel and two Fe10 clusters derived from a multidentate triethanolamine ligand","CrystEngComm","2014","16","24","5212","","10.1039/c3ce42381f","","","0.71073","MoKα","","0.1286","0.0991","","","0.1801","0.2036","","","","","","1.005","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7216219","11.154","0.002","29.642","0.006","21.965","0.004","90","","104.05","0.03","90","","7045","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H87 Cl4 Fe10 N7 O27 -","- C43 H84 Cl4 Fe10 N7 O27 -","- C172 H336 Cl16 Fe40 N28 O108 -","4","1","","Liu, Sui-Jun; Han, Song-De; Jia, Ji-Min; Xue, Li; Cui, Yu; Zhang, Shu-Ming; Chang, Ze","Step-by-step synthesis of one Fe6 wheel and two Fe10 clusters derived from a multidentate triethanolamine ligand","CrystEngComm","2014","16","24","5212","","10.1039/c3ce42381f","","","0.71073","MoKα","","0.1104","0.0811","","","0.2013","0.2186","","","","","","1.098","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216220","11.597","0.004","22.299","0.007","13.655","0.005","90","","94.344","0.006","90","","3521","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 Cl Fe N24 O14 -","- C18 H32 Cl Fe N24 O14 -","- C72 H128 Cl4 Fe4 N96 O56 -","4","1","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0751","0.0502","","","0.1376","0.1497","","","","","","0.993","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216221","13.4174","0.0006","18.1772","0.0007","22.334","0.0008","90","","90","","90","","5447.1","0.4","293","2","293","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C22 H22 Fe K N4 O14 -","- C22 H22 Fe K N4 O14 -","- C176 H176 Fe8 K8 N32 O112 -","8","0.5","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.085","0.0449","","","0.09","0.1041","","","","","","1.043","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216222","7.599","0.0005","11.7318","0.0007","16.7071","0.001","88.582","0.001","88.202","0.001","71.4","0.001","1410.78","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H23 Fe N4 O11 -","- C28 H23 Fe N4 O11 -","- C56 H46 Fe2 N8 O22 -","2","1","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0543","0.0435","","","0.1233","0.1298","","","","","","1.013","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216223","10.6758","0.0008","10.7457","0.0008","10.8774","0.0009","113.219","0.008","109.138","0.007","99.294","0.006","1020.84","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H32 Cl4 Fe2 N8 O12 -","- C34 H32 Cl4 Fe2 N8 O12 -","- C34 H32 Cl4 Fe2 N8 O12 -","1","0.5","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0877","0.0498","","","0.1086","0.1294","","","","","","1.02","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216224","14.7637","0.0012","20.5458","0.0015","9.5211","0.0008","90","","107.412","0.009","90","","2755.7","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H24 Fe K N4 O14 -","- C22 H24 Fe K N4 O14 -","- C88 H96 Fe4 K4 N16 O56 -","4","0.5","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0381","0.0315","","","0.0771","0.0801","","","","","","1.03","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7216225","14.7204","0.0005","16.3987","0.0006","18.7939","0.0007","90","","103.259","0.001","90","","4415.8","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H18 Fe K N4 O13 -","- C16 H18 Fe K N4 O13 -","- C128 H144 Fe8 K8 N32 O104 -","8","1","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0382","0.0339","","","0.0906","0.0932","","","","","","1.093","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216226","14.5197","0.001","12.4744","0.0008","9.3796","0.0007","90","","109.26","0.008","90","","1603.8","0.2","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H9 Fe N6 O4 -","- C14 H9 Fe N6 O4 -","- C56 H36 Fe4 N24 O16 -","4","1","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0492","0.042","","","0.0862","0.0921","","","","","","1.012","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216227","7.6299","0.0006","8.1873","0.0007","10.0309","0.0009","107.527","0.008","100.261","0.007","95.27","0.007","580.85","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H26 Fe2 N4 O20 -","- C12 H26 Fe2 N4 O20 -","- C12 H26 Fe2 N4 O20 -","1","0.5","","Wang, Lei; Wang, Wenqiang; Guo, Dong; Zhang, Ao; Song, Yaoguang; Zhang, Yiheng; Huang, Keke","Design and syntheses of hybrid supramolecular architectures: based on [Fe(C2O4)3]3− metallotectons and diverse organic cations","CrystEngComm","2014","16","24","5437","","10.1039/c4ce00357h","","","0.71073","MoKα","","0.0434","0.0355","","","0.0889","0.094","","","","","","1.065","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216228","11.539","0.003","11.562","0.003","14.283","0.003","99.419","0.003","96.191","0.003","117.938","0.003","1623.1","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H48 N16 O19 Zn5 -","- C62 H46 N16 O19 Zn5 -","- C62 H46 N16 O19 Zn5 -","1","0.5","","Hua, Ji-Ai; Zhao, Yue; Liu, Qing; Zhao, Dan; Chen, Kai; Sun, Wei-Yin","Zinc(ii) coordination polymers with substituted benzenedicarboxylate and tripodal imidazole ligands: syntheses, structures and properties","CrystEngComm","2014","16","32","7536","","10.1039/C4CE00835A","","","0.71073","MoKα","","0.0896","0.0663","","","0.1852","0.2045","","","","","","1.019","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7216229","7.999","0.01","11.703","0.005","17.386","0.002","104.387","0.002","98.557","0.002","96.306","0.002","1541","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H31 N7 O15 S Zn2 -","- C23 H31 N7 O15 S Zn2 -","- C46 H62 N14 O30 S2 Zn4 -","2","1","","Hua, Ji-Ai; Zhao, Yue; Liu, Qing; Zhao, Dan; Chen, Kai; Sun, Wei-Yin","Zinc(ii) coordination polymers with substituted benzenedicarboxylate and tripodal imidazole ligands: syntheses, structures and properties","CrystEngComm","2014","16","32","7536","","10.1039/C4CE00835A","","","0.71073","MoKα","","0.0417","0.0368","","","0.0975","0.1008","","","","","","1.034","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216230","14.6517","0.0016","7.8277","0.0008","22.551","0.002","90","","90.01","0.02","90","","2586.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H42 N12 O17 Zn2 -","- C54 H38 N12 O17 Zn2 -","- C108 H76 N24 O34 Zn4 -","2","0.5","","Hua, Ji-Ai; Zhao, Yue; Liu, Qing; Zhao, Dan; Chen, Kai; Sun, Wei-Yin","Zinc(ii) coordination polymers with substituted benzenedicarboxylate and tripodal imidazole ligands: syntheses, structures and properties","CrystEngComm","2014","16","32","7536","","10.1039/C4CE00835A","","","0.71073","MoKα","","0.0512","0.0393","","","0.115","0.1341","","","","","","1.075","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7216231","10.426","0.005","18.99","0.01","11.711","0.006","90","","96.875","0.01","90","","2302","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H17 N7 O7 Zn -","- C23 H15 N7 O7 Zn -","- C92 H60 N28 O28 Zn4 -","4","1","","Hua, Ji-Ai; Zhao, Yue; Liu, Qing; Zhao, Dan; Chen, Kai; Sun, Wei-Yin","Zinc(ii) coordination polymers with substituted benzenedicarboxylate and tripodal imidazole ligands: syntheses, structures and properties","CrystEngComm","2014","16","32","7536","","10.1039/C4CE00835A","","","0.71073","MoKα","","0.0328","0.0297","","","0.0829","0.0851","","","","","","1.039","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216232","17.5405","0.0009","17.5405","0.0009","76.087","0.003","90","","90","","120","","20273.3","1.7","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C48 H12 Co9 Li3 N36 O54 -","- C48 H12 Co9 Li3 N36 O54 -","- C288 H72 Co54 Li18 N216 O324 -","6","0.166667","","Zou, Ji-Yong; Shi, Wei; Zhang, Jing-Ya; He, Yan-Fei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng","Alkaline cation directed structural diversity of cubic-cage-based cobalt(ii) metal‒organic frameworks: from pcu to bct net","CrystEngComm","2014","16","30","7133","","10.1039/C4CE00597J","","","0.71073","MoKα","","0.1077","0.062","","","0.1614","0.1806","","","","","","0.952","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7216233","17.6972","0.0011","17.6972","0.0011","76.397","0.005","90","","90","","120","","20721","2","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C48 H12 Co9 Li3 N36 O54 -","- C48 H12 Co9 Li3 N36 O54 -","- C288 H72 Co54 Li18 N216 O324 -","6","0.166667","","Zou, Ji-Yong; Shi, Wei; Zhang, Jing-Ya; He, Yan-Fei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng","Alkaline cation directed structural diversity of cubic-cage-based cobalt(ii) metal‒organic frameworks: from pcu to bct net","CrystEngComm","2014","16","30","7133","","10.1039/C4CE00597J","","","0.71073","MoKα","","0.1139","0.0553","","","0.1475","0.168","","","","","","0.903","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216234","28.9159","0.0013","18.0006","0.0012","28.5482","0.0014","90","","110.501","0.005","90","","13918.3","1.4","126.1","0.3","126.1","0.3","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H4 Co8 K5 N36 O51 -","- C48 H4 Co8 K5 N36 O51 -","- C192 H16 Co32 K20 N144 O204 -","4","0.5","","Zou, Ji-Yong; Shi, Wei; Zhang, Jing-Ya; He, Yan-Fei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng","Alkaline cation directed structural diversity of cubic-cage-based cobalt(ii) metal‒organic frameworks: from pcu to bct net","CrystEngComm","2014","16","30","7133","","10.1039/C4CE00597J","","","0.71073","MoKα","","0.1219","0.0785","","","0.227","0.2515","","","","","","0.971","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216241","7.673","0.006","13.318","0.011","16.25","0.014","90","","90","","90","","1661","2","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","COCRYSTAL 1","","","- C12 H13 Cl N6 O5 S2 -","- C12 H13 Cl N6 O5 S2 -","- C48 H52 Cl4 N24 O20 S8 -","4","1","","Wang, Jian-Rong; Ye, Chanjuan; Mei, Xuefeng","Structural and physicochemical aspects of hydrochlorothiazide co-crystals","CrystEngComm","2014","16","30","6996","","10.1039/C4CE00666F","","","0.71073","MoKα","","0.112","0.0538","","","0.0996","0.1215","","","","","","1.022","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216242","7.5201","0.0011","18.295","0.003","17.782","0.003","90","","93.534","0.009","90","","2441.8","0.7","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","COCRYSTAL 5","","","- C22 H22 Cl N6 O5 S2 -","- C22 H22 Cl N6 O5 S2 -","- C88 H88 Cl4 N24 O20 S8 -","4","1","","Wang, Jian-Rong; Ye, Chanjuan; Mei, Xuefeng","Structural and physicochemical aspects of hydrochlorothiazide co-crystals","CrystEngComm","2014","16","30","6996","","10.1039/C4CE00666F","","","0.71073","MoKα","","0.1023","0.0481","","","0.0986","0.1148","","","","","","0.939","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216243","10.676","0.002","23.734","0.005","8.556","0.0016","90","","95.786","0.008","90","","2156.9","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","COCRYSTAL 6","","","- C19 H20 Cl N5 O4 S2 -","- C19 H20 Cl N5 O4 S2 -","- C76 H80 Cl4 N20 O16 S8 -","4","1","","Wang, Jian-Rong; Ye, Chanjuan; Mei, Xuefeng","Structural and physicochemical aspects of hydrochlorothiazide co-crystals","CrystEngComm","2014","16","30","6996","","10.1039/C4CE00666F","","","0.71073","MoKα","","0.1882","0.0673","","","0.0858","0.1114","","","","","","1.017","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216244","11.2718","0.0014","26.189","0.003","21.16","0.003","90","","93.349","0.009","90","","6235.7","1.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","HCTEN","","","- C31 H32 Cl N7 O4 S2 -","- C31 H28 Cl N7 O4 S2 -","- C248 H224 Cl8 N56 O32 S16 -","8","2","","Wang, Jian-Rong; Ye, Chanjuan; Mei, Xuefeng","Structural and physicochemical aspects of hydrochlorothiazide co-crystals","CrystEngComm","2014","16","30","6996","","10.1039/C4CE00666F","","","0.71073","MoKα","","0.2088","0.0912","","","0.2063","0.2664","","","","","","1.022","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216245","9.0139","0.0003","21.2524","0.0008","22.2753","0.0008","90","","90","","90","","4267.2","0.3","120","0.2","120","0.2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","disodium guanosine-5-phosphate heptahydrate","","- C10 H26 N5 Na2 O15 P -","- C10 H26 N5 Na2 O15 P -","- C80 H208 N40 Na16 O120 P8 -","8","2","","Dračínský, Martin; Šála, Michal; Hodgkinson, Paul","Dynamics of water molecules and sodium ions in solid hydrates of nucleotides","CrystEngComm","2014","16","29","6756","","10.1039/c4ce00727a","","","0.71073","MoKα","","0.116","0.0794","","","0.1792","0.2118","","","","","","1.029","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216246","17.125","0.003","14.6887","0.0018","7.0147","0.0011","90","","93.338","0.016","90","","1761.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H21 N4 O2 P S2 -","- C12 H21 N4 O2 P S2 -","- C48 H84 N16 O8 P4 S8 -","4","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.1248","0.1007","","","0.2267","0.2412","","","","","","0.996","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216247","6.8774","0.0005","14.6409","0.0014","15.1569","0.0012","70.775","0.008","89.447","0.006","83.841","0.007","1432.2","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H31 N4 O5 P S2 -","- C26 H31 N4 O5 P S2 -","- C52 H62 N8 O10 P2 S4 -","2","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.0695","0.052","","","0.1332","0.1447","","","","","","1.04","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216248","8.5874","0.0007","11.9114","0.0014","12.8574","0.0015","98.428","0.01","109.104","0.009","96.547","0.008","1210.7","0.2","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H24 Cl N4 O3 P S2 -","- C19 H24 Cl N4 O3 P S2 -","- C38 H48 Cl2 N8 O6 P2 S4 -","2","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.0583","0.0463","","","0.1191","0.1261","","","","","","1.05","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216249","8.5957","0.0013","11.821","0.002","12.807","0.002","98.558","0.015","108.643","0.015","97.79","0.015","1195.8","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H24 Br N4 O3 P S2 -","- C19 H24 Br N4 O3 P S2 -","- C38 H48 Br2 N8 O6 P2 S4 -","2","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.048","0.0424","","","0.1101","0.1141","","","","","","1.037","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216250","9.0052","0.0008","11.7572","0.001","12.3225","0.0011","98.558","0.007","106.445","0.007","97.06","0.007","1218.5","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H23 Cl2 N4 O3 P S2 -","- C19 H23 Cl2 N4 O3 P S2 -","- C38 H46 Cl4 N8 O6 P2 S4 -","2","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.0567","0.0436","","","0.0955","0.1001","","","","","","1.104","","","","has coordinates,has disorder","180493","2020-10-21","18:00:00",""
"7216251","25.4932","0.0013","8.2482","0.0005","25.1957","0.0014","90","","101.28","0.004","90","","5195.6","0.5","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 Br2 N4 O3.5 P S2 -","- C20 H26 Br2 N4 O3.5 P S2 -","- C160 H208 Br16 N32 O28 P8 S16 -","8","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.0821","0.0546","","","0.1208","0.1318","","","","","","1.027","","","","has coordinates","180493","2020-10-21","18:00:00",""
"7216341","10.3636","0.0009","12.2034","0.0011","14.0163","0.0012","89.208","0.002","73.739","0.001","75.875","0.001","1647.5","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H26 Co N4 O8 -","- C40 H26 Co N4 O8 -","- C80 H52 Co2 N8 O16 -","2","1","","Fan, Liming; Gao, Yan; Liu, Guangzeng; Fan, Weiliu; Song, Weikuo; Sun, Liming; Zhao, Xian; Zhang, Xiutang","Syntheses, structures, and magnetic properties of six coordination polymers based on 4,5-di(4′-carboxylphenyl)phthalic acid and different bis(imidazole) bridging linkers","CrystEngComm","2014","16","33","7649","","10.1039/C4CE00760C","","","0.71073","MoKα","","0.0621","0.0439","","","0.111","0.1297","","","","","","1.003","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216342","19.7798","0.0006","12.5466","0.0011","25.8545","0.0006","90","","110.619","0.003","90","","6005.3","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H20 Co2 N4 O8 -","- C34 H20 Co2 N4 O8 -","- C272 H160 Co16 N32 O64 -","8","1","","Fan, Liming; Gao, Yan; Liu, Guangzeng; Fan, Weiliu; Song, Weikuo; Sun, Liming; Zhao, Xian; Zhang, Xiutang","Syntheses, structures, and magnetic properties of six coordination polymers based on 4,5-di(4′-carboxylphenyl)phthalic acid and different bis(imidazole) bridging linkers","CrystEngComm","2014","16","33","7649","","10.1039/C4CE00760C","","","0.71073","MoKα","","0.0674","0.0433","","","0.1093","0.1228","","","","","","0.998","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216343","14.649","0.002","13.47","0.002","24.399","0.004","90","","106.607","0.003","90","","4613.6","1.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H42 N8 Ni O9 -","- C50 H42 N8 Ni O9 -","- C200 H168 N32 Ni4 O36 -","4","1","","Fan, Liming; Gao, Yan; Liu, Guangzeng; Fan, Weiliu; Song, Weikuo; Sun, Liming; Zhao, Xian; Zhang, Xiutang","Syntheses, structures, and magnetic properties of six coordination polymers based on 4,5-di(4′-carboxylphenyl)phthalic acid and different bis(imidazole) bridging linkers","CrystEngComm","2014","16","33","7649","","10.1039/C4CE00760C","","","0.71073","MoKα","","0.0601","0.0409","","","0.0976","0.1079","","","","","","1","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216344","33.6935","0.0018","11.1225","0.0006","27.5859","0.0014","90","","114.027","0.001","90","","9442.2","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H38 Co2 N8 O8 -","- C58 H38 Co2 N8 O8 -","- C464 H304 Co16 N64 O64 -","8","1","","Fan, Liming; Gao, Yan; Liu, Guangzeng; Fan, Weiliu; Song, Weikuo; Sun, Liming; Zhao, Xian; Zhang, Xiutang","Syntheses, structures, and magnetic properties of six coordination polymers based on 4,5-di(4′-carboxylphenyl)phthalic acid and different bis(imidazole) bridging linkers","CrystEngComm","2014","16","33","7649","","10.1039/C4CE00760C","","","0.71073","MoKα","","0.0726","0.0441","","","0.1063","0.124","","","","","","1","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216345","7.7686","0.0011","13.6512","0.0007","19.8766","0.0011","99.25","0.003","94.563","0.003","97.512","0.003","2051.7","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C80 H80 N12 Ni3 O30 -","- C80 H80 N12 Ni3 O30 -","- C80 H80 N12 Ni3 O30 -","1","0.5","","Fan, Liming; Gao, Yan; Liu, Guangzeng; Fan, Weiliu; Song, Weikuo; Sun, Liming; Zhao, Xian; Zhang, Xiutang","Syntheses, structures, and magnetic properties of six coordination polymers based on 4,5-di(4′-carboxylphenyl)phthalic acid and different bis(imidazole) bridging linkers","CrystEngComm","2014","16","33","7649","","10.1039/C4CE00760C","","","0.71073","MoKα","","0.0836","0.0508","","","0.137","0.1621","","","","","","0.998","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216346","15.591","0.003","16.362","0.003","21.032","0.003","90","","120.491","0.005","90","","4623.3","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H42 Co2 N8 O10 -","- C50 H42 Co2 N8 O10 -","- C200 H168 Co8 N32 O40 -","4","1","","Fan, Liming; Gao, Yan; Liu, Guangzeng; Fan, Weiliu; Song, Weikuo; Sun, Liming; Zhao, Xian; Zhang, Xiutang","Syntheses, structures, and magnetic properties of six coordination polymers based on 4,5-di(4′-carboxylphenyl)phthalic acid and different bis(imidazole) bridging linkers","CrystEngComm","2014","16","33","7649","","10.1039/C4CE00760C","","","0.71073","MoKα","","0.151","0.0661","","","0.131","0.1626","","","","","","0.999","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216347","7.9663","0.0009","11.4723","0.0013","14.0805","0.0017","90","","90","","90","","1286.8","0.3","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C14 H10 Ag O6 P -","- C14 H10 Ag O6 P -","- C56 H40 Ag4 O24 P4 -","4","0.5","","Wu, Lin-Fei; Wang, Zhao-Xi; Xue, Chao-Chao; Xiao, Hong-Ping; Li, Ming-Xing","Two 2D sliver complexes with a symmetric and noncentrosymmetric architecture controlled by the metal‒ligand ratio","CrystEngComm","2014","16","25","5627","","10.1039/c4ce00008k","","","0.71073","MoKα","","0.0293","0.0277","","","0.0807","0.082","","","","","","1.073","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216348","18.151","0.003","26.476","0.004","5.9595","0.001","90","","90","","90","","2863.9","0.8","296","2","296","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C14 H8 Ag3 O6 P -","- C14 H8 Ag3 O6 P -","- C112 H64 Ag24 O48 P8 -","8","1","","Wu, Lin-Fei; Wang, Zhao-Xi; Xue, Chao-Chao; Xiao, Hong-Ping; Li, Ming-Xing","Two 2D sliver complexes with a symmetric and noncentrosymmetric architecture controlled by the metal‒ligand ratio","CrystEngComm","2014","16","25","5627","","10.1039/c4ce00008k","","","0.71073","MoKα","","0.0195","0.019","","","0.0534","0.0538","","","","","","1.097","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216349","14.904","0.004","14.159","0.003","21.949","0.005","90","","99.879","0.003","90","","4563.1","1.9","93","2","93","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C102 H106 N10 O9 Zn2 -","- C98 H98 N10 O8 Zn2 -","- C196 H196 N20 O16 Zn4 -","2","1","","Shinozaki, Y.; Yoshikawa, I.; Araki, K.; Sugawa, K.; Otsuki, J.","Control of higher-order structures of zinc chlorophyll coordination polymers","CrystEngComm","2014","16","39","9155","","10.1039/C4CE00861H","","","0.71075","MoKα","","0.1002","0.0787","","","0.2032","0.2271","","","","","","1.021","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216350","10.372","0.007","22.684","0.014","18.375","0.011","90","","104.44","0.01","90","","4187","5","93","2","93","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H39 N5 O3 Zn -","- C45 H39 N5 O3 Zn -","- C180 H156 N20 O12 Zn4 -","4","2","","Shinozaki, Y.; Yoshikawa, I.; Araki, K.; Sugawa, K.; Otsuki, J.","Control of higher-order structures of zinc chlorophyll coordination polymers","CrystEngComm","2014","16","39","9155","","10.1039/C4CE00861H","","","0.71075","MoKα","","0.1955","0.1136","","","0.2384","0.299","","","","","","1.046","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216351","11.019","0.002","12.676","0.003","21.167","0.004","90","","98.13","0.03","90","","2926.8","1.1","200","2","200.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 As3 Co N9 O10 -","- C24 H23.858 As3 Co N9 O10 -","- C96 H95.432 As12 Co4 N36 O40 -","4","1","","Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang","Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid","CrystEngComm","2014","16","34","7894","","10.1039/C4CE00553H","","","0.71073","MoKα","","0.0298","0.0259","","","0.0681","0.07","","","","","","1.055","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216352","20.454","0.004","7.7512","0.0016","8.4433","0.0017","90","","102.15","0.03","90","","1308.6","0.5","150","2","150.15","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C8 H11 As Cl Cu N3 O5 -","- C8 H7 As Cl Cu N3 O5 -","- C32 H28 As4 Cl4 Cu4 N12 O20 -","4","0.5","","Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang","Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid","CrystEngComm","2014","16","34","7894","","10.1039/C4CE00553H","","","0.71073","MoKα","","0.0601","0.05","","","0.1663","0.1736","","","","","","0.999","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216353","8.5378","0.0017","17.151","0.003","12.69","0.003","90","","96.98","0.03","90","","1844.4","0.7","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 As2 Mn N6 O6 -","- C16 H14 As2 Mn N6 O6 -","- C64 H56 As8 Mn4 N24 O24 -","4","1","","Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang","Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid","CrystEngComm","2014","16","34","7894","","10.1039/C4CE00553H","","","0.71073","MoKα","","0.0296","0.0257","","","0.0598","0.0615","","","","","","1.037","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216354","8.6818","0.0005","17.1961","0.0009","12.8662","0.0007","90","","96.906","0.001","90","","1906.9","0.18","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 As2 Cd N6 O6 -","- C16 H14 As2 Cd N6 O6 -","- C64 H56 As8 Cd4 N24 O24 -","4","1","","Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang","Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid","CrystEngComm","2014","16","34","7894","","10.1039/C4CE00553H","","","0.71073","MoKα","","0.0221","0.0206","","","0.0513","0.0524","","","","","","1.029","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216355","6.012","0.0009","21.594","0.003","8.9646","0.0009","90","","126.135","0.007","90","","939.9","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 As N3 O3 -","- C8 H8 As N3 O3 -","- C32 H32 As4 N12 O12 -","4","1","","Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang","Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid","CrystEngComm","2014","16","34","7894","","10.1039/C4CE00553H","","","0.71073","MoKα","","0.0601","0.0593","","","0.1344","0.1348","","","","","","1.078","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216356","20.875","0.004","7.6129","0.0015","8.5776","0.0017","90","","101.41","0.03","90","","1336.2","0.5","150","2","150","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C8 H7 As Cl Co N3 O5 -","- C8 H7 As Cl Co N3 O5 -","- C32 H28 As4 Cl4 Co4 N12 O20 -","4","0.5","","Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang","Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid","CrystEngComm","2014","16","34","7894","","10.1039/C4CE00553H","","","0.71073","MoKα","","0.0366","0.0365","","","0.1015","0.1016","","","","","","1.075","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216357","8.5117","0.0003","15.9674","0.0005","20.4293","0.0006","90","","97.588","0.002","90","","2752.23","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Zn","","","- C52 H52 Cl6 N4 O8 Zn2 -","- C52 H52 Cl6 N4 O8 Zn2 -","- C104 H104 Cl12 N8 O16 Zn4 -","2","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","","","0.0763","0.0518","","","0.1497","0.1617","","","","","","1.058","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216358","17.5218","0.0008","16.1106","0.0007","20.7074","0.0009","90","","100.232","0.003","90","","5752.5","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H60 Cl6 N4 O10 Zn2 -","- C56 H60 Cl6 N4 O10 Zn2 -","- C224 H240 Cl24 N16 O40 Zn8 -","4","1","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.2352","0.0697","","","0.121","0.1682","","","","","","0.938","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216359","8.4959","0.0001","16.3216","0.0002","20.7112","0.0003","90","","97.903","0.001","90","","2844.68","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H56 Br6 N4 O9 Zn2 -","- C53 H52 Br6 N4 O9 Zn2 -","- C106 H104 Br12 N8 O18 Zn4 -","2","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.2136","0.0703","","","0.1362","0.1776","","","","","","0.966","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216360","17.5924","0.0002","16.3095","0.0002","21.257","0.0002","90","","100.799","0.001","90","","5991.12","0.12","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H60 Br6 N4 O10 Zn2 -","- C56 H60 Br6 N4 O10 Zn2 -","- C224 H240 Br24 N16 O40 Zn8 -","4","1","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.0992","0.047","","","0.0947","0.1104","","","","","","1.041","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216361","11.1323","0.0002","20.1613","0.0003","28.3599","0.0005","91.835","0.001","100.902","0.001","92.955","0.001","6236.29","0.18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H67.5 Br4 Cd Cl1.5 N4 O12 -","- C58 H64.5 Br4 Cd Cl1.5 N4 O12 -","- C232 H258 Br16 Cd4 Cl6 N16 O48 -","4","2","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.2281","0.0824","","","0.1918","0.2483","","","","","","1.003","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216362","18.905","0.0002","17.3064","0.0001","31.5699","0.0003","90","","90","","90","","10329","0.16","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C48 H56 Br4 Cd N4 O10 -","- C48 H56 Br4 Cd N4 O10 -","- C384 H448 Br32 Cd8 N32 O80 -","8","1","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.097","0.042","","","0.0729","0.0878","","","","","","1.005","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216363","11.3078","0.0004","11.4735","0.0004","15.1493","0.0005","69.17","0.002","77.757","0.002","72.357","0.002","1738.56","0.11","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H68 Cd2 I6 N4 O12 -","- C58 H60 Cd2 I6 N4 O12 -","- C58 H60 Cd2 I6 N4 O12 -","1","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.0657","0.0373","","","0.0894","0.1","","","","","","1.074","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216364","18.7667","0.0002","18.3528","0.0002","31.9417","0.0004","90","","90","","90","","11001.4","0.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C48 H56 Cd I4 N4 O10 -","- C48 H56 Cd I4 N4 O10 -","- C384 H448 Cd8 I32 N32 O80 -","8","1","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.1779","0.082","","","0.1412","0.1701","","","","","","1.016","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216365","9.8203","0.0001","11.5983","0.0002","12.8782","0.0002","94.835","0.001","106.333","0.001","103.139","0.001","1353.42","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H52 Br6 Hg2 N4 O8 -","- C52 H52 Br6 Hg2 N4 O8 -","- C52 H52 Br6 Hg2 N4 O8 -","1","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.0275","0.0226","","","0.0479","0.0495","","","","","","1.011","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216366","10.9943","0.0002","15.1689","0.0002","15.5408","0.0003","111.58","0.001","101.951","0.001","104.728","0.001","2196.87","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C77 H80 Br12 Hg4 N8 O11 -","- C77 H76 Br12 Hg4 N8 O11 -","- C77 H76 Br12 Hg4 N8 O11 -","1","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.1136","0.0476","","","0.0584","0.0692","","","","","","1.066","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216367","10.039","0.001","11.7664","0.0012","13.0968","0.0013","93.757","0.006","106.866","0.006","105.202","0.007","1411.8","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H52 Hg2 I6 N4 O8 -","- C52 H52 Hg2 I6 N4 O8 -","- C52 H52 Hg2 I6 N4 O8 -","1","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.1297","0.084","","","0.252","0.291","","","","","","1.058","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216368","11.3555","0.0002","12.1082","0.0002","14.2423","0.0003","103.372","0.001","97.008","0.001","115.665","0.001","1661.16","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H72 Hg2 I6 N4 O13 -","- C59 H68 Hg2 I6 N4 O13 -","- C59 H68 Hg2 I6 N4 O13 -","1","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.034","0.0302","","","0.1145","0.1197","","","","","","1.009","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216369","10.2446","0.0009","16.4684","0.0014","14.9546","0.0013","90","","90","","90","","2523","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 Cd I4 N4 -","- C20 H16 Cd I4 N4 -","- C80 H64 Cd4 I16 N16 -","4","1","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.1342","0.0418","","","0.0893","0.1345","","","","","","0.555","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216370","28.1847","0.0003","9.0482","0.0001","14.2578","0.0002","90","","98.699","0.001","90","","3594.21","0.08","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H28 I6 N4 O3 Zn2 -","- C23 H25 I6 N4 O3 Zn2 -","- C92 H100 I24 N16 O12 Zn8 -","4","0.5","","Fernando, Isurika R.; Mo, Yirong; Mezei, Gellert","Metal-binding studies of linear rigid-axle [2]pseudorotaxanes with in situ generated anionic metal halide complexes","CrystEngComm","2014","16","31","7320","","10.1039/C4CE00789A","","","0.71073","MoKα","","0.0846","0.0678","","","0.1323","0.1411","","","","","","1.069","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216371","13.4688","0.0012","13.4688","0.0012","10.4961","0.0013","90","","90","","120","","1649","0.3","173","2","173","2","","","","","","","","6","P -3","-P 3","147","","","","- C78 H78 Cl2 Mn N12 O8 -","- C78 H78 Cl2 Mn N12 O8 -","- C78 H78 Cl2 Mn N12 O8 -","1","0.166667","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang","Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene","CrystEngComm","2014","16","30","7023","","10.1039/C4CE00215F","","","0.71073","MoKα","","0.0791","0.0478","","","0.0919","0.1039","","","","","","1.025","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216372","12.608","0.002","13.831","0.003","17.334","0.002","90","","119.575","0.009","90","","2628.9","0.8","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 Cu N4 O7 S -","- C26 H32 Cu N4 O7 S -","- C104 H128 Cu4 N16 O28 S4 -","4","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang","Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene","CrystEngComm","2014","16","30","7023","","10.1039/C4CE00215F","","","0.71073","MoKα","","0.0776","0.0515","","","0.1208","0.1366","","","","","","1.028","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216373","9.144","0.004","9.914","0.004","10.981","0.005","113.235","0.006","104.079","0.007","92.301","0.007","876.8","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H44 Co N4 O8 -","- C34 H36 Co N4 O8 -","- C34 H36 Co N4 O8 -","1","0.5","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang","Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene","CrystEngComm","2014","16","30","7023","","10.1039/C4CE00215F","","","0.71073","MoKα","","0.0766","0.0633","","","0.1699","0.1833","","","","","","1.049","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216374","16.62","0.003","9.5294","0.0016","19.384","0.004","90","","104.236","0.005","90","","2975.7","1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14.5 H16.5 Co0.5 N3.5 O3.5 -","- C14.5 H16.5 Co0.5 N3.5 O3.5 -","- C116 H132 Co4 N28 O28 -","8","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang","Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene","CrystEngComm","2014","16","30","7023","","10.1039/C4CE00215F","","","0.71073","MoKα","","0.0857","0.0715","","","0.2381","0.2543","","","","","","1.027","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216375","16.651","0.005","9.66","0.003","19.921","0.007","90","","105.878","0.005","90","","3082","1.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H33 Cd N7 O7 -","- C29 H33 Cd N7 O7 -","- C116 H132 Cd4 N28 O28 -","4","0.5","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang","Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene","CrystEngComm","2014","16","30","7023","","10.1039/C4CE00215F","","","0.71073","MoKα","","0.0441","0.0353","","","0.0737","0.0774","","","","","","1.006","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216376","16.271","0.003","9.664","0.003","19.485","0.005","90","","103.811","0.006","90","","2975.3","1.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H33 Cu N7 O7 -","- C29 H33 Cu N7 O7 -","- C116 H132 Cu4 N28 O28 -","4","0.5","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang","Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene","CrystEngComm","2014","16","30","7023","","10.1039/C4CE00215F","","","0.71073","MoKα","","0.0777","0.0512","","","0.123","0.1367","","","","","","1.061","","","","has coordinates,has disorder","180494","2020-10-21","18:00:00",""
"7216382","12.937","0.008","11.15","0.007","17.445","0.008","90","","126.8","0.03","90","","2015","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H46 Co N6 O10 -","- C42 H46 Co N6 O10 -","- C84 H92 Co2 N12 O20 -","2","0.5","","Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin","Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands","CrystEngComm","2014","16","33","7701","","10.1039/C4CE00635F","","","0.71073","MoKα","","0.1122","0.0694","","","0.1086","0.1213","","","","","","1.01","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216383","9.753","0.006","14.101","0.008","14.74","0.008","116.334","0.01","108.889","0.01","90.034","0.01","1693.9","1.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H28 Co N4 O8 -","- C36 H28 Co N4 O8 -","- C72 H56 Co2 N8 O16 -","2","1","","Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin","Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands","CrystEngComm","2014","16","33","7701","","10.1039/C4CE00635F","","","0.71073","MoKα","","0.1734","0.1153","","","0.237","0.2598","","","","","","1.069","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216384","18.724","0.007","19.302","0.007","20.004","0.008","90","","90","","90","","7230","5","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C39 H37 N5 O8 Zn -","- C39 H35 N5 O8 Zn -","- C312 H280 N40 O64 Zn8 -","8","1","","Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin","Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands","CrystEngComm","2014","16","33","7701","","10.1039/C4CE00635F","","","0.71073","MoKα","","0.1127","0.0534","","","0.1175","0.1462","","","","","","1.004","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216385","16.982","0.004","10.725","0.002","22.521","0.004","90","","128.552","0.011","90","","3207.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H33 Cd N5 O8 -","- C31 H33 Cd N5 O8 -","- C124 H132 Cd4 N20 O32 -","4","1","","Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin","Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands","CrystEngComm","2014","16","33","7701","","10.1039/C4CE00635F","","","0.71073","MoKα","","0.0465","0.0335","","","0.0779","0.0849","","","","","","1.027","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216386","11.473","0.003","11.473","0.003","19.268","0.005","90","","90","","120","","2196.4","1","296","2","296","2","","","","","","","","5","P 32","P 32","145","","","","- C28 H30 Co N4 O9 -","- C28 H24 Co N4 O9 -","- C84 H72 Co3 N12 O27 -","3","1","","Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin","Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands","CrystEngComm","2014","16","33","7701","","10.1039/C4CE00635F","","","0.71073","MoKα","","0.1033","0.0778","","","0.2014","0.2195","","","","","","1.1","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216387","9.779","0.004","13.952","0.006","21.144","0.009","92.178","0.009","96.238","0.009","109.309","0.008","2698","2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H48 N8 O15 Zn2 -","- C56 H48 N8 O15 Zn2 -","- C112 H96 N16 O30 Zn4 -","2","1","","Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin","Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands","CrystEngComm","2014","16","33","7701","","10.1039/C4CE00635F","","","0.71073","MoKα","","0.1358","0.0613","","","0.1176","0.1444","","","","","","1.018","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216388","19.088","0.005","4.672","0.003","12.691","0.005","90","","115.56","0.03","90","","1021","0.9","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H18 N4 O3 -","- C8 H18 N4 O3 -","- C32 H72 N16 O12 -","4","0.5","","Owczarek, Magdalena; Majerz, Irena; Jakubas, Ryszard","Weak hydrogen and dihydrogen bonds instead of strong N‒H⋯O bonds of a tricyclic [1,2,4,5]-tetrazine derivative. Single-crystal X-ray diffraction, theoretical calculations and Hirshfeld surface analysis","CrystEngComm","2014","16","33","7638","","10.1039/C4CE00571F","","","0.71073","MoKα","","0.0432","0.0372","","","0.1083","0.1116","","","","","","1.068","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216389","9.789","0.005","6.441","0.003","7.862","0.004","90","","112.18","0.05","90","","459","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 N4 O2 -","- C8 H16 N4 O2 -","- C16 H32 N8 O4 -","2","0.5","","Owczarek, Magdalena; Majerz, Irena; Jakubas, Ryszard","Weak hydrogen and dihydrogen bonds instead of strong N‒H⋯O bonds of a tricyclic [1,2,4,5]-tetrazine derivative. Single-crystal X-ray diffraction, theoretical calculations and Hirshfeld surface analysis","CrystEngComm","2014","16","33","7638","","10.1039/C4CE00571F","","","0.71073","MoKα","","0.0477","0.0434","","","0.13","0.1331","","","","","","1.132","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216390","11.4423","0.0003","13.6677","0.0004","21.4571","0.0005","90","","107.676","0.001","90","","3197.25","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 N4 O9 Zn -","- C36 H28 N4 O9 Zn -","- C144 H112 N16 O36 Zn4 -","4","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.0459","0.0419","","","0.1001","0.1026","","","","","","1.136","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216391","7.3644","0.0018","20.505","0.005","18.269","0.004","90","","101.628","0.004","90","","2702.1","1.1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 N4 O7 Zn -","- C30 H22 N4 O7 Zn -","- C120 H88 N16 O28 Zn4 -","4","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.061","0.0485","","","0.1296","0.1391","","","","","","1.096","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216392","27.8066","0.0004","10.0464","0.0001","22.2781","0.0003","90","","109.236","0.001","90","","5876.06","0.13","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H23 N4 O10 Zn -","- C31 H23 N4 O10 Zn -","- C248 H184 N32 O80 Zn8 -","8","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.0429","0.0374","","","0.0927","0.0976","","","","","","1.082","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216393","9.4834","0.0001","10.6376","0.0002","14.9133","0.0002","95.191","0.001","103.417","0.001","96.864","0.001","1441.99","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H24 N4 O7 Zn -","- C34 H24 N4 O7 Zn -","- C68 H48 N8 O14 Zn2 -","2","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.0423","0.0374","","","0.0875","0.0907","","","","","","1.075","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216394","13.2139","0.0005","21.7434","0.0008","16.7754","0.0006","90","","127.107","0.002","90","","3843.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 Cd N4 O7 -","- C34 H24 Cd N4 O7 -","- C136 H96 Cd4 N16 O28 -","4","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.0331","0.0301","","","0.0756","0.078","","","","","","1.048","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216395","11.358","0.0002","18.7948","0.0004","13.6608","0.0003","90","","100.438","0.001","90","","2867.93","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H24 Cd N4 O7 -","- C34 H24 Cd N4 O7 -","- C136 H96 Cd4 N16 O28 -","4","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.0361","0.0295","","","0.0615","0.0664","","","","","","1.137","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216396","10.0055","0.0005","10.2265","0.0005","14.5845","0.0008","90.836","0.003","93.894","0.003","90.72","0.003","1488.56","0.13","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H26 Cd N4 O11 -","- C31 H26 Cd N4 O11 -","- C62 H52 Cd2 N8 O22 -","2","1","","Zhang, Xiao-min; Ning, Yang; Meng, Li-na; Li, Jian-qiang; Luo, Ming-biao; Luo, Feng","Constructing various metal‒organic frameworks by mixed pyridine‒acylamide and carboxylate ligands: ring-like or helical building blocks","CrystEngComm","2014","16","32","7440","","10.1039/C4CE00796D","","","0.71073","MoKα","","0.05","0.0383","","","0.0741","0.0866","","","","","","1.118","","","","has coordinates","180494","2020-10-21","18:00:00",""
"7216403","10.1012","0.001","15.8278","0.0016","27.754","0.003","90","","92.249","0.002","90","","4433.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H44 Co2 N4 O12 -","- C43 H36 Co2 N4 O12 -","- C172 H144 Co8 N16 O48 -","4","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.0923","0.0487","","","0.1181","0.1398","","","","","","0.994","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216404","9.5048","0.0008","26.132","0.002","16.8487","0.0014","90","","99.253","0.002","90","","4130.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H38 N4 O9 Zn2 -","- C43 H36 N4 O9 Zn2 -","- C172 H144 N16 O36 Zn8 -","4","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.1111","0.0539","","","0.1432","0.1747","","","","","","1.004","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216405","25.584","0.007","11.903","0.003","15.203","0.004","90","","120.107","0.004","90","","4005.1","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H40 Co2 N4 O9 -","- C44 H32 Co2 N4 O9 -","- C176 H128 Co8 N16 O36 -","4","0.5","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.0541","0.0429","","","0.1124","0.1222","","","","","","0.871","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216406","14.0828","0.0008","23.9967","0.0012","37.1516","0.0019","90","","90","","90","","12555","1.1","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C63 H75 N11 O12 Zn2 -","- C63 H64 N11 O12 Zn2 -","- C504 H512 N88 O96 Zn16 -","8","","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.1154","0.0674","","","0.1779","0.207","","","","","","1.056","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216407","21.096","0.012","10.897","0.006","18.875","0.011","90","","90","","90","","4339","4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C22 H19 N2 O4 Zn -","- C22 H15 N2 O4 Zn -","- C176 H120 N16 O32 Zn8 -","8","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.1534","0.075","","","0.1514","0.1844","","","","","","1.029","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216408","11.6756","0.0013","14.7495","0.0016","16.4661","0.0018","109.353","0.002","101.206","0.002","108.562","0.002","2389.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H48 N6 Ni2 O11 -","- C49 H32 N6 Ni2 O11 -","- C98 H64 N12 Ni4 O22 -","2","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.0905","0.057","","","0.1715","0.1894","","","","","","0.971","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216409","21.1497","0.0019","10.9266","0.0009","18.6978","0.0016","90","","90","","90","","4321","0.6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C22 H19 N2 O4 Zn -","- C22 H15 N2 O4 Zn -","- C176 H120 N16 O32 Zn8 -","8","1","","Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan; Zhao, Lun; Liu, Chunming","A series of coordination polymers assembled from 9,9-dimethylfluorene-2,7-dicarboxylic acid and various flexible bis(imidazole) ligands: synthesis, structures and properties","CrystEngComm","2014","16","32","7459","","10.1039/C4CE00664J","","","0.71073","MoKα","","0.1164","0.0513","","","0.1206","0.1486","","","","","","1.002","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216410","5.9041","0.0008","5.9041","0.0008","10.499","0.002","90","","90","","90","","365.98","0.1","93","2","93","2","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- Ag3 Ga3 Se8 Si -","- Ag3 Ga3 Se8 Si -","- Ag3 Ga3 Se8 Si -","1","0.0625","","Mei, Dajiang; Gong, Pifu; Lin, Zheshuai; Feng, Kai; Yao, Jiyong; Huang, Fuqiang; Wu, Yicheng","Ag3Ga3SiSe8: a new infrared nonlinear optical material with a chalcopyrite structure","CrystEngComm","2014","16","30","6836","","10.1039/C4CE00817K","","","0.71073","MoKα","","0.0315","0.0273","","","0.0547","0.0558","","","","","","1.134","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216411","23.933","0.003","18.5408","0.0016","22.9605","0.0017","90","","108.96","0.011","90","","9635.7","1.8","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C62 H102 Mn6 N4 O24 -","- C62 H102 Mn6 N4 O24 -","- C248 H408 Mn24 N16 O96 -","4","1","","Malaestean, Iurie L.; Ellern, Arkady; van Leusen, Jan; Kravtsov, Victor C.; Kögerler, Paul; Baca, Svetlana G.","Cluster-based networks: assembly of a (4,4) layer and a rare T-shaped bilayer from [MnIII2MnII4O2(RCOO)10] coordination clusters","CrystEngComm","2014","16","29","6523","","10.1039/c4ce00504j","","","0.71073","MoKα","","0.1807","0.0766","","","0.1664","0.1876","","","","","","1.004","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216412","29.157","0.003","26.193","0.002","13.1814","0.0012","90","","90","","90","","10066.8","1.6","173","2","173","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C39 H61 Mn3 N2 O12 S2 -","- C39 H61 Mn3 N2 O12 S2 -","- C312 H488 Mn24 N16 O96 S16 -","8","1","","Malaestean, Iurie L.; Ellern, Arkady; van Leusen, Jan; Kravtsov, Victor C.; Kögerler, Paul; Baca, Svetlana G.","Cluster-based networks: assembly of a (4,4) layer and a rare T-shaped bilayer from [MnIII2MnII4O2(RCOO)10] coordination clusters","CrystEngComm","2014","16","29","6523","","10.1039/c4ce00504j","","","0.71073","MoKα","","0.0696","0.0515","","","0.1535","0.1711","","","","","","1.114","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216413","27.93","0.008","12.816","0.003","48.811","0.014","90","","95.693","0.007","90","","17386","8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70 H112 Mn6 N4 O26 S4 -","- C64 H94 Mn6 N4 O23 S4 -","- C512 H752 Mn48 N32 O184 S32 -","8","1","","Malaestean, Iurie L.; Ellern, Arkady; van Leusen, Jan; Kravtsov, Victor C.; Kögerler, Paul; Baca, Svetlana G.","Cluster-based networks: assembly of a (4,4) layer and a rare T-shaped bilayer from [MnIII2MnII4O2(RCOO)10] coordination clusters","CrystEngComm","2014","16","29","6523","","10.1039/c4ce00504j","","","0.71073","MoKα","","0.1293","0.1059","","","0.2406","0.2507","","","","","","1.138","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216414","50.85","0.016","15.26","0.005","14.006","0.004","90","","90","","90","","10868","6","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","MeBTB","1,3,5-Tris(2,6-dimethyl-4-carboxyphenyl)benzene + 2*1,1,2,2-tetrachloroethane","","- C37 H34 Cl8 O6 -","- C37 H34 Cl8 O6 -","- C296 H272 Cl64 O48 -","8","1","","Bajpai, Alankriti; Venugopalan, Paloth; Moorthy, Jarugu Narasimha","Self-assembly of sterically-rigidified 3-connecting benzenetribenzoic acid into (6,3) and (3,3) nets and stabilization of water channel in the crystal lattice","CrystEngComm","2014","16","22","4853","","10.1039/c3ce42515k","","","0.71073","MoKα","","0.2673","0.1833","","","0.4279","0.4562","","","","","","1.672","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216415","50.85","0.016","15.26","0.005","14.006","0.004","90","","90","","90","","10868","6","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","MeBTB","1,3,5-Tris(2,6-dimethyl-4-carboxyphenyl)benzene + 2*1,1,2,2-tetrachloroethane","","- C37 H34 Cl8 O6 -","- C33 H30 O6 -","- C264 H240 O48 -","8","1","","Bajpai, Alankriti; Venugopalan, Paloth; Moorthy, Jarugu Narasimha","Self-assembly of sterically-rigidified 3-connecting benzenetribenzoic acid into (6,3) and (3,3) nets and stabilization of water channel in the crystal lattice","CrystEngComm","2014","16","22","4853","","10.1039/c3ce42515k","","","0.71073","MoKα","","0.1634","0.0817","","","0.1768","0.197","","","","","","1.014","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216416","25.35","0.004","25.35","0.004","18.979","0.004","90","","90","","120","","10562","3","293","2","293","2","","","","","","","","3","P 61","P 61","169","2*1,3,5-Tris(2,6-dimethyl-4-carboxyphenyl)benzene+2*Dimethoxyethane+2*H2O","","","- C74 H84 O18 -","- C74 H80 O18 -","- C444 H480 O108 -","6","1","","Bajpai, Alankriti; Venugopalan, Paloth; Moorthy, Jarugu Narasimha","Self-assembly of sterically-rigidified 3-connecting benzenetribenzoic acid into (6,3) and (3,3) nets and stabilization of water channel in the crystal lattice","CrystEngComm","2014","16","22","4853","","10.1039/c3ce42515k","","","0.71073","MoKα","","0.1038","0.0728","","","0.1768","0.1948","","","","","","1.06","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216417","8.6821","0.0008","29.796","0.003","12.8045","0.0012","90","","96.432","0.002","90","","3291.6","0.5","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","1,3,5-Tris(2,6-dimethyl-4-carboxyphenyl)benzene + 2*dibenzocrown + 1.5K+","","","- C73 H80 K1.5 O20 -","- C73 H75 K1.5 O20 -","- C146 H150 K3 O40 -","2","1","","Bajpai, Alankriti; Venugopalan, Paloth; Moorthy, Jarugu Narasimha","Self-assembly of sterically-rigidified 3-connecting benzenetribenzoic acid into (6,3) and (3,3) nets and stabilization of water channel in the crystal lattice","CrystEngComm","2014","16","22","4853","","10.1039/c3ce42515k","","","0.71073","MoKα","","0.1106","0.071","","","0.138","0.1556","","","","","","1.073","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216418","13.3641","0.0007","13.3641","0.0007","45.517","0.003","90","","90","","120","","7040.2","0.7","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C90 H80 F6 N14 O24 Si -","- C90 H80 F6 N14 O24 Si -","- C270 H240 F18 N42 O72 Si3 -","3","0.166667","","Basu, Arghya; Chutia, Romen; Das, Gopal","Dual modes of binding on the hexafluorosilicate anion by a C3v symmetric flexible tripodal amide ligand in solid state","CrystEngComm","2014","16","22","4886","","10.1039/c4ce00529e","","","0.71073","MoKα","","0.1499","0.0987","","","0.2801","0.314","","","","","","1.057","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216419","13.1197","0.0005","13.1321","0.0006","15.7929","0.0006","108.655","0.002","105.033","0.002","92.632","0.002","2464.94","0.18","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H102 F6 N16 O30 Si -","- C96 H102 F6 N16 O30 Si -","- C96 H102 F6 N16 O30 Si -","1","0.5","","Basu, Arghya; Chutia, Romen; Das, Gopal","Dual modes of binding on the hexafluorosilicate anion by a C3v symmetric flexible tripodal amide ligand in solid state","CrystEngComm","2014","16","22","4886","","10.1039/c4ce00529e","","","0.71073","MoKα","","0.1322","0.0608","","","0.1524","0.1831","","","","","","0.83","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216420","20.9184","0.001","10.4771","0.0006","7.8468","0.0004","90","","95.79","0.004","90","","1710.96","0.16","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Furosemide sodium salt trihydrate","","","- C12 H16 Cl N2 Na O8 S -","- C12 H16 Cl N2 Na O8 S -","- C48 H64 Cl4 N8 Na4 O32 S4 -","4","1","","Rao Khandavilli, U. B.; Gangavaram, Swarupa; Rajesh Goud, N.; Cherukuvada, Suryanarayan; Raghavender, S.; Nangia, Ashwini; Manjunatha, Sulur G.; Nambiar, Sudhir; Pal, Sharmistha","High solubility crystalline hydrates of Na and K furosemide salts","CrystEngComm","2014","16","22","4842","","10.1039/c3ce42347f","","","0.71073","MoKα","","0.0922","0.0476","","","0.0808","0.0901","","","","","","0.92","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216421","18.8967","0.001","11.1734","0.0006","7.3056","0.0004","90","","91.346","0.005","90","","1542.08","0.14","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Furosemide potassuium salt monohydrate","","","- C12 H12 Cl K N2 O6 S -","- C12 H12 Cl K N2 O6 S -","- C48 H48 Cl4 K4 N8 O24 S4 -","4","1","","Rao Khandavilli, U. B.; Gangavaram, Swarupa; Rajesh Goud, N.; Cherukuvada, Suryanarayan; Raghavender, S.; Nangia, Ashwini; Manjunatha, Sulur G.; Nambiar, Sudhir; Pal, Sharmistha","High solubility crystalline hydrates of Na and K furosemide salts","CrystEngComm","2014","16","22","4842","","10.1039/c3ce42347f","","","0.71073","MoKα","","0.091","0.0752","","","0.2237","0.2326","","","","","","1.183","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216422","12.579","0.015","24.34","0.02","14.063","0.013","90","","109.3","0.04","90","","4064","7","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C37 H53 N5 O11 -","- C37 H53 N5 O11 -","- C148 H212 N20 O44 -","4","2","","Bera, Santu; Maity, Suman Kumar; Haldar, Debasish","Photoelectrochemical properties of CdSe quantum dots doped disk-like tripeptide capsule","CrystEngComm","2014","16","22","4834","","10.1039/c3ce42582g","","","0.71073","MoKα","","0.0612","0.0565","","","0.1588","0.163","","","","","","1.28","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216423","11.6087","0.0013","21.608","0.003","14.0422","0.0016","90","","105.152","0.002","90","","3399.9","0.7","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H44 N5 O11.5 -","- C29 H44 N5 O11.5 -","- C116 H176 N20 O46 -","4","2","","Bera, Santu; Maity, Suman Kumar; Haldar, Debasish","Photoelectrochemical properties of CdSe quantum dots doped disk-like tripeptide capsule","CrystEngComm","2014","16","22","4834","","10.1039/c3ce42582g","","","0.71073","MoKα","","0.0996","0.0631","","","0.1362","0.1687","","","","","","1.05","","","","has coordinates","183084","2020-10-21","18:00:00",""
"7216424","8.5118","0.0007","22.703","0.002","11.3906","0.0008","90","","105.401","0.007","90","","2122.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Co N4 O4 -","- C24 H22 Co N4 O4 -","- C96 H88 Co4 N16 O16 -","4","1","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Structural library of coordination polymers based on flexible linkers exploiting the role of linker coordination angle: synthesis, structural characterization and magnetic properties","CrystEngComm","2014","16","22","4816","","10.1039/c3ce42637h","","","0.71073","MoKα","","0.0875","0.0535","","","0.0934","0.1061","","","","","","1.034","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216425","13.177","0.008","15.668","0.008","28.949","0.015","90","","90","","90","","5977","6","298","2","298","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C31 H22 Co F6 N4 O5 -","- C31 H22 Co F6 N4 O5 -","- C248 H176 Co8 F48 N32 O40 -","8","0.5","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Structural library of coordination polymers based on flexible linkers exploiting the role of linker coordination angle: synthesis, structural characterization and magnetic properties","CrystEngComm","2014","16","22","4816","","10.1039/c3ce42637h","","","0.71073","MoKα","","0.0868","0.0687","","","0.1361","0.1421","","","","","","1.266","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216426","11.5867","0.0003","12.6968","0.0004","17.5141","0.0005","90","","96.216","0.003","90","","2561.42","0.13","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Co N4 O4 -","- C28 H30 Co N4 O4 -","- C112 H120 Co4 N16 O16 -","4","1","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Structural library of coordination polymers based on flexible linkers exploiting the role of linker coordination angle: synthesis, structural characterization and magnetic properties","CrystEngComm","2014","16","22","4816","","10.1039/c3ce42637h","","","0.71073","MoKα","","0.0529","0.0398","","","0.1043","0.1123","","","","","","1.056","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216427","13.1976","0.0009","10.4914","0.0007","20.376","0.0015","90","","108.808","0.008","90","","2670.6","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 Co N4 O5 -","- C28 H34 Co N4 O5 -","- C112 H136 Co4 N16 O20 -","4","1","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Structural library of coordination polymers based on flexible linkers exploiting the role of linker coordination angle: synthesis, structural characterization and magnetic properties","CrystEngComm","2014","16","22","4816","","10.1039/c3ce42637h","","","0.71073","MoKα","","0.0653","0.044","","","0.1027","0.1166","","","","","","1.024","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216428","9.3717","0.0008","10.1843","0.0009","11.7377","0.0011","112.956","0.001","108.358","0.001","90.696","0.001","967.32","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H38 Co3 N12 O16 -","- C30 H38 Co3 N12 O16 -","- C30 H38 Co3 N12 O16 -","1","0.5","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Structural library of coordination polymers based on flexible linkers exploiting the role of linker coordination angle: synthesis, structural characterization and magnetic properties","CrystEngComm","2014","16","22","4816","","10.1039/c3ce42637h","","","0.71073","MoKα","","0.0385","0.0322","","","0.0767","0.0802","","","","","","1.027","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216429","8.9732","0.0004","20.4712","0.0009","10.4084","0.0005","90","","102.998","0.005","90","","1862.95","0.15","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 Co2 N5 O5 -","- C16 H12 Co2 N5 O5 -","- C64 H48 Co8 N20 O20 -","4","1","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Structural library of coordination polymers based on flexible linkers exploiting the role of linker coordination angle: synthesis, structural characterization and magnetic properties","CrystEngComm","2014","16","22","4816","","10.1039/c3ce42637h","","","0.71073","MoKα","","0.0565","0.0448","","","0.1063","0.112","","","","","","1.109","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216430","16.3552","0.0006","16.0035","0.0006","12.1024","0.0005","90","","111.399","0.001","90","","2949.3","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H27 Cd2 N4 O9 -","- C30 H27 Cd2 N4 O9 -","- C120 H108 Cd8 N16 O36 -","4","0.5","","Haldar, Ritesh; Bonakala, Satyanarayana; Kanoo, Prakash; Balasubramanian, Sundaram; Maji, Tapas Kumar","Two 3D metal‒organic frameworks of Cd(ii): modulation of structures and porous properties based on linker functionalities","CrystEngComm","2014","16","22","4877","","10.1039/c4ce00190g","","","0.71073","MoKα","","0.0387","0.0295","","","0.0645","0.0682","","","","","","1.026","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216431","6.7119","0.0007","24.876","0.003","14.0647","0.0017","90","","90","","90","","2348.3","0.5","150","2","150","2","","","","","","","","5","C m m a","-C 2a 2","67","","","","- C18 H10 Cd N5 O9.5 -","- C18 H10 Cd N5 O9.52 -","- C72 H40 Cd4 N20 O38.08 -","4","0.25","","Haldar, Ritesh; Bonakala, Satyanarayana; Kanoo, Prakash; Balasubramanian, Sundaram; Maji, Tapas Kumar","Two 3D metal‒organic frameworks of Cd(ii): modulation of structures and porous properties based on linker functionalities","CrystEngComm","2014","16","22","4877","","10.1039/c4ce00190g","","","0.71073","MoKα","","0.1062","0.0953","","","0.2257","0.241","","","","","","1.058","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216432","16.38","0.002","20.382","0.003","31.993","0.004","90","","97.917","0.002","90","","10579","2","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C8 H24 Cu2 Mo12 N16 O46.5 P S2 -","- C8 H12 Cu2 Mo12 N16 O44 P S2 -","- C64 H96 Cu16 Mo96 N128 O352 P8 S16 -","8","1","","Hu, Hailiang; Zhang, Weisong; Gong, Jingjing; Dong, Huan; Zhao, Fangfang; Huang, Hui; Liu, Yang; Zhang, Guangju; Kang, Zhenhui","Can tetrazole-functionalized ligands realize the role-control of Keggin-type POMs in hybrid frameworks?","CrystEngComm","2014","16","25","5642","","10.1039/c4ce00293h","","","0.71073","MoKα","","0.0596","0.0479","","","0.1313","0.1381","","","","","","1.041","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216433","14.703","0.002","14.703","0.002","19.139","0.005","90","","90","","90","","4137.4","1.3","150","2","150","2","","","","","","","","9","P 4 n c","P 4 -2n","104","","","","- C26 H40 Cl Cu4 N32 O40 P S8 W12 -","- C26 H40 Cl Cu4 N32 O40 P S8 W12 -","- C52 H80 Cl2 Cu8 N64 O80 P2 S16 W24 -","2","0.25","","Hu, Hailiang; Zhang, Weisong; Gong, Jingjing; Dong, Huan; Zhao, Fangfang; Huang, Hui; Liu, Yang; Zhang, Guangju; Kang, Zhenhui","Can tetrazole-functionalized ligands realize the role-control of Keggin-type POMs in hybrid frameworks?","CrystEngComm","2014","16","25","5642","","10.1039/c4ce00293h","","","0.71073","MoKα","","0.061","0.0373","","","0.0758","0.0863","","","","","","1.003","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216434","24.3102","0.0014","18.5783","0.0011","25.6814","0.0015","90","","90","","90","","11598.8","1.2","150","2","150","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C12 H20 Ag3 Mo12 N24 O41 P S3 -","- C12 H18 Ag3 Mo12 N24 O41 P S3 -","- C96 H144 Ag24 Mo96 N192 O328 P8 S24 -","8","1","","Hu, Hailiang; Zhang, Weisong; Gong, Jingjing; Dong, Huan; Zhao, Fangfang; Huang, Hui; Liu, Yang; Zhang, Guangju; Kang, Zhenhui","Can tetrazole-functionalized ligands realize the role-control of Keggin-type POMs in hybrid frameworks?","CrystEngComm","2014","16","25","5642","","10.1039/c4ce00293h","","","0.71073","MoKα","","0.0647","0.0514","","","0.1105","0.1157","","","","","","1.053","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216435","18.274","0.003","16.737","0.003","26.438","0.003","90","","131.755","0.007","90","","6032.2","1.7","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C13 H32 Ag3 N16 O46 P S4 W12 -","- C13 H20 Ag3 N16 O46 P S4 W12 -","- C52 H80 Ag12 N64 O184 P4 S16 W48 -","4","1","","Hu, Hailiang; Zhang, Weisong; Gong, Jingjing; Dong, Huan; Zhao, Fangfang; Huang, Hui; Liu, Yang; Zhang, Guangju; Kang, Zhenhui","Can tetrazole-functionalized ligands realize the role-control of Keggin-type POMs in hybrid frameworks?","CrystEngComm","2014","16","25","5642","","10.1039/c4ce00293h","","","0.71073","MoKα","","0.0534","0.0312","","","0.0607","0.0689","","","","","","1.022","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216436","12.294","0.0006","21.514","0.0011","19.633","0.001","90","","90","","90","","5192.8","0.5","293","2","293","2","","","","","","","","8","P b c m","-P 2c 2b","57","","","","- C8 H34 Ag4 N12 O55 P V W11 -","- C8 H4 Ag4 N12 O41 P V0.96 W11.04 -","- C32 H16 Ag16 N48 O164 P4 V3.84 W44.16 -","4","0.5","","Wang, Xiu-Li; Cao, Jing-Jing; Liu, Guo-Cheng; Tian, Ai-Xiang; Luan, Jian; Lin, Hong-Yan; Zhang, Ju-Wen; Li, Na","Keggin-based 3D frameworks tuned by silver polymeric motifs: effect of the bi(triazole) substituent group on the architectures","CrystEngComm","2014","16","25","5732","","10.1039/c4ce00147h","","","0.71069","MoKα","","0.0484","0.0398","","","0.1041","0.1082","","","","","","1.057","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216437","12.308","0.0014","21.532","0.003","19.998","0.002","90","","90","","90","","5299.8","1.1","293","2","293","2","","","","","","","","8","P b c m","-P 2c 2b","57","","","","- C8 H61 Ag4 N12 O68 Si V W11 -","- C8 H4 Ag4.49 N12 O43 Si V0.96 W11.04 -","- C32 H16 Ag17.96 N48 O172 Si4 V3.84 W44.16 -","4","0.5","","Wang, Xiu-Li; Cao, Jing-Jing; Liu, Guo-Cheng; Tian, Ai-Xiang; Luan, Jian; Lin, Hong-Yan; Zhang, Ju-Wen; Li, Na","Keggin-based 3D frameworks tuned by silver polymeric motifs: effect of the bi(triazole) substituent group on the architectures","CrystEngComm","2014","16","25","5732","","10.1039/c4ce00147h","","","0.71069","MoKα","","0.089","0.0754","","","0.1888","0.1976","","","","","","1.062","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216438","14.376","0.0007","23.087","0.0008","21.206","0.0011","90","","130.199","0.014","90","","5375.9","1.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Ag4 N12 O44 P V W11 -","- C18 H10 Ag4 N14 O44 P V0.96 W11.04 -","- C72 H40 Ag16 N56 O176 P4 V3.84 W44.16 -","4","1","","Wang, Xiu-Li; Cao, Jing-Jing; Liu, Guo-Cheng; Tian, Ai-Xiang; Luan, Jian; Lin, Hong-Yan; Zhang, Ju-Wen; Li, Na","Keggin-based 3D frameworks tuned by silver polymeric motifs: effect of the bi(triazole) substituent group on the architectures","CrystEngComm","2014","16","25","5732","","10.1039/c4ce00147h","","","0.71069","MoKα","","0.0648","0.0508","","","0.1231","0.1309","","","","","","1.045","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216439","23.7011","0.0007","12.1758","0.0003","14.3519","0.0006","90","","105.526","0.002","90","","3990.5","0.2","173","0.2","173","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H12.6 N2 O11.3 Zr -","- C14 H10 N2 O11.259 Zr -","- C112 H80 N16 O90.072 Zr8 -","8","1","","Lee, Nam Hee; Lee, Dong Woo; Yeo, Hakmin; Kwak, Kyungwon; Chun, Hyang Sook; Ok, Kang Min","A molecular porous zirconium‒organic material exhibiting highly selective CO2 adsorption, high thermal stability, reversible hydration, facile ligand exchange and exclusive dimerization of phenylacetylene","CrystEngComm","2014","16","25","5619","","10.1039/c4ce00253a","","","0.71073","MoKα","","0.0696","0.0529","","","0.1534","0.1602","","","","","","1.454","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216440","30.4402","0.0013","11.6778","0.0004","15.9518","0.0006","90","","99.695","0.003","90","","5589.5","0.4","173","0.2","173","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H27 N5 O11 Zr -","- C23 H27 N5 O11 Zr -","- C184 H216 N40 O88 Zr8 -","8","1","","Lee, Nam Hee; Lee, Dong Woo; Yeo, Hakmin; Kwak, Kyungwon; Chun, Hyang Sook; Ok, Kang Min","A molecular porous zirconium‒organic material exhibiting highly selective CO2 adsorption, high thermal stability, reversible hydration, facile ligand exchange and exclusive dimerization of phenylacetylene","CrystEngComm","2014","16","25","5619","","10.1039/c4ce00253a","","","0.71073","MoKα","","0.1339","0.0419","","","0.0754","0.0948","","","","","","0.724","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216441","9.6801","0.0002","18.9975","0.0003","21.3644","0.0003","90","","90","","90","","3928.86","0.12","173","0.2","173","0.2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C17 H18 N2 O11 Zr -","- C17 H18 N2 O11 Zr -","- C136 H144 N16 O88 Zr8 -","8","1","","Lee, Nam Hee; Lee, Dong Woo; Yeo, Hakmin; Kwak, Kyungwon; Chun, Hyang Sook; Ok, Kang Min","A molecular porous zirconium‒organic material exhibiting highly selective CO2 adsorption, high thermal stability, reversible hydration, facile ligand exchange and exclusive dimerization of phenylacetylene","CrystEngComm","2014","16","25","5619","","10.1039/c4ce00253a","","","0.71073","MoKα","","0.057","0.0317","","","0.0664","0.0733","","","","","","0.913","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216442","12.3032","0.0016","11.0287","0.0015","19.618","0.003","90","","90.411","0.002","90","","2661.9","0.6","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H18 Cl2 Cu N4 O8 S2 -","- C24 H18 Cl2 Cu N4 O8 S2 -","- C96 H72 Cl8 Cu4 N16 O32 S8 -","4","0.5","","Zhao, Fangfang; Dong, Huan; Liu, BeiBei; Zhang, Guangju; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui","Tuning luminescence via transition metal-directed strategy in coordination polymers","CrystEngComm","2014","16","21","4422","","10.1039/c3ce42566e","","","0.71073","MoKα","","0.0276","0.0251","","","0.0664","0.0677","","","","","","1.046","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216443","5.4158","0.0006","11.4254","0.0013","12.559","0.0014","114.573","0.002","90.156","0.002","95.928","0.002","702.06","0.14","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H18 Cl2 Co N4 O10 S2 -","- C24 H18 Cl2 Co N4 O10 S2 -","- C24 H18 Cl2 Co N4 O10 S2 -","1","0.5","","Zhao, Fangfang; Dong, Huan; Liu, BeiBei; Zhang, Guangju; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui","Tuning luminescence via transition metal-directed strategy in coordination polymers","CrystEngComm","2014","16","21","4422","","10.1039/c3ce42566e","","","0.71073","MoKα","","0.0292","0.0272","","","0.0737","0.0749","","","","","","1.026","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216444","5.4158","0.0006","11.4254","0.0013","12.559","0.0014","114.573","0.002","90.156","0.002","95.928","0.002","702.06","0.14","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H18 Cl2 Mn N4 O10 S2 -","- C24 H18 Cl2 Mn N4 O10 S2 -","- C24 H18 Cl2 Mn N4 O10 S2 -","1","0.5","","Zhao, Fangfang; Dong, Huan; Liu, BeiBei; Zhang, Guangju; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui","Tuning luminescence via transition metal-directed strategy in coordination polymers","CrystEngComm","2014","16","21","4422","","10.1039/c3ce42566e","","","0.71073","MoKα","","0.0367","0.0346","","","0.091","0.0924","","","","","","1.018","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216445","7.4679","0.0007","10.8411","0.001","11.3461","0.0011","77.045","0.002","70.917","0.001","76.493","0.002","833.1","0.14","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H13 Ag Cl N3 O4 S -","- C17 H13 Ag Cl N3 O4 S -","- C34 H26 Ag2 Cl2 N6 O8 S2 -","2","1","","Zhao, Fangfang; Dong, Huan; Liu, BeiBei; Zhang, Guangju; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui","Tuning luminescence via transition metal-directed strategy in coordination polymers","CrystEngComm","2014","16","21","4422","","10.1039/c3ce42566e","","","0.71073","MoKα","","0.0315","0.026","","","0.0594","0.0616","","","","","","1.011","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216446","10.1145","0.0008","10.2684","0.0008","10.8689","0.0009","74.219","0.001","68.085","0.001","64.291","0.001","935.39","0.13","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H12 Cd Cl N3 O5 S -","- C17 H12 Cd Cl N3 O5 S -","- C34 H24 Cd2 Cl2 N6 O10 S2 -","2","1","","Zhao, Fangfang; Dong, Huan; Liu, BeiBei; Zhang, Guangju; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui","Tuning luminescence via transition metal-directed strategy in coordination polymers","CrystEngComm","2014","16","21","4422","","10.1039/c3ce42566e","","","0.71073","MoKα","","0.0251","0.0241","","","0.0673","0.0679","","","","","","1.026","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216447","15.746","0.004","10.962","0.003","22.411","0.005","90","","109.335","0.004","90","","3650.1","1.6","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H24 Cl2 N6 O9 S2 Zn2 -","- C34 H24 Cl2 N6 O9 S2 Zn2 -","- C136 H96 Cl8 N24 O36 S8 Zn8 -","4","0.5","","Zhao, Fangfang; Dong, Huan; Liu, BeiBei; Zhang, Guangju; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui","Tuning luminescence via transition metal-directed strategy in coordination polymers","CrystEngComm","2014","16","21","4422","","10.1039/c3ce42566e","","","0.71073","MoKα","","0.0415","0.031","","","0.0769","0.0824","","","","","","1.008","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216448","26.6699","0.0005","37.3628","0.0009","54.356","0.001","90","","90","","90","","54163.7","1.9","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C89 H105.2 N5 O42.6 S8 -","- C89 H75 N5 O42.6 S8 -","- C1424 H1200 N80 O681.6 S128 -","16","0.5","","Lesniewska, B.; Perret, F.; Suwinska, K.; Coleman, A. W.","Structural characterization of inclusion complexes of para-sulphonato-calix[8]arene with 1,2-bis(4-pyridyl)-ethane and 1,3-bis(4-pyridyl)-propane. New ‘double cone’ and ‘up‒flat‒down’ conformations of para-sulphonato-calix[8]arene","CrystEngComm","2014","16","21","4399","","10.1039/c3ce42303d","","","0.71073","MoKα","","0.1805","0.1429","","","0.3737","0.3943","","","","","","1.612","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216449","14.6443","0.0004","19.4468","0.0006","26.594","0.001","99.79","0.002","90.699","0.001","107.796","0.004","7089.5","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C121 H176 N10 O61 S8 -","- C120.75 H124 N10 O61 S8 -","- C241.5 H248 N20 O122 S16 -","2","1","","Lesniewska, B.; Perret, F.; Suwinska, K.; Coleman, A. W.","Structural characterization of inclusion complexes of para-sulphonato-calix[8]arene with 1,2-bis(4-pyridyl)-ethane and 1,3-bis(4-pyridyl)-propane. New ‘double cone’ and ‘up‒flat‒down’ conformations of para-sulphonato-calix[8]arene","CrystEngComm","2014","16","21","4399","","10.1039/c3ce42303d","","","0.71073","MoKα","","0.1756","0.1094","","","0.2716","0.3107","","","","","","0.996","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216450","9.926","0.003","10.992","0.004","7.12","0.002","90","","90","","90","","776.8","0.4","293","2","293","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- C3 Gd Na3 O9 -","- C3 Gd Na3 O9 -","- C12 Gd4 Na12 O36 -","4","0.5","","Luo, Min; Lin, Chensheng; Zou, Guohong; Ye, Ning; Cheng, Wendan","Sodium–rare earth carbonates with shorite structure and large second harmonic generation response","CrystEngComm","2014","16","21","4414","","10.1039/c4ce00183d","","","0.71073","MoKα","","0.0167","0.0162","","","0.0435","0.0437","","","","","","1.152","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7216451","9.82","0.014","10.883","0.016","7.038","0.009","90","","90","","90","","752.2","1.8","293","2","293","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- C3 Na3 O9 Y -","- C3 Na3 O9 Y -","- C12 Na12 O36 Y4 -","4","0.5","","Luo, Min; Lin, Chensheng; Zou, Guohong; Ye, Ning; Cheng, Wendan","Sodium–rare earth carbonates with shorite structure and large second harmonic generation response","CrystEngComm","2014","16","21","4414","","10.1039/c4ce00183d","","","0.71073","MoKα","","0.0392","0.0326","","","0.0636","0.0665","","","","","","1.08","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7216452","5.7765","0.0006","13.4566","0.0013","19.456","0.002","90","","90","","90","","1512.4","0.3","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 Cl N3 O -","- C15 H18 Cl N3 O -","- C60 H72 Cl4 N12 O4 -","4","1","","Davey, Roger J.; Sadiq, Ghazala; Seaton, Colin C.; Pritchard, Robin G.; Coquerel, Gerard; Rougeot, Celine","Racemic compound versus conglomerate: concerning the crystal chemistry of the triazoylketone, 1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-one","CrystEngComm","2014","16","21","4377","","10.1039/c4ce00615a","","x-ray","0.71073","MoKα","","0.0881","0.0557","","","0.0774","0.0901","","","","","","1.007","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216453","10.3388","0.0007","10.3388","0.0007","9.4073","0.0012","90","","90","","90","","1005.55","0.16","296","2","296","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C2 H8 Al Ge3 N O8 -","- C2 H4 Al Ge3 N O8 -","- C8 H16 Al4 Ge12 N4 O32 -","4","0.5","","Wang, Jiahong; Zhang, Yu; Zhang, Zaichao; Xu, Yan","Synthesis and structural characterization of three 3-D aluminogermanates with different topologies","CrystEngComm","2014","16","23","5103","","10.1039/c3ce42585a","","","0.71073","MoKα","","0.0306","0.0288","","","0.1166","0.1179","","","","","","1.057","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216454","10.3404","0.0003","10.3404","0.0003","9.4021","0.0007","90","","90","","90","","1005.31","0.09","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C2 H8 Al Ge3 N O8 -","- C2 H8 Al Ge3 N O8 -","- C8 H32 Al4 Ge12 N4 O32 -","4","0.5","","Wang, Jiahong; Zhang, Yu; Zhang, Zaichao; Xu, Yan","Synthesis and structural characterization of three 3-D aluminogermanates with different topologies","CrystEngComm","2014","16","23","5103","","10.1039/c3ce42585a","","","0.71073","MoKα","","0.0271","0.0253","","","0.0756","0.0765","","","","","","1.125","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216455","16.4699","0.0007","16.4699","0.0007","16.4699","0.0007","90","","90","","90","","4467.6","0.3","293","2","293","2","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C7 H29 Al3 Ge3 N7 Ni O12 -","- C7 H12 Al3 Ge3 N6.99 Ni O12 -","- C56 H96 Al24 Ge24 N55.92 Ni8 O96 -","8","0.333333","","Wang, Jiahong; Zhang, Yu; Zhang, Zaichao; Xu, Yan","Synthesis and structural characterization of three 3-D aluminogermanates with different topologies","CrystEngComm","2014","16","23","5103","","10.1039/c3ce42585a","","","0.71073","MoKα","","0.05","0.0389","","","0.1193","0.1243","","","","","","1.136","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216456","22.0842","0.0002","22.0842","0.0002","28.0921","0.0006","90","","90","","120","","11865.3","0.3","296","2","296","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C30 H35 K4 La3 N12 O74 Si W12 -","- C30 H15 K3.99 La3 N12 O69.49 Si W12 -","- C180 H90 K23.94 La18 N72 O416.94 Si6 W72 -","6","0.333333","","Gao, Guang-Gang; Song, Chao-Yu; Zong, Xi-Ming; Chai, Dong-Feng; Liu, Hong; Zou, Yu-Long; Liu, Jian-Xun; Qiu, Yun-Feng","Solvent-controlled 3D lanthanide‒polyoxometalate frameworks: reduction and stabilization of Ag nanocomposites and catalytic properties","CrystEngComm","2014","16","23","5150","","10.1039/c4ce00403e","","","0.71073","MoKα","","0.0438","0.0327","","","0.0716","0.0763","","","","","","1.011","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216457","22.152","0.0004","22.152","0.0004","28.2012","0.0012","90","","90","","120","","11984.6","0.6","296","2","296","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C30 H33 Ce3 K4 N12 O73 Si W12 -","- C30 H15 Ce3 K3.99 N12 O70.48 Si W12 -","- C180 H90 Ce18 K23.94 N72 O422.88 Si6 W72 -","6","0.333333","","Gao, Guang-Gang; Song, Chao-Yu; Zong, Xi-Ming; Chai, Dong-Feng; Liu, Hong; Zou, Yu-Long; Liu, Jian-Xun; Qiu, Yun-Feng","Solvent-controlled 3D lanthanide‒polyoxometalate frameworks: reduction and stabilization of Ag nanocomposites and catalytic properties","CrystEngComm","2014","16","23","5150","","10.1039/c4ce00403e","","","0.71073","MoKα","","0.0269","0.0227","","","0.0513","0.0533","","","","","","1.012","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216458","13.685","0.005","13.144","0.004","22.649","0.007","90","","100.551","0.005","90","","4005","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H46 La4 N8 O75 Si W12 -","- C20 H8 La4 N8 O73 Si W12 -","- C40 H16 La8 N16 O146 Si2 W24 -","2","0.5","","Gao, Guang-Gang; Song, Chao-Yu; Zong, Xi-Ming; Chai, Dong-Feng; Liu, Hong; Zou, Yu-Long; Liu, Jian-Xun; Qiu, Yun-Feng","Solvent-controlled 3D lanthanide‒polyoxometalate frameworks: reduction and stabilization of Ag nanocomposites and catalytic properties","CrystEngComm","2014","16","23","5150","","10.1039/c4ce00403e","","","0.71073","MoKα","","0.1585","0.0838","","","0.1734","0.2035","","","","","","1.01","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216459","13.7014","0.001","13.1554","0.001","22.7273","0.0017","90","","100.366","0.001","90","","4029.7","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H46 Ce4 N8 O75 Si W12 -","- C20 H8 Ce4 N8 O78 Si W12 -","- C40 H16 Ce8 N16 O156 Si2 W24 -","2","0.5","","Gao, Guang-Gang; Song, Chao-Yu; Zong, Xi-Ming; Chai, Dong-Feng; Liu, Hong; Zou, Yu-Long; Liu, Jian-Xun; Qiu, Yun-Feng","Solvent-controlled 3D lanthanide‒polyoxometalate frameworks: reduction and stabilization of Ag nanocomposites and catalytic properties","CrystEngComm","2014","16","23","5150","","10.1039/c4ce00403e","","","0.71073","MoKα","","0.0782","0.073","","","0.1487","0.1514","","","","","","1.014","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216463","16.529","0.002","16.529","0.002","16.604","0.002","90","","90","","90","","4536.3","0.9","293","2","293","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C40 H38 Cl2 N8 O11 S4 Zn -","- C40 H38 Cl2 N8 O11 S4 Zn -","- C160 H152 Cl8 N32 O44 S16 Zn4 -","4","0.5","","De la Pinta, Noelia; Caballero, Ana B.; Madariaga, Gotzon; Ezpeleta, José M.; Rodriguez-Dieguez, Antonio; Salas, Juan M.; Cortés, Roberto","DPDS‒DPS in situ transformation at room temperature via a 1,2-nucleophilic addition mechanism","CrystEngComm","2014","16","36","8322","","10.1039/C4CE00781F","","","0.71073","MoKα","","0.0511","0.046","","","0.1156","0.1195","","","","","","1.021","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216464","9.694","0.003","11.143","0.004","11.326","0.003","87.71","0.04","76.9","0.03","67.65","0.04","1100.6","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H32 Mn N10 S6 -","- C42 H32 Mn N10 S6 -","- C42 H32 Mn N10 S6 -","1","0.5","","De la Pinta, Noelia; Caballero, Ana B.; Madariaga, Gotzon; Ezpeleta, José M.; Rodriguez-Dieguez, Antonio; Salas, Juan M.; Cortés, Roberto","DPDS‒DPS in situ transformation at room temperature via a 1,2-nucleophilic addition mechanism","CrystEngComm","2014","16","36","8322","","10.1039/C4CE00781F","","","0.71073","MoKα","","0.1201","0.0394","","","","0.094","","","","","","0.787","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216465","14.545","0.003","14.834","0.003","12.805","0.004","90","","90","","90","","2762.8","1.2","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C12 H8 N4 O2 S Zn -","- C12 H8 N4 O2 S Zn -","- C96 H64 N32 O16 S8 Zn8 -","8","1","","De la Pinta, Noelia; Caballero, Ana B.; Madariaga, Gotzon; Ezpeleta, José M.; Rodriguez-Dieguez, Antonio; Salas, Juan M.; Cortés, Roberto","DPDS‒DPS in situ transformation at room temperature via a 1,2-nucleophilic addition mechanism","CrystEngComm","2014","16","36","8322","","10.1039/C4CE00781F","","","0.71069","MoKα","","0.1409","0.029","","","","0.0613","","","","","","0.801","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216466","17.001","0.006","10.288","0.004","16.629","0.006","90","","118.53","0.04","90","","2555.3","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 Fe N6 O2 S4 -","- C22 H20 Fe N6 O2 S4 -","- C88 H80 Fe4 N24 O8 S16 -","4","0.5","","De la Pinta, Noelia; Caballero, Ana B.; Madariaga, Gotzon; Ezpeleta, José M.; Rodriguez-Dieguez, Antonio; Salas, Juan M.; Cortés, Roberto","DPDS‒DPS in situ transformation at room temperature via a 1,2-nucleophilic addition mechanism","CrystEngComm","2014","16","36","8322","","10.1039/C4CE00781F","","","0.71069","MoKα","","0.2429","0.0446","","","","0.1051","","","","","","0.625","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216478","25.985","0.005","13.713","0.003","24.798","0.005","90","","112.39","0.03","90","","8170","3","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H36 Cu3 N6 O9 -","- C36 H36 Cu3 N6 O9 -","- C288 H288 Cu24 N48 O72 -","8","1","","Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian","Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents","CrystEngComm","2014","16","42","9792","","10.1039/C4CE00898G","","","0.71073","MoKα","","0.084","0.0746","","","0.1692","0.1755","","","","","","1.136","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216479","22.533","0.004","23.066","0.005","14.201","0.003","90","","90","","90","","7381","3","293","2","293","2","","","","","","","","5","P b a 2","P 2 -2ab","32","","","","- C68 H63 Cu6 N11 O17 -","- C68 H63 Cu6 N11 O17 -","- C272 H252 Cu24 N44 O68 -","4","1","","Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian","Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents","CrystEngComm","2014","16","42","9792","","10.1039/C4CE00898G","","","0.71073","MoKα","","0.0939","0.0535","","","0.1312","0.1525","","","","","","0.85","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216480","9.6951","0.0019","21.832","0.004","19.246","0.004","90","","97.76","0.03","90","","4036.4","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H39 Cu3 N7 O10 -","- C37 H39 Cu3 N7 O10 -","- C148 H156 Cu12 N28 O40 -","4","1","","Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian","Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents","CrystEngComm","2014","16","42","9792","","10.1039/C4CE00898G","","","0.71073","MoKα","","0.1502","0.072","","","0.1626","0.206","","","","","","0.959","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216481","14.76","0.003","14.694","0.003","18.395","0.004","90","","98.88","0.03","90","","3941.8","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H33 Cu3 N7 O7 -","- C41 H33 Cu3 N7 O7 -","- C164 H132 Cu12 N28 O28 -","4","1","","Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian","Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents","CrystEngComm","2014","16","42","9792","","10.1039/C4CE00898G","","","0.71073","MoKα","","0.0689","0.0421","","","0.1233","0.1422","","","","","","0.922","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216482","41.72","0.003","8.6534","0.0005","28.881","0.002","90","","120.329","0.005","90","","8999.6","1.1","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41.5 H51.5 Cu3 N10.5 O11.5 -","- C41.5 H51.5 Cu3 N10.5 O11.5 -","- C332 H412 Cu24 N84 O92 -","8","1","","Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian","Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents","CrystEngComm","2014","16","42","9792","","10.1039/C4CE00898G","","","0.71073","MoKα","","0.0852","0.0634","","","0.1486","0.1666","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216483","23.049","0.005","11.765","0.005","22.522","0.005","90","0.005","101.828","0.005","90","0.005","5978","3","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H30 Ag5 Mo12 N10 O43 P -","- C32 H24 Ag5 Mo12 N10 O40 P -","- C128 H96 Ag20 Mo48 N40 O160 P4 -","4","0.5","","Zhou, Wei-Li; Liang, Jun; Qin, Chao; Shao, Kui-Zhan; Wang, Fang-Ming; Su, Zhong-Min","Syntheses, crystal structures and properties of inorganic‒organic hybrids constructed from Keggin-type polyoxometalates and silver coordination compounds","CrystEngComm","2014","16","32","7410","","10.1039/C4CE00633J","","","0.71069","MoKα","","0.0941","0.0448","","","0.082","0.1026","","","","","","1.055","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216484","12.977","0.005","20.255","0.005","21.995","0.005","90","0.005","97.708","0.005","90","0.005","5729","3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 Ag4 Mo12 N12 Na O42 P -","- C24 H18 Ag4 Mo12 N12 Na O41 P -","- C96 H72 Ag16 Mo48 N48 Na4 O164 P4 -","4","1","","Zhou, Wei-Li; Liang, Jun; Qin, Chao; Shao, Kui-Zhan; Wang, Fang-Ming; Su, Zhong-Min","Syntheses, crystal structures and properties of inorganic‒organic hybrids constructed from Keggin-type polyoxometalates and silver coordination compounds","CrystEngComm","2014","16","32","7410","","10.1039/C4CE00633J","","","0.71069","MoKα","","0.0389","0.0265","","","0.0517","0.0553","","","","","","1.004","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216485","11.396","0.005","11.792","0.005","13.376","0.005","65.249","0.005","80.299","0.005","61.303","0.005","1430.7","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H28 Ag4 Mo12 N6 O42 P -","- C30 H24 Ag4 Mo12 N6 O42 P -","- C30 H24 Ag4 Mo12 N6 O42 P -","1","0.5","","Zhou, Wei-Li; Liang, Jun; Qin, Chao; Shao, Kui-Zhan; Wang, Fang-Ming; Su, Zhong-Min","Syntheses, crystal structures and properties of inorganic‒organic hybrids constructed from Keggin-type polyoxometalates and silver coordination compounds","CrystEngComm","2014","16","32","7410","","10.1039/C4CE00633J","","","0.71069","MoKα","","0.0516","0.0385","","","0.084","0.0901","","","","","","1.083","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216486","22.902","0.005","11.913","0.005","22.594","0.005","90","0.005","101.657","0.005","90","0.005","6037","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H30 Ag5 N10 O43 P W12 -","- C32 H24 Ag5 N10 O40 P W12 -","- C128 H96 Ag20 N40 O160 P4 W48 -","4","0.5","","Zhou, Wei-Li; Liang, Jun; Qin, Chao; Shao, Kui-Zhan; Wang, Fang-Ming; Su, Zhong-Min","Syntheses, crystal structures and properties of inorganic‒organic hybrids constructed from Keggin-type polyoxometalates and silver coordination compounds","CrystEngComm","2014","16","32","7410","","10.1039/C4CE00633J","","","0.71069","MoKα","","0.0758","0.0548","","","0.1123","0.1207","","","","","","1.093","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216487","10.324","0.003","18.828","0.005","21.852","0.006","69.016","0.006","84.428","0.01","75.039","0.01","3831.4","1.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","[(±)-2,7,12-tripropoxy-3,8,13-tris(4-pyridylcarboxy)-10,15- dihydro-5H-tribenzo[a,d,g]cyclononene]silver (I) cobalt(III) bis(dicarbollide) hydrate dimethylformamide","","- C59.5 H86.5 Ag B18 Co N5.5 O12.5 -","- C59.5 H84.5 Ag B18 Co N5.5 O12.5 -","- C119 H169 Ag2 B36 Co2 N11 O25 -","2","1","","Henkelis, James J.; Hardie, Michaele J.","Tuning the coordination chemistry of cyclotriveratrylene ligand pairs through alkyl chain aggregation","CrystEngComm","2014","16","35","8138","","10.1039/C4CE00467A","","","0.6889","synchrotron","","0.0885","0.0807","","","0.2334","0.2426","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216488","38.7","0.003","9.6729","0.001","38.853","0.004","90","","111.954","0.004","90","","13490","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","aquodonitro[(±)-2,7,12-tripropoxy-3,8,13-tris(4-pyridylcarboxy)- 10,15-dihydro-5H-tribenzo[a,d,g]cyclononene]cadmium(II) diethylether dimethylformamide clathrate","","- C106 H118 Cd2 N12 O35 -","- C106 H114 Cd2 N12 O35 -","- C424 H456 Cd8 N48 O140 -","4","0.5","","Henkelis, James J.; Hardie, Michaele J.","Tuning the coordination chemistry of cyclotriveratrylene ligand pairs through alkyl chain aggregation","CrystEngComm","2014","16","35","8138","","10.1039/C4CE00467A","","","0.71073","MoKα","","0.1749","0.1335","","","0.385","0.4291","","","","","","1.617","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216489","19.3628","0.0007","43.7924","0.0011","16.6371","0.0006","90","","90.525","0.003","90","","14106.7","0.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{(±)-2,7,12-tripropoxy-3,8,13- tris(2-quinolylmethyl)-10,15-dihydro-5H-tribenzo[a,d,g] cyclononene}silver(I) cobalt(III) bis(dicarbollide) nitromethane","","- C129.5 H163.5 Ag2 B36 Co2 N7.5 O15 -","- C129.5 H163.5 Ag2 B36 Co2 N7.5 O15 -","- C518 H654 Ag8 B144 Co8 N30 O60 -","4","1","","Henkelis, James J.; Hardie, Michaele J.","Tuning the coordination chemistry of cyclotriveratrylene ligand pairs through alkyl chain aggregation","CrystEngComm","2014","16","35","8138","","10.1039/C4CE00467A","","","0.6889","synchrotron","","0.135","0.1128","","","0.3054","0.3462","","","","","","1.377","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216490","21.057","0.005","44.917","0.009","40.687","0.008","90","","97.365","0.006","90","","38165","14","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[dodeca(trifluoroacetate)tetra{(±)-2,7,12-tripropoxy-3,8,13- tris(2-quinolylmethyl)-10,15-dihydro-5H-tribenzo[a,d,g] cyclononene}hexaplatinum(II) ether","","- C268 H234 F36 N12 O49 Pd6 -","- C268 H234 F36 N12 O49 Pd6 -","- C1072 H936 F144 N48 O196 Pd24 -","4","0.5","","Henkelis, James J.; Hardie, Michaele J.","Tuning the coordination chemistry of cyclotriveratrylene ligand pairs through alkyl chain aggregation","CrystEngComm","2014","16","35","8138","","10.1039/C4CE00467A","","","0.71073","MoKα","","0.1251","0.0914","","","0.2444","0.2572","","","","","","1.546","","","","has coordinates,has disorder","180495","2020-10-21","18:00:00",""
"7216491","13.745","0.0008","24.8293","0.0014","7.2076","0.0004","90","","95.191","0.001","90","","2449.7","0.2","95","2","95","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1-Iodo-3,5-bis(4',4',5',5'-tetramethyl-4',5'-dihydro- 1'H-imidazole-1'-oxyl)benzene - co - dichloromethane","","- C21 H29.72 Cl2 I N4 O2.36 -","- C21 H29 Cl2 I N4 O2.36 -","- C84 H116 Cl8 I4 N16 O9.44 -","4","0.5","","Akpinar, Handan; Schlueter, John A.; Lahti, Paul M.","Organizing a bis(iminoylnitroxide) diradical into antiferromagnetically coupled chains by co-crystallization with dichloromethane","CrystEngComm","2014","16","26","5832","","10.1039/c4ce00207e","","x-ray","0.3936","synchrotron","","0.046","0.0404","","","0.1157","0.1192","","","","","","1.161","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216492","14.8642","0.0011","18.5544","0.0015","4.7094","0.0004","90","","90","","90","","1298.84","0.18","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","none","4-aminobenzoic acid + 2-acetaminopyridine","","- C14 H15 N3 O3 -","- C14 H15 N3 O3 -","- C56 H60 N12 O12 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0422","0.0329","","","0.0742","0.0788","","","","","","1.036","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216493","12.776","0.003","5.1844","0.001","19.547","0.004","90","","103.08","0.03","90","","1261.1","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","none","benzoic acid + 2-acetaminopyridine","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C56 H56 N8 O12 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0783","0.0401","","","0.0935","0.1076","","","","","","0.974","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216494","8.4349","0.0017","23.547","0.005","7.127","0.0014","90","","90.22","0.03","90","","1415.5","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","none","4-aminobenzoic acid + 2-acetamido-6-methylpyridine","","- C15 H17 N3 O3 -","- C15 H17 N3 O3 -","- C60 H68 N12 O12 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.1665","0.0583","","","0.1218","0.1566","","","","","","0.989","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216495","9.0318","0.0007","10.8602","0.0009","23.561","0.0019","90","","97.95","0.002","90","","2288.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","none","2(4-methoxybenzoic acid) + 4,4-bipyridine","","- C26 H24 N2 O6 -","- C26 H24 N2 O6 -","- C104 H96 N8 O24 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0598","0.0398","","","0.1011","0.1133","","","","","","1.029","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216496","7.3345","0.0015","9.1868","0.0018","21.307","0.004","90","","93.3","0.03","90","","1433.3","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","none","4-aminobenzoic acid + 6-aminoquinoline","","- C16 H15 N3 O2 -","- C16 H15 N3 O2 -","- C64 H60 N12 O8 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.042","0.0363","","","0.0987","0.1032","","","","","","1.065","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216497","3.7592","0.0013","27.082","0.009","6.551","0.002","90","","90.735","0.008","90","","666.9","0.4","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","none","4-nitrobenzoic acid + quinoline","","- C16 H12 N2 O4 -","- C16 H12 N2 O4 -","- C32 H24 N4 O8 -","2","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0837","0.047","","","0.0901","0.1029","","","","","","0.99","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216498","11.5","0.002","15.191","0.003","12.228","0.002","90","","90","","90","","2136.2","0.7","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","none","benzoic acid + 2-aminopyridine","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C96 H96 N16 O16 -","8","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.1054","0.0443","","","0.0929","0.11","","","","","","0.95","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216499","9.6861","0.0007","10.3327","0.0007","12.0022","0.0008","90","","97.765","0.002","90","","1190.21","0.14","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","none","4-bromobenzoic acid + 2-aminopyridine","","- C12 H11 Br N2 O2 -","- C12 H11 Br N2 O2 -","- C48 H44 Br4 N8 O8 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0254","0.0208","","","0.0515","0.0533","","","","","","1.043","","","","has coordinates","180495","2020-10-21","18:00:00",""
"7216500","5.5541","0.0011","8.5531","0.0017","25.38","0.005","90","","90","","90","","1205.7","0.4","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","none","4-aminobenzoic acid + 2-amino-4-methylpyridine","","- C13 H15 N3 O2 -","- C13 H15 N3 O2 -","- C52 H60 N12 O8 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0802","0.0389","","","0.0711","0.0795","","","","","","0.94","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216501","9.4403","0.0019","11.509","0.002","12.69","0.003","90","","110.77","0.03","90","","1289.1","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","none","4-methoxybenzoic acid + 2-amino-6-methylpyridine","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0863","0.0423","","","0.0863","0.0972","","","","","","0.958","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216502","10.337","0.002","11.727","0.002","11.031","0.002","90","","105.53","0.03","90","","1288.4","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","none","4-methoxybenzoic acid + 2-amino-4-methylpyridine","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.104","0.0462","","","0.1029","0.1209","","","","","","0.938","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216503","11.888","0.002","12.313","0.003","16.815","0.003","90","","90","","90","","2461.3","0.9","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","none","benzoic acid + 2-amino-6-methylpyridine","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C104 H112 N16 O16 -","8","2","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.1051","0.0525","","","0.1079","0.1297","","","","","","1.019","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216504","17.1239","0.0016","4.1317","0.0004","22.882","0.002","90","","111.762","0.002","90","","1503.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","none","4-bromobenzoic acid + 2-amino-6-methylpyridine + 2(water)","","- C13 H17 Br N2 O4 -","- C13 H15 Br N2 O4 -","- C52 H60 Br4 N8 O16 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0455","0.0303","","","0.0751","0.082","","","","","","1","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216505","9.5786","0.0019","11.539","0.002","11.311","0.002","90","","100.45","0.03","90","","1229.4","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","none","4-bromobenzoic acid + 2-amino-4-methylpyridine","","- C13 H13 Br N2 O2 -","- C13 H13 Br N2 O2 -","- C52 H52 Br4 N8 O8 -","4","1","","Ramon, Gaëlle; Davies, Kate; Nassimbeni, Luigi R.","Structures of benzoic acids with substituted pyridines and quinolines: salt versus co-crystal formation","CrystEngComm","2014","16","26","5802","","10.1039/c3ce41963k","","","0.71073","MoKα","","0.0387","0.0242","","","0.0526","0.0557","","","","","","1.048","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216506","11.478","0.002","15.142","0.003","19.266","0.004","90","","101.27","0.03","90","","3283.9","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline. 2,2-bis(4-hydroxyphenyl)propane cocrystal","","- C40 H36 N2 O3 -","- C40 H36 N2 O3 -","- C160 H144 N8 O12 -","4","1","","Feng, Qi; Wang, Mingliang; Xu, Chunxiang; Khan, Arshad; Wu, Xiaojuan; Lu, Jiao; Wei, Xiang","Investigation of molecular arrangements and solid-state fluorescence properties of solvates and cocrystals of 1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline","CrystEngComm","2014","16","26","5820","","10.1039/c3ce42210k","","","0.71073","MoKα","","0.158","0.0659","","","0.1466","0.1906","","","","","","1.003","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216507","13.383","0.003","9.766","0.002","18.67","0.004","90","","100.97","0.03","90","","2395.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline.chloroform solvate","","- C26 H21 Cl3 N2 O -","- C26 H21 Cl3 N2 O -","- C104 H84 Cl12 N8 O4 -","4","1","","Feng, Qi; Wang, Mingliang; Xu, Chunxiang; Khan, Arshad; Wu, Xiaojuan; Lu, Jiao; Wei, Xiang","Investigation of molecular arrangements and solid-state fluorescence properties of solvates and cocrystals of 1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline","CrystEngComm","2014","16","26","5820","","10.1039/c3ce42210k","","","0.71073","MoKα","","0.182","0.0741","","","0.133","0.1697","","","","","","1.006","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216508","10.258","0.002","12.272","0.003","16.034","0.003","90","","105.53","0.03","90","","1944.8","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline monohydrate","","- C25 H22 N2 O2 -","- C25 H22 N2 O2 -","- C100 H88 N8 O8 -","4","1","","Feng, Qi; Wang, Mingliang; Xu, Chunxiang; Khan, Arshad; Wu, Xiaojuan; Lu, Jiao; Wei, Xiang","Investigation of molecular arrangements and solid-state fluorescence properties of solvates and cocrystals of 1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline","CrystEngComm","2014","16","26","5820","","10.1039/c3ce42210k","","","0.71073","MoKα","","0.1601","0.0685","","","0.1252","0.1519","","","","","","1.002","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216509","22.826","0.005","10.082","0.002","10.677","0.002","90","","90","","90","","2457.1","0.9","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline.phenol cocrystal","","- C31 H26 N2 O2 -","- C31 H26 N2 O2 -","- C124 H104 N8 O8 -","4","1","","Feng, Qi; Wang, Mingliang; Xu, Chunxiang; Khan, Arshad; Wu, Xiaojuan; Lu, Jiao; Wei, Xiang","Investigation of molecular arrangements and solid-state fluorescence properties of solvates and cocrystals of 1-acetyl-3-phenyl-5-(9-anthryl)-2-pyrazoline","CrystEngComm","2014","16","26","5820","","10.1039/c3ce42210k","","","0.71073","MoKα","","0.1722","0.0731","","","0.1024","0.1278","","","","","","1","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216510","6.9931","0.0014","10.127","0.002","15.112","0.003","95.46","0.03","96.7","0.03","101.17","0.03","1035.1","0.4","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H18 F3 N5 O4 -","- C21 H18 F3 N5 O4 -","- C42 H36 F6 N10 O8 -","2","1","","Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.","Cocrystallization with flufenamic acid: comparison of physicochemical properties of two pharmaceutical cocrystals","CrystEngComm","2014","16","26","5793","","10.1039/c3ce42182a","","","0.71073","MoKα","","0.0705","0.0628","","","0.2017","0.232","","","","","","1.188","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216511","7.5628","0.0015","7.645","0.0015","14.552","0.003","90.45","0.03","92.14","0.03","95.81","0.03","836.4","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H15 F3 N2 O3 -","- C19 H15 F3 N2 O3 -","- C38 H30 F6 N4 O6 -","2","1","","Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.","Cocrystallization with flufenamic acid: comparison of physicochemical properties of two pharmaceutical cocrystals","CrystEngComm","2014","16","26","5793","","10.1039/c3ce42182a","","","0.71073","MoKα","","0.0979","0.0789","","","0.1889","0.2023","","","","","","1.184","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216512","9.827","0.002","10.361","0.002","25.005","0.005","84.67","0.03","81.34","0.03","71.46","0.03","2383.5","0.9","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H28 F6 N4 O4 -","- C38 H28 F6 N4 O4 -","- C114 H84 F18 N12 O12 -","3","1.5","","Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.","Cocrystallization with flufenamic acid: comparison of physicochemical properties of two pharmaceutical cocrystals","CrystEngComm","2014","16","26","5793","","10.1039/c3ce42182a","","","0.71073","MoKα","","0.2316","0.1985","","","0.473","0.4988","","","","","","1.572","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216513","9.9973","0.0013","22.788","0.003","10.4078","0.0014","90","","91.243","0.001","90","","2370.5","0.5","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C88 H128 Cl8 N8 O8 -","8","2","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0649","0.0385","","0.0872","0.0732","0.0872","","","","","","1.0075","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216514","10.0093","0.0003","22.8207","0.0008","10.4016","0.0004","90","","91.416","0.002","90","","2375.2","0.14","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C88 H128 Cl8 N8 O8 -","8","2","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0625","0.0376","","0.1","0.0806","0.1","","","","","","1.099","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216515","10.0604","0.0018","22.876","0.004","10.4041","0.0019","90","","91.741","0.002","90","","2393.3","0.7","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C88 H128 Cl8 N8 O8 -","8","2","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.084","0.0384","","0.0769","0.0717","0.0769","","","","","","0.7821","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216516","7.116","0.0012","22.916","0.004","7.3818","0.0013","90","","91.415","0.002","90","","1203.4","0.4","180","","180","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0639","0.0386","","0.0989","0.0951","0.0989","","","","","","0.9037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216517","7.1234","0.0014","22.966","0.004","7.3986","0.0014","90","","91.146","0.002","90","","1210.1","0.4","210","","210","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0677","0.0407","","0.1072","0.0909","0.1072","","","","","","0.9846","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216518","7.1264","0.0014","22.986","0.005","7.4072","0.0014","90","","90.974","0.002","90","","1213.2","0.4","230","","230","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-4'-methylmethcathinone hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0714","0.0413","","0.115","0.0939","0.115","","","","","","0.9794","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216519","7.1314","0.0014","23.013","0.005","7.418","0.0015","90","","90.803","0.002","90","","1217.3","0.4","250","","250","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0771","0.0381","","0.09","0.0857","0.09","","","","","","0.8468","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216520","7.1365","0.0014","23.041","0.005","7.4304","0.0015","90","","90.628","0.002","90","","1221.7","0.4","275","","275","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0836","0.0391","","0.0892","0.0841","0.0892","","","","","","0.8112","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216521","7.1345","0.0007","23.048","0.003","7.433","0.0008","90","","90.449","0.006","90","","1222.2","0.2","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-4'-methylmethcathinone Hydrochloride, Mephedrone","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.081","0.0456","","0.1403","0.1109","0.1403","","","","","","1.0185","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216522","5.7804","0.0004","19.7971","0.0014","10.5967","0.0006","90","","100.841","0.003","90","","1190.99","0.14","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-4'-methylmethcathinone Hydrobromide","","- C11 H16 Br N O -","- C11 H16 Br N O -","- C44 H64 Br4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0333","0.0264","","0.0706","0.0668","0.0706","","","","","","0.9801","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216523","10.8355","0.0019","10.203","0.0017","11.5425","0.0019","90","","111.839","0.008","90","","1184.5","0.4","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-4'-methylmethcathinone Hydrobromide","","- C11 H16 Br N O -","- C11 H16 Br N O -","- C44 H64 Br4 N4 O4 -","4","1","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0257","0.02","","0.0476","0.0446","0.0476","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216524","10.2017","0.0006","22.3376","0.0013","10.5639","0.0006","90","","90.157","0.003","90","","2407.3","0.2","123","","123","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","30:70 (±)-4'-methylmethcathinone hydrochloride hydrobromide salt solution","","- C11 H16 Br0.72 Cl0.28 N O -","- C11 H16 Br0.7185 Cl0.2815 N O -","- C88 H128 Br5.748 Cl2.252 N8 O8 -","8","2","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0399","0.0286","","0.0701","0.0628","0.0701","","","","","","1.0075","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216525","10.1409","0.0011","22.488","0.003","10.4979","0.0011","90","","90.359","0.008","90","","2394","0.5","123","","123","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","60:40 (±)-4'-methylmethcathinone hydrochloride hydrobromide salt solution","","- C11 H16 Br0.4 Cl0.6 N O -","- C11 H16 Br0.4035 Cl0.5965 N O -","- C88 H128 Br3.228 Cl4.772 N8 O8 -","8","2","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.1608","0.1186","","0.4127","0.3897","0.4127","","","","","","1.5578","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216526","10.1012","0.0005","22.5506","0.0012","10.4737","0.0005","90","","90.441","0.003","90","","2385.7","0.2","123","","123","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","70:30 (±)-4'-methylmethcathinone hydrochloride hydrobromide salt solution","","- C11 H16 Br0.3 Cl0.7 N O -","- C11 H16 Br0.3025 Cl0.6975 N O -","- C88 H128 Br2.42 Cl5.58 N8 O8 -","8","2","","Delori, Amit; Maclure, Pauline; Bhardwaj, Rajni M.; Johnston, Andrea; Florence, Alastair J.; Sutcliffe, Oliver B.; Oswald, Iain D. H.","Drug solid solutions ‒ a method for tuning phase transformations","CrystEngComm","2014","16","26","5827","","10.1039/c4ce00211c","","","0.71073","MoKα","","0.0374","0.0321","","0.0753","0.0698","0.0753","","","","","","1.0369","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216527","27.4599","0.0012","5.6654","0.0002","11.4275","0.0005","90","","92.25","0.002","90","","1776.42","0.13","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 F N2 O3 -","- C21 H20 F N2 O3 -","- C84 H80 F4 N8 O12 -","4","1","","Blagden, N.; Coles, S. J.; Berry, D. J.","Pharmaceutical co-crystals ‒ are we there yet?","CrystEngComm","2014","16","26","5753","","10.1039/c4ce00127c","","","0.71073","MoKα","","0.1033","0.0543","","","0.1219","0.1448","","","","","","1.04","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216528","7.624","0.006","5.8","0.004","36.02","0.03","90","","90.017","0.008","90","","1593","2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 N O3 -","- C19 H18 N O3 -","- C76 H72 N4 O12 -","4","1","","Manoj, K.; Tamura, Rui; Takahashi, Hiroki; Tsue, Hirohito","Crystal engineering of homochiral molecular organization of naproxen in cocrystals and their thermal phase transformation studies","CrystEngComm","2014","16","26","5811","","10.1039/c3ce42415d","","","0.71075","MoKα","","0.127","0.0965","","","0.1846","0.198","","","","","","1.189","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216529","7.966","0.004","6.012","0.003","28.985","0.015","90","","91.739","0.007","90","","1387.5","1.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","RS-Naproxen-Piperidine","","","- C16 H18 N O3 -","- C16 H18 N O3 -","- C64 H72 N4 O12 -","4","1","","Manoj, K.; Tamura, Rui; Takahashi, Hiroki; Tsue, Hirohito","Crystal engineering of homochiral molecular organization of naproxen in cocrystals and their thermal phase transformation studies","CrystEngComm","2014","16","26","5811","","10.1039/c3ce42415d","","","0.71075","MoKα","","0.1671","0.0928","","","0.1627","0.1936","","","","","","1.101","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216530","15.206","0.006","5.766","0.002","19.37","0.008","90","","111.189","0.005","90","","1583.5","1.1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C38 H36 N2 O6 -","- C38 H36 N2 O6 -","- C76 H72 N4 O12 -","2","1","","Manoj, K.; Tamura, Rui; Takahashi, Hiroki; Tsue, Hirohito","Crystal engineering of homochiral molecular organization of naproxen in cocrystals and their thermal phase transformation studies","CrystEngComm","2014","16","26","5811","","10.1039/c3ce42415d","","","0.71075","MoKα","","0.1402","0.0753","","","0.1128","0.1353","","","","","","1.008","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216531","8.029","0.004","6.118","0.003","28.045","0.014","90","","93.99","0.007","90","","1374.3","1.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","S-Naproxen-Piperidine","","","- C32 H36 N2 O6 -","- C32 H36 N2 O6 -","- C64 H72 N4 O12 -","2","1","","Manoj, K.; Tamura, Rui; Takahashi, Hiroki; Tsue, Hirohito","Crystal engineering of homochiral molecular organization of naproxen in cocrystals and their thermal phase transformation studies","CrystEngComm","2014","16","26","5811","","10.1039/c3ce42415d","","","0.71075","MoKα","","0.1382","0.0799","","","0.136","0.167","","","","","","1.021","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216532","6.0536","0.0007","10.5285","0.0016","24.444","0.003","90","","90","","90","","1557.9","0.4","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 I N3 O6 -","- C13 H10 I N3 O6 -","- C52 H40 I4 N12 O24 -","4","1","","Jones, Charlotte L.; Wilson, Chick C.; Thomas, Lynne H.","Turning colour on and off using molecular disorder and proton transfer in multi-component molecular complexes","CrystEngComm","2014","16","26","5849","","10.1039/c4ce00229f","","","0.71075","MoKα","","0.0249","0.0211","","","0.0449","0.0505","","","","","","1.154","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216533","9.947","0.007","12.823","0.009","13.02","0.01","94.249","0.016","91.739","0.016","90.493","0.019","1655","2","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H24 I2 N6 O13 -","- C27 H17 I2 N6 O13 -","- C54 H34 I4 N12 O26 -","2","1","","Jones, Charlotte L.; Wilson, Chick C.; Thomas, Lynne H.","Turning colour on and off using molecular disorder and proton transfer in multi-component molecular complexes","CrystEngComm","2014","16","26","5849","","10.1039/c4ce00229f","","","0.71075","MoKα","","0.1317","0.0791","","","0.1856","0.2125","","","","","","1.075","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216534","7.3806","0.0015","9.3433","0.0018","11.754","0.002","80.602","0.005","71.795","0.005","79.46","0.005","752.1","0.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H10 I N3 O7 -","- C13 H10 I N3 O7 -","- C26 H20 I2 N6 O14 -","2","1","","Jones, Charlotte L.; Wilson, Chick C.; Thomas, Lynne H.","Turning colour on and off using molecular disorder and proton transfer in multi-component molecular complexes","CrystEngComm","2014","16","26","5849","","10.1039/c4ce00229f","","","0.71075","MoKα","","0.0211","0.0191","","","0.0462","0.0474","","","","","","1.087","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216535","9.0879","0.0011","9.9637","0.0012","10.5749","0.0012","94.099","0.004","103.81","0.004","92.568","0.004","925.6","0.19","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H26 I3 N7 O14 -","- C32 H26 I3 N7 O14 -","- C32 H26 I3 N7 O14 -","1","0.5","","Jones, Charlotte L.; Wilson, Chick C.; Thomas, Lynne H.","Turning colour on and off using molecular disorder and proton transfer in multi-component molecular complexes","CrystEngComm","2014","16","26","5849","","10.1039/c4ce00229f","","","0.71075","MoKα","","0.0657","0.0392","","","0.0788","0.111","","","","","","1.193","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216536","10.756","0.009","5.79","0.004","13.363","0.009","90","","107.859","0.008","90","","792.1","1","100","","100","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H12 I N3 O6 -","- C14 H12 I N3 O6 -","- C28 H24 I2 N6 O12 -","2","1","","Jones, Charlotte L.; Wilson, Chick C.; Thomas, Lynne H.","Turning colour on and off using molecular disorder and proton transfer in multi-component molecular complexes","CrystEngComm","2014","16","26","5849","","10.1039/c4ce00229f","","","0.71073","MoKα","","0.0133","0.0131","","","0.0332","0.0332","","","","","","1.088","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216537","8.534","0.002","8.769","0.002","11.882","0.008","111.035","0.008","101.327","0.007","95.273","0.007","800.9","0.6","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 I N3 O6 -","- C14 H12 I N3 O6 -","- C28 H24 I2 N6 O12 -","2","1","","Jones, Charlotte L.; Wilson, Chick C.; Thomas, Lynne H.","Turning colour on and off using molecular disorder and proton transfer in multi-component molecular complexes","CrystEngComm","2014","16","26","5849","","10.1039/c4ce00229f","","","0.71073","MoKα","","0.019","0.018","","","0.0471","0.0475","","","","","","1.132","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216538","14.0063","0.0003","16.8616","0.0004","7.8007","0.0005","90","","105.402","0.001","90","","1776.12","0.13","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","MMP","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine","","- C18 H17 N3 O3 S -","- C18 H17 N3 O3 S -","- C72 H68 N12 O12 S4 -","4","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.0585","0.0388","","","0.0913","0.1012","","","","","","1.012","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216539","10.4542","0.0007","10.7365","0.0007","19.2796","0.0012","92.407","0.001","96.173","0.002","105.247","0.001","2070.1","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine. hexanedioic acid","","- C42 H44 N6 O10 S2 -","- C42 H44 N6 O10 S2 -","- C84 H88 N12 O20 S4 -","2","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.0918","0.05","","","0.1131","0.1332","","","","","","0.98","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216540","5.411","0.002","11.572","0.005","18.486","0.008","87.456","0.008","89.447","0.007","84.076","0.008","1150.2","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine.(E)-butenedioate methanolate","","- C23 H25 N3 O8 S -","- C23 H25 N3 O8 S -","- C46 H50 N6 O16 S2 -","2","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.1245","0.1079","","","0.259","0.2707","","","","","","1.029","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216541","18.581","0.002","5.1754","0.0007","23.326","0.003","90","","106.774","0.002","90","","2147.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","007 oxalic acid hydrate salt","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine.ethanedioate tetrahydrate","","- C19 H26 N3 O9 S -","- C19 H26 N3 O9 S -","- C76 H104 N12 O36 S4 -","4","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.0653","0.0434","","","0.1078","0.1187","","","","","","1.055","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216542","13.4221","0.0006","16.746","0.0008","25.6251","0.0012","90","","99.444","0.001","90","","5681.6","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine. 2H-1lamda6,2-benzothiazol-1,1,3-trione salt hydrate","","- C25 H26.97 N4 O8.48 S2 -","- C25 H22 N4 O8.48 S2 -","- C200 H176 N32 O67.84 S16 -","8","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.0625","0.0514","","","0.1365","0.144","","","","","","1.062","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216543","13.232","0.0008","11.6031","0.0007","16.5449","0.001","90","","110.977","0.001","90","","2371.8","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine. 2-hydroxybenzoate salt hydrate","","- C25 H25 N3 O7 S -","- C25 H23 N3 O7 S -","- C100 H92 N12 O28 S4 -","4","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.062","0.0488","","","0.1333","0.1464","","","","","","1.036","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216544","5.4192","0.0007","12.1987","0.0015","19.705","0.003","75.627","0.002","88.814","0.002","89.651","0.002","1261.6","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-6(-Methoxypyridin-3-yl)-5-(4-methylsulfonylphenyl)- pyridine-2-amine. octanedioate salt","","- C26 H31 N3 O7 S -","- C26 H31 N3 O7 S -","- C52 H62 N6 O14 S2 -","2","1","","Cruickshank, Dyanne L.; Younis, Yassir; Njuguna, Nicholas M.; Ongarora, Dennis S. B.; Chibale, Kelly; Caira, Mino R.","Alternative solid-state forms of a potent antimalarial aminopyridine: X-ray crystallographic, thermal and solubility aspects","CrystEngComm","2014","16","26","5781","","10.1039/c3ce41798k","","","0.71073","MoKα","","0.0696","0.0409","","","0.0887","0.0962","","","","","","0.905","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216545","9.5289","0.0003","9.1191","0.0003","8.667","0.0002","90","","90","","90","","753.12","0.04","110","2","110","2","","","","","","","","4","P m n 21","P 2ac -2","31","melamine barbital addition compound","","","- C11 H18 N8 O3 -","- C11 H18 N8 O3 -","- C22 H36 N16 O6 -","2","0.5","","Gryl, M.; Seidler, T.; Stadnicka, K.; Matulková, I.; Němec, I.; Tesařová, N.; Němec, P.","The crystal structure and optical properties of a pharmaceutical co-crystal ‒ the case of the melamine‒barbital addition compound","CrystEngComm","2014","16","26","5765","","10.1039/c4ce00178h","","","0.71073","MoKα","","0.0887","0.0453","","","0.09","0.0986","","","","","","0.892","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216546","26.292","0.002","5.2948","0.0004","34.158","0.003","90","","90.598","0.004","90","","4754.9","0.7","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","alpha lipoicacid nicotinamide co-crystal","","","- C14 H20 N2 O3 S2 -","- C14 H20 N2 O3 S2 -","- C168 H240 N24 O36 S24 -","12","3","","Zhao, Lihua; Raval, Vishal; Briggs, Naomi E. B.; Bhardwaj, Rajni M.; McGlone, Thomas; Oswald, Iain D. H.; Florence, Alastair J.","From discovery to scale-up: α-lipoic acid : nicotinamide co-crystals in a continuous oscillatory baffled crystalliser","CrystEngComm","2014","16","26","5769","","10.1039/c4ce00154k","","","0.71073","MoKα","","0.1089","0.0733","","","0.1832","0.2147","","","","","","1.046","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216547","7.482","0.0001","22.751","0.0003","36.294","0.0005","90","","90","","90","","6178.07","0.14","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H31 Cl O3 -","- C22 H31 Cl O3 -","- C264 H372 Cl12 O36 -","12","3","","Ruiz, Alberto; Pérez, Hiram; Morera-Boado, Cercis; Almagro, Luis; da Silva, Cecilia C. P.; Ellena, Javier; García de la Vega, José M.; Martínez-Álvarez, Roberto; Suárez, Margarita; Martín, Nazario","Unusual hydrogen bond patterns contributing to supramolecular assembly: conformational study, Hirshfeld surface analysis and density functional calculations of a new steroid derivative","CrystEngComm","2014","16","33","7802","","10.1039/C4CE00709C","","","0.71073","MoKα","","0.0669","0.0484","","","","0.12","","","","","","1.027","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216548","7.1671","0.0016","14.704","0.003","11.157","0.003","90","","96.747","0.003","90","","1167.6","0.5","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","AsC5H12NO8U","","- C5 H11 As N O8 U -","- C5 H11 As N O8 U -","- C20 H44 As4 N4 O32 U4 -","4","1","","Smith, P. A.; Burns, P. C.","Ionothermal effects on low-dimensionality uranyl compounds using task specific ionic liquids","CrystEngComm","2014","16","31","7244","","10.1039/C4CE00512K","","","0.71073","MoKα","","0.0194","0.0166","","","0.037","0.0381","","","","","","1.08","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7216549","12.3917","0.0015","36.745","0.004","10.2457","0.0012","90","","112.19","0.0013","90","","4319.7","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","C38H40N2O15S4U","","- C38 H40 N2 O15 S4 U -","- C38 H40 N2 O15 S4 U -","- C152 H160 N8 O60 S16 U4 -","4","1","","Smith, P. A.; Burns, P. C.","Ionothermal effects on low-dimensionality uranyl compounds using task specific ionic liquids","CrystEngComm","2014","16","31","7244","","10.1039/C4CE00512K","","","0.71073","MoKα","","0.0496","0.0328","","","0.0677","0.0734","","","","","","1.023","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7216550","28.2107","0.0014","23.9375","0.0012","26.1899","0.0013","90","","90","","90","","17685.9","1.5","293","2","293","2","","","","","","","","7","P n n m","-P 2 2n","58","","","","- Cu17 H290 Mo46 N19 Na O317 V18 -","- Cu17 Mo46 Na O310 V18 -","- Cu34 Mo92 Na2 O620 V36 -","2","0.25","","Gao, Qiao; Li, Fengyan; Sun, Minghui; Xu, Lin; Wang, Yuchao; Bai, Jie","Multidimensional all-inorganic frameworks based on new molybdovanadate cluster of [VMo7O28]9−with Cu(ii) linker showing semiconducting behavior","CrystEngComm","2014","16","33","7681","","10.1039/C4CE00831F","","","0.71073","MoKα","","0.1028","0.0657","","","0.1454","0.1569","","","","","","1.061","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216551","14.7333","0.0003","17.2359","0.0006","18.2871","0.0004","96.789","0.002","98.188","0.002","93.537","0.002","4549.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- Cu8 H152 Mo30 N20 O169 V10 -","- Cu8 Mo30 N18 O160 V10 -","- Cu8 Mo30 N18 O160 V10 -","1","0.5","","Gao, Qiao; Li, Fengyan; Sun, Minghui; Xu, Lin; Wang, Yuchao; Bai, Jie","Multidimensional all-inorganic frameworks based on new molybdovanadate cluster of [VMo7O28]9−with Cu(ii) linker showing semiconducting behavior","CrystEngComm","2014","16","33","7681","","10.1039/C4CE00831F","","","0.71073","MoKα","","0.0636","0.0453","","","0.1245","0.135","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216552","53.884","0.005","13.9563","0.0011","26.848","0.002","90","","104.181","0.002","90","","19575","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- Cu11 H144 Mo30 N10 Na O181 V9 -","- Cu11 Mo30 N7 Na O177 V9 -","- Cu44 Mo120 N28 Na4 O708 V36 -","4","0.5","","Gao, Qiao; Li, Fengyan; Sun, Minghui; Xu, Lin; Wang, Yuchao; Bai, Jie","Multidimensional all-inorganic frameworks based on new molybdovanadate cluster of [VMo7O28]9−with Cu(ii) linker showing semiconducting behavior","CrystEngComm","2014","16","33","7681","","10.1039/C4CE00831F","","","0.71073","MoKα","","0.1068","0.0663","","","0.1907","0.215","","","","","","1.004","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216553","6.557","0.0003","6.9924","0.0004","19.2094","0.001","90","","90.285","0.004","90","","880.72","0.08","293.21","0.1","293.21","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- B6 Cd2 O12 Pb -","- B6 Cd2 O12 Pb -","- B24 Cd8 O48 Pb4 -","4","1","","Hao, Yu-Cheng; Xu, Xiang; Kong, Fang; Song, Jun-Ling; Mao, Jiang-Gao","PbCd2B6O12and EuZnB5O10: syntheses, crystal structures and characterizations of two new mixed metal borates","CrystEngComm","2014","16","33","7689","","10.1039/C4CE00777H","","","0.71073","MoKα","","0.0301","0.0258","","","0.0483","0.0504","","","","","","1.006","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216554","8.6173","0.0005","7.5994","0.0004","9.4036","0.0005","90","","93.358","0.005","90","","614.75","0.06","293","2","293","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- B5 Eu O10 Zn -","- B5 Eu O10 Zn -","- B20 Eu4 O40 Zn4 -","4","1","","Hao, Yu-Cheng; Xu, Xiang; Kong, Fang; Song, Jun-Ling; Mao, Jiang-Gao","PbCd2B6O12and EuZnB5O10: syntheses, crystal structures and characterizations of two new mixed metal borates","CrystEngComm","2014","16","33","7689","","10.1039/C4CE00777H","","","0.71073","MoKα","","0.0268","0.0221","","","0.0487","0.0511","","","","","","1.072","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216555","12.947","0.005","15.169","0.005","15.922","0.005","67.605","0.005","82.355","0.005","65.089","0.005","2620.7","1.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H132 Ag20 N2 O23 S10 -","- C63 H132 Ag20 N2 O23 S10 -","- C63 H132 Ag20 N2 O23 S10 -","1","0.5","","Zhou, Kun; Qin, Chao; Wang, Xin-Long; Shao, Kui-Zhan; Yan, Li-Kai; Su, Zhong-Min","Unexpected 1D self-assembly of carbonate-templated sandwich-like macrocycle-based Ag20S10luminescent nanoclusters","CrystEngComm","2014","16","34","7860","","10.1039/C4CE00867G","","","0.71069","MoKα","","0.1109","0.0614","","","0.1519","0.1765","","","","","","0.988","","","","has coordinates,has disorder","180496","2020-10-21","18:00:00",""
"7216556","9.9795","0.0008","10.1903","0.0008","11.6966","0.0009","91.086","0.005","101.528","0.005","118.691","0.004","1013.21","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- B2 K7 O19 P5 -","- B2 K6.995 O19 P5 -","- B4 K13.99 O38 P10 -","2","1","","Wang, Ying; Pan, Shilie; Han, Shujuan; Zhang, Bingbing; Dong, Lingyun; Zhang, Min; Yang, Zhihua","K7B2P5O19: a novel alkali metal borophosphate with zero dimensional [B2P5O19]7−anionic units","CrystEngComm","2014","16","30","6848","","10.1039/C4CE00917G","","","0.71073","MoKα","","0.0583","0.0401","","","0.0939","0.1016","","","","","","1.111","","","","has coordinates","180496","2020-10-21","18:00:00",""
"7216617","6.6943","0.0006","15.4475","0.0015","15.5647","0.0015","94.626","0.001","98.453","0.001","101.528","0.001","1549.9","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H58 N2 O3 -","- C31 H58 N2 O3 -","- C62 H116 N4 O6 -","2","1","","Fang, Yuan; Salamé, Nadime; Woo, Simon; Bohle, D. Scott; Friščić, Tomislav; Cuccia, Louis A.","Rapid and facile solvent-free mechanosynthesis in a cell lysis mill: preparation and mechanochemical complexation of aminobenzoquinones","CrystEngComm","2014","16","31","7180","","10.1039/C4CE00328D","","","0.71073","MoKα","","0.0917","0.0724","","","0.1856","0.202","","","","","","1.069","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216618","7.116","0.002","9.994","0.004","19.147","0.007","81.47","0.009","82.505","0.008","87.191","0.008","1334.5","0.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Ciprofloxacin diflunisal salt","","","- C30 H26 F3 N3 O6 -","- C30 H26 F3 N3 O6 -","- C60 H52 F6 N6 O12 -","2","1","","Bag, Partha Pratim; Ghosh, Soumyajit; Khan, Hamza; Devarapalli, Ramesh; Malla Reddy, C.","Drug‒drug salt forms of ciprofloxacin with diflunisal and indoprofen","CrystEngComm","2014","16","32","7393","","10.1039/C4CE00631C","","","0.71073","MoKα","","0.0822","0.0418","","","0.1122","0.1631","","","","","","0.853","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216619","10.325","0.004","12.615","0.005","12.916","0.005","71.51","0.007","74.334","0.007","70.672","0.007","1479.7","1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Ciprofloxacin indoprofen hydrate salt","","","- C34 H35 F N4 O7 -","- C34 H35 F N4 O7 -","- C68 H70 F2 N8 O14 -","2","1","","Bag, Partha Pratim; Ghosh, Soumyajit; Khan, Hamza; Devarapalli, Ramesh; Malla Reddy, C.","Drug‒drug salt forms of ciprofloxacin with diflunisal and indoprofen","CrystEngComm","2014","16","32","7393","","10.1039/C4CE00631C","","","0.71073","MoKα","","0.1216","0.0548","","","0.1182","0.1472","","","","","","1.012","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216620","7.943","0.003","12.822","0.005","13.509","0.005","90","","90.626","0.012","90","","1375.7","0.9","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Cu N4 O10 -","- C26 H22 Cu N4 O10 -","- C52 H44 Cu2 N8 O20 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.098","0.0456","","","0.1069","0.1362","","","","","","1.076","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216621","7.7617","0.0002","12.4624","0.0003","13.3308","0.0004","90","","101.243","0.001","90","","1264.73","0.06","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Co N4 O10 -","- C26 H26 Co N4 O10 -","- C52 H52 Co2 N8 O20 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0412","0.032","","","0.1034","0.117","","","","","","0.878","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216622","9.3173","0.0006","10.4833","0.0006","14.0375","0.0008","97.468","0.002","96.161","0.002","91.98","0.002","1350.01","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H26 N4 O10 Zn -","- C26 H18 N4 O10 Zn -","- C52 H36 N8 O20 Zn2 -","2","1","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0677","0.0522","","","0.1759","0.1944","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216623","8.7935","0.0009","12.2071","0.0013","12.6146","0.0013","96.023","0.004","103.536","0.004","96.686","0.004","1295.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H22 Cd N4 O9 -","- C26 H18 Cd N4 O9 -","- C52 H36 Cd2 N8 O18 -","2","1","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0365","0.0304","","","0.0893","0.1004","","","","","","1.187","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7216624","7.9016","0.0001","12.7481","0.0002","13.556","0.0002","90","","101.935","0.001","90","","1335.98","0.03","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Cd N4 O10 -","- C26 H26 Cd N4 O10 -","- C52 H52 Cd2 N8 O20 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0298","0.0218","","","0.0639","0.0777","","","","","","1.139","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216625","7.7788","0.0003","12.5459","0.0004","13.3501","0.0005","90","","101.483","0.001","90","","1276.79","0.08","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Fe N4 O10 -","- C26 H26 Fe N4 O10 -","- C52 H52 Fe2 N8 O20 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0405","0.0323","","","0.0934","0.1048","","","","","","1.082","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216626","8.8359","0.0006","19.4935","0.0013","8.0415","0.0005","90","","96.394","0.002","90","","1376.47","0.16","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 Cu N4 O12 -","- C26 H26 Cu N4 O12 -","- C52 H52 Cu2 N8 O24 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0614","0.041","","","0.1103","0.1325","","","","","","1.126","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216627","9.0273","0.0008","9.6688","0.0008","15.3406","0.0012","90","","99.176","0.003","90","","1321.84","0.19","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Cu N4 O10 -","- C26 H18 Cu N4 O10 -","- C52 H36 Cu2 N8 O20 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.1039","0.0586","","","0.1359","0.1714","","","","","","1.113","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216628","8.793","0.001","9.8082","0.0011","15.5768","0.0018","90","","100.664","0.003","90","","1320.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Co N4 O10 -","- C26 H26 Co N4 O10 -","- C52 H52 Co2 N8 O20 -","2","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0269","0.0252","","","0.071","0.072","","","","","","1.049","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216629","10.6479","0.0004","11.0165","0.0005","12.9533","0.0005","106.997","0.002","96.481","0.002","106.063","0.002","1364.97","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H26 N4 O9 Zn -","- C27 H26 N4 O9 Zn -","- C54 H52 N8 O18 Zn2 -","2","1","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0438","0.0359","","","0.101","0.1067","","","","","","1.041","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216630","20.3394","0.0016","10.1426","0.0007","14.968","0.0009","90","","104.5","0.005","90","","2989.5","0.4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H31 Cd N4 O11 -","- C28 H25 Cd N4 O11 -","- C112 H100 Cd4 N16 O44 -","4","0.5","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.03","0.0253","","","0.069","0.0715","","","","","","1.12","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216631","16.5778","0.0008","16.9789","0.0008","21.804","0.001","90","","94.606","0.002","90","","6117.4","0.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 Cd2 Cl2 N4 O11 -","- C26 H20 Cd2 Cl2 N4 O11 -","- C208 H160 Cd16 Cl16 N32 O88 -","8","1","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0528","0.0362","","","0.0988","0.1171","","","","","","1.023","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216632","9.4072","0.0003","12.735","0.0003","17.8919","0.0005","90","","90","","90","","2143.46","0.1","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C104 H80 N16 O24 -","8","1","","Paul, Mithun; Dastidar, Parthasarathi","Coordination polymers derived from pyridyl carboxylate ligands having an amide backbone: an attempt towards the selective separation of CuIIcation following in situ crystallization under competitive conditions","CrystEngComm","2014","16","33","7815","","10.1039/C4CE00733F","","","0.71073","MoKα","","0.0965","0.0526","","","0.1295","0.1543","","","","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216633","18.1964","0.0007","8.1426","0.0003","3.9569","0.0001","90","","124.043","0.002","90","","485.8","0.03","293","","293","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C6 H6 Ca Cl2 N2 O -","- C6 H6 Ca Cl2 N2 O -","- C12 H12 Ca2 Cl4 N4 O2 -","2","1","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Rubini, Katia; Turrina, Alessandro; Zorzi, Federico","Crystal form selectivity by humidity control: the case of the ionic co-crystals of nicotinamide and CaCl2","CrystEngComm","2014","16","32","7452","","10.1039/C4CE00464G","powder diffraction","","1.5406","CuKα","","","","","","","","","","1.222","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7216634","17.5215","0.0006","11.4158","0.0004","6.7943","0.0002","90","","90","","90","","1359.01","0.08","293","","293","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C6 H14 Ca Cl2 N2 O5 -","- C6 H6 Ca Cl2 N2 O5 -","- C24 H24 Ca4 Cl8 N8 O20 -","4","1","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Rubini, Katia; Turrina, Alessandro; Zorzi, Federico","Crystal form selectivity by humidity control: the case of the ionic co-crystals of nicotinamide and CaCl2","CrystEngComm","2014","16","32","7452","","10.1039/C4CE00464G","powder diffraction","","1.5406","CuKα","","","","","","","","","0.03117","1.46","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7216635","10.18","0.002","11.926","0.002","13.693","0.003","105.79","0.03","97.96","0.03","95.69","0.03","1567.9","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 N11 Nd O13 -","- C24 H24 N11 Nd O13 -","- C48 H48 N22 Nd2 O26 -","2","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0414","0.0376","","","0.1057","0.122","","","","","","1.19","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216636","28.898","0.006","7.76","0.0016","19.778","0.004","90","","104.39","0.03","90","","4296","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 Cl3 La N4 O7 -","- C12 H22 Cl3 La N4 O7 -","- C96 H176 Cl24 La8 N32 O56 -","8","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0627","0.0537","","","0.1187","0.123","","","","","","1.249","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216637","28.77","0.006","7.739","0.0015","19.629","0.004","90","","104.26","0.03","90","","4235.8","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 Cl3 N4 Nd O7 -","- C12 H22 Cl3 N4 Nd O7 -","- C96 H176 Cl24 N32 Nd8 O56 -","8","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0276","0.0262","","","0.0598","0.0607","","","","","","1.135","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216638","28.794","0.006","7.7507","0.0016","19.683","0.004","90","","104.34","0.03","90","","4255.9","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 Cl3 N4 O7 Pr -","- C12 H22 Cl3 N4 O7 Pr -","- C96 H176 Cl24 N32 O56 Pr8 -","8","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0497","0.0419","","","0.0831","0.087","","","","","","1.105","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216639","28.712","0.006","7.7286","0.0015","19.559","0.004","90","","104.11","0.03","90","","4209.3","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 Cl3 N4 O7 Sm -","- C12 H22 Cl3 N4 O7 Sm -","- C96 H176 Cl24 N32 O56 Sm8 -","8","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0827","0.0747","","","0.1904","0.2011","","","","","","1.18","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216640","28.616","0.006","7.7264","0.0015","19.526","0.004","90","","104.04","0.03","90","","4188.2","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 Cl3 Gd N4 O7 -","- C12 H22 Cl3 Gd N4 O7 -","- C96 H176 Cl24 Gd8 N32 O56 -","8","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0396","0.0357","","","0.1016","0.1163","","","","","","1.238","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216641","8.6514","0.0017","9.1529","0.0018","14.048","0.003","96.25","0.03","99.78","0.03","105.83","0.03","1040.4","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H22 Cl3 Er N4 O7 -","- C12 H22 Cl3 Er N4 O7 -","- C24 H44 Cl6 Er2 N8 O14 -","2","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.0254","0.0246","","","0.0679","0.0684","","","","","","1.201","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216642","29.485","0.006","7.878","0.0016","20.344","0.004","90","","103.39","0.03","90","","4597.1","1.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 Br3 N4 O7 Pr -","- C12 H22 Br3 N4 O7 Pr -","- C96 H176 Br24 N32 O56 Pr8 -","8","1","","Xue, Jun-Hui; Hua, Xiao-Hui; Yang, Li-Min; Li, Wei-Hong; Xu, Yi-Zhuang; Zhao, Guo-Zhong; Zhang, Gao-Hui; Liu, Ke-Xin; Chen, Jia-Er; Wu, Jin-Guang","The coordination of lanthanide ions with picolinamide. The influence of different anions","CrystEngComm","2014","16","33","7711","","10.1039/C4CE00606B","","","0.71073","MoKα","","0.082","0.0646","","","0.1693","0.1984","","","","","","1.221","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216645","14.3564","0.0012","13.8963","0.0012","18.4197","0.0015","90","","90","","90","","3674.7","0.5","296","2","296","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C6 H44 Mo6 N6 O29.5 P -","- C6 H13 Mo6 N6 O29.5 P -","- C24 H52 Mo24 N24 O118 P4 -","4","1","","Yang, Donghui; Liang, Yanfen; Ma, Pengtao; Li, Suzhi; Wang, Jingping; Niu, Jingyang","Self assembly of carboxylate/alcoholate functionalized ring-shape phosphomolybdates","CrystEngComm","2014","16","34","8041","","10.1039/C4CE00580E","","","0.71073","MoKα","","0.0325","0.0307","","","0.0825","0.0837","","","","","","1.037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216646","14.932","0.005","13.158","0.004","23.575","0.007","90","","90","","90","","4632","3","296","2","296","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C18 H44 Mo6 N8 Na O34 P -","- C18 H30 Mo6 N8 Na O34 P -","- C72 H120 Mo24 N32 Na4 O136 P4 -","4","0.5","","Yang, Donghui; Liang, Yanfen; Ma, Pengtao; Li, Suzhi; Wang, Jingping; Niu, Jingyang","Self assembly of carboxylate/alcoholate functionalized ring-shape phosphomolybdates","CrystEngComm","2014","16","34","8041","","10.1039/C4CE00580E","","","0.71073","MoKα","","0.0356","0.0323","","","0.0852","0.0874","","","","","","1.058","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216647","24.95","0.008","21.344","0.007","21.084","0.006","90","","120.51","0.006","90","","9673","5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H51 Mo6 N6 O36 P -","- C21 H18 Mo6 N6 O36 P -","- C168 H144 Mo48 N48 O288 P8 -","8","1","","Yang, Donghui; Liang, Yanfen; Ma, Pengtao; Li, Suzhi; Wang, Jingping; Niu, Jingyang","Self assembly of carboxylate/alcoholate functionalized ring-shape phosphomolybdates","CrystEngComm","2014","16","34","8041","","10.1039/C4CE00580E","","","0.71073","MoKα","","0.0698","0.0431","","","0.1046","0.121","","","","","","1.035","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216648","12.375","0.002","12.611","0.003","18.842","0.004","79.892","0.004","89.735","0.004","70.484","0.003","2723.9","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H49 Mo6 N5 O38 P -","- C21 H15 Mo6 N5 O38 P -","- C42 H30 Mo12 N10 O76 P2 -","2","1","","Yang, Donghui; Liang, Yanfen; Ma, Pengtao; Li, Suzhi; Wang, Jingping; Niu, Jingyang","Self assembly of carboxylate/alcoholate functionalized ring-shape phosphomolybdates","CrystEngComm","2014","16","34","8041","","10.1039/C4CE00580E","","","0.71073","MoKα","","0.0625","0.0504","","","0.1708","0.1794","","","","","","1.062","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216649","15.184","0.006","17.929","0.007","16.115","0.006","90","","117.472","0.006","90","","3892","3","296","2","296","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C12 H66 Mo12 N10 O60 P2 -","- C12 H12 Mo12 N10 O60 P2 -","- C24 H24 Mo24 N20 O120 P4 -","2","0.5","","Yang, Donghui; Liang, Yanfen; Ma, Pengtao; Li, Suzhi; Wang, Jingping; Niu, Jingyang","Self assembly of carboxylate/alcoholate functionalized ring-shape phosphomolybdates","CrystEngComm","2014","16","34","8041","","10.1039/C4CE00580E","","","0.71073","MoKα","","0.1559","0.1098","","","0.3193","0.3417","","","","","","1.043","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216650","18.1471","0.0018","26.828","0.003","19.2959","0.0019","90","","115.157","0.002","90","","8503.1","1.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H79 Mo12 N10 O60.5 P2 -","- C18 H24 Mo12 N10 O60.5 P2 -","- C72 H96 Mo48 N40 O242 P8 -","4","1","","Yang, Donghui; Liang, Yanfen; Ma, Pengtao; Li, Suzhi; Wang, Jingping; Niu, Jingyang","Self assembly of carboxylate/alcoholate functionalized ring-shape phosphomolybdates","CrystEngComm","2014","16","34","8041","","10.1039/C4CE00580E","","","0.71073","MoKα","","0.1712","0.0685","","","0.1587","0.188","","","","","","1.01","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216651","20.299","0.007","6.988","0.004","6.747","0.003","90","","99.2","0.04","90","","944.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","semicarbazide 5 metastable polymorph","N-(4-chlorobenzamide)urea","","- C8 H8 Cl N3 O2 -","- C8 H8 Cl N3 O2 -","- C32 H32 Cl4 N12 O8 -","4","1","","Centore, Roberto; Causà, Mauro; Cerciello, Francesca; Capone, Fabio; Fusco, Sandra","Orthogonal H-bonding synthons, actual and virtual structures in molecular crystals: a case study","CrystEngComm","2014","16","39","9168","","10.1039/C4CE00956H","","x-ray","0.71073","MoKα","","0.0837","0.0577","","","0.1254","0.1363","","","","","","1.121","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216652","4.524","0.003","23.583","0.007","9.537","0.004","90","","108.39","0.02","90","","965.5","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(4-nitrophenylbenzamido)urea","","- C8 H8 N4 O4 -","- C8 H8 N4 O4 -","- C32 H32 N16 O16 -","4","1","","Centore, Roberto; Causà, Mauro; Cerciello, Francesca; Capone, Fabio; Fusco, Sandra","Orthogonal H-bonding synthons, actual and virtual structures in molecular crystals: a case study","CrystEngComm","2014","16","39","9168","","10.1039/C4CE00956H","","x-ray","0.71073","MoKα","","0.084","0.049","","","0.1047","0.121","","","","","","1.023","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216653","4.508","0.003","24.111","0.007","9.612","0.004","90","","105.38","0.03","90","","1007.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(4-cyanobenzamide)urea","","- C9 H8 N4 O2 -","- C9 H8 N4 O2 -","- C36 H32 N16 O8 -","4","1","","Centore, Roberto; Causà, Mauro; Cerciello, Francesca; Capone, Fabio; Fusco, Sandra","Orthogonal H-bonding synthons, actual and virtual structures in molecular crystals: a case study","CrystEngComm","2014","16","39","9168","","10.1039/C4CE00956H","","x-ray","0.71073","MoKα","","0.1524","0.0822","","","0.2468","0.2852","","","","","","1.09","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216654","4.513","0.002","20.038","0.007","9.619","0.005","90","","106.34","0.02","90","","834.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(isonicotinoamido)urea","","- C7 H8 N4 O2 -","- C7 H8 N4 O2 -","- C28 H32 N16 O8 -","4","1","","Centore, Roberto; Causà, Mauro; Cerciello, Francesca; Capone, Fabio; Fusco, Sandra","Orthogonal H-bonding synthons, actual and virtual structures in molecular crystals: a case study","CrystEngComm","2014","16","39","9168","","10.1039/C4CE00956H","","x-ray","0.71073","MoKα","","0.0932","0.0484","","","0.0967","0.111","","","","","","1.066","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216655","7.785","0.004","13.578","0.006","8.459","0.004","90","","99.74","0.02","90","","881.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-fluorobenzamide)urea","","- C8 H8 F N3 O2 -","- C8 H8 F N3 O2 -","- C32 H32 F4 N12 O8 -","4","1","","Centore, Roberto; Causà, Mauro; Cerciello, Francesca; Capone, Fabio; Fusco, Sandra","Orthogonal H-bonding synthons, actual and virtual structures in molecular crystals: a case study","CrystEngComm","2014","16","39","9168","","10.1039/C4CE00956H","","x-ray","0.71073","MoKα","","0.082","0.0623","","","0.2158","0.2268","","","","","","1.215","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216656","6.786","0.004","4.604","0.003","30.169","0.008","90","","90.76","0.03","90","","942.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-chlorobenzamide)urea","","- C8 H8 Cl N3 O2 -","- C8 H8 Cl N3 O2 -","- C32 H32 Cl4 N12 O8 -","4","1","","Centore, Roberto; Causà, Mauro; Cerciello, Francesca; Capone, Fabio; Fusco, Sandra","Orthogonal H-bonding synthons, actual and virtual structures in molecular crystals: a case study","CrystEngComm","2014","16","39","9168","","10.1039/C4CE00956H","","x-ray","0.71073","MoKα","","0.0878","0.0448","","","0.0931","0.1114","","","","","","0.983","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216657","12.972","0.0011","5.0426","0.0004","17.0878","0.0015","90","","92.47","0.004","90","","1116.72","0.16","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","TW-1-107 [2-(4-pyridyl)-imidazole]2, 1,4-diiodotetrafluorobenzene","","- C22 H14 F4 I2 N6 -","- C22 H14 F4 I2 N6 -","- C44 H28 F8 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0329","0.0256","","","0.0589","0.0622","","","","","","1.058","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216658","12.3214","0.0007","8.9036","0.0005","9.8742","0.0006","90","","100.493","0.001","90","","1065.13","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 F4 I2 N6 -","- C18 H14 F4 I2 N6 -","- C36 H28 F8 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0224","0.0215","","","0.0564","0.057","","","","","","1.037","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216659","14.35","0.0009","8.7642","0.0005","9.9637","0.0006","90","","106.551","0.002","90","","1201.18","0.13","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","TW-2-07 [2-(3-pyridyl)-imidazole]2, I-(CF2)4-I","","- C20 H14 F8 I2 N6 -","- C20 H14 F8 I2 N6 -","- C40 H28 F16 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0321","0.0284","","","0.0626","0.0639","","","","","","1.11","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216660","10.0009","0.0013","28.964","0.004","4.1036","0.0006","90","","100.997","0.002","90","","1166.8","0.3","100","2","100","2","","","","","","","","5","C 1 m 1","C -2y","8","","","","- C22 H14 F4 I2 N6 -","- C22 H14 F4 I2 N6 -","- C44 H28 F8 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0221","0.0203","","","0.0462","0.047","","","","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216661","4.1462","0.0003","27.9646","0.0017","9.9124","0.0006","90","","100.094","0.002","90","","1131.52","0.13","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","TW-2-27 [2-(3-pyridyl)-imidazole]2, 1,4-diiodotetrafluorobenzene","","- C22 H14 F4 I2 N6 -","- C22 H14 F4 I2 N6 -","- C44 H28 F8 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0301","0.0254","","","0.0586","0.0607","","","","","","1.022","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216662","32.4147","0.0016","9.9354","0.0005","7.4776","0.0004","90","","90","","90","","2408.2","0.2","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","TW-1-57 [2-(3-pyridyl)-imidazole]2, 1,3,5-F3-2,4,6-I3-benzene","","- C22 H14 F3 I3 N6 -","- C22 H14 F3 I3 N6 -","- C88 H56 F12 I12 N24 -","4","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.042","0.0343","","","0.0781","0.0805","","","","","","1.157","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216663","4.2333","0.0003","32.768","0.002","9.9627","0.0008","90","","93.76","0.001","90","","1379.02","0.17","120","2","120","2","","","","","","","","5","P 1 c 1","P -2yc","7","","TW-1-67 [2-(3-pyridyl)-imidazole], 4,4'-diiodo-F8-biphenyl","","- C28 H14 F8 I2 N6 -","- C28 H14 F8 I2 N6 -","- C56 H28 F16 I4 N12 -","2","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0216","0.0205","","","0.0475","0.048","","","","","","1.027","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216664","4.0019","0.0011","28.546","0.008","9.972","0.003","90","","98.464","0.008","90","","1126.8","0.6","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","TW-1-47 [2-(3-pyridyl)-imidazole]2, 1-bromo-4-iodotetrafluorobenzene","","- C22 H14 Br F4 I N6 -","- C22 H14 Br F4 I N6 -","- C44 H28 Br2 F8 I2 N12 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.1276","0.1103","","","0.2375","0.2432","","","","","","1.348","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216665","5.1393","0.0006","11.0259","0.0012","15.2795","0.0017","92.084","0.003","91.221","0.003","100.093","0.003","851.52","0.17","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","TW-2-13 [2-(2-pyridyl)-imidazole]3, I-(CF2)6-I","","- C30 H21 F12 I2 N9 -","- C30 H21 F12 I2 N9 -","- C30 H21 F12 I2 N9 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","1.54178","CuKα","","0.0391","0.0368","","","0.1201","0.1302","","","","","","1.257","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216666","9.392","0.0005","10.5244","0.0006","17.4011","0.001","106.841","0.002","92.19","0.002","106.005","0.002","1569.34","0.15","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","TW-1-R38 2-(2-pyridyl)-imidazole, 1,4-diiodotetrafluorobenzene","","- C14 H7 F4 I2 N3 -","- C14 H7 F4 I2 N3 -","- C56 H28 F16 I8 N12 -","4","2","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0321","0.027","","","0.0654","0.0688","","","","","","1.056","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216667","24.4359","0.0012","7.2667","0.0004","16.3695","0.0008","90","","109.713","0.001","90","","2736.4","0.2","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","TW-1-68 [2-(2-pyridyl)-imidazole]2, 4,4'-diiodo-F8-biphenyl","","- C28 H14 F8 I2 N6 -","- C28 H14 F8 I2 N6 -","- C112 H56 F32 I8 N24 -","4","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0251","0.0231","","","0.0559","0.057","","","","","","1.029","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216668","6.1488","0.0007","6.3967","0.0007","15.8942","0.0019","81.861","0.004","85.95","0.004","72.388","0.003","589.59","0.12","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","TW-2-09 2-(2-pyrazinyl)-imidazole, I-(CF2)4-I","","- C18 H12 F8 I2 N8 -","- C18 H12 F8 I2 N8 -","- C18 H12 F8 I2 N8 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.049","0.0314","","","0.1023","0.1144","","","","","","1.14","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216669","11.0717","0.0006","10.625","0.0006","10.1858","0.0006","90","","108.814","0.002","90","","1134.2","0.11","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","TW-1-M1 2-(2-pyrazinyl)-imidazole, 1,4-diiodotetrafluorobenzene, I-(CF2)4-I","","- C20 H12 F4 I2 N8 -","- C20 H12 F4 I2 N8 -","- C40 H24 F8 I4 N16 -","2","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0249","0.0219","","","0.058","0.0595","","","","","","1.077","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216670","33.0655","0.0016","9.8284","0.0005","7.3176","0.0003","90","","90","","90","","2378.08","0.19","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","TW-1-59 [2-(2-pyrazinyl)-imidazole]2, 1,3,5-F3-2,4,6-I3-benzene","","- C20 H12 F3 I3 N8 -","- C20 H12 F2.5 I3 N8 -","- C80 H48 F10 I12 N32 -","4","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0269","0.0212","","","0.046","0.048","","","","","","1.046","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216671","7.6527","0.0004","12.7331","0.0007","15.4446","0.0009","67.32","0.001","88.558","0.002","81.616","0.001","1372.95","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","TW-1-69 [2-(2-pyrazinyl)-imidazole]2, 4,4'-diiodo-F8-biphenyl","","- C26 H12 F8 I2 N8 -","- C26 H12 F8 I2 N8 -","- C52 H24 F16 I4 N16 -","2","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Haj, Mohammad Abul; Desper, John; Moore, Curtis","The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions","CrystEngComm","2014","16","31","7218","","10.1039/C4CE00803K","","","0.71073","MoKα","","0.0234","0.021","","","0.0505","0.0516","","","","","","1.041","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216672","18.175","0.003","8.3359","0.0014","20.6","0.004","90","","91.868","0.003","90","","3119.3","1","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 K La N4 O10.5 S2 -","- C8 H5 K La N4 O10.5 S2 -","- C64 H40 K8 La8 N32 O84 S16 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0253","0.021","","","0.0499","0.0526","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216673","18.1735","0.0007","8.3436","0.0003","20.5557","0.0008","90","","91.699","0.001","90","","3115.5","0.2","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 Ce K N4 O10.5 S2 -","- C8 H5 Ce K N4 O10.5 S2 -","- C64 H40 Ce8 K8 N32 O84 S16 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.021","0.0187","","","0.0475","0.0494","","","","","","1.089","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216674","18.1389","0.0014","8.3629","0.0006","20.4829","0.0015","90","","91.505","0.001","90","","3106.1","0.4","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 K N4 O10.5 Pr S2 -","- C8 H5 K N4 O10.5 Pr S2 -","- C64 H40 K8 N32 O84 Pr8 S16 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0226","0.0196","","","0.043","0.0446","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216675","18.077","0.004","8.3675","0.0017","20.38","0.004","90","","91.14","0.03","90","","3082.1","1.1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 K N4 Nd O10.5 S2 -","- C8 H5 K N4 Nd O10.5 S2 -","- C64 H40 K8 N32 Nd8 O84 S16 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0309","0.0227","","","0.0437","0.0464","","","","","","1.042","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216676","18.031","0.0018","8.3836","0.0008","20.254","0.002","90","","90.938","0.001","90","","3061.3","0.5","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 K N4 O10.5 S2 Sm -","- C8 H5 K N4 O10.5 S2 Sm -","- C64 H40 K8 N32 O84 S16 Sm8 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0299","0.028","","","0.0645","0.0652","","","","","","1.258","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216677","18.017","0.007","8.423","0.004","20.231","0.008","90","","90.709","0.006","90","","3070","2","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 Eu K N4 O10.5 S2 -","- C8 H5 Eu K N4 O10.5 S2 -","- C64 H40 Eu8 K8 N32 O84 S16 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0212","0.0193","","","0.0452","0.0463","","","","","","1.064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216678","17.9598","0.0011","8.3889","0.0005","20.1191","0.0013","90","","90.639","0.001","90","","3031","0.3","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 Gd K N4 O10.5 S2 -","- C8 H5 Gd K N4 O10.5 S2 -","- C64 H40 Gd8 K8 N32 O84 S16 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0198","0.0181","","","0.042","0.0428","","","","","","1.038","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216679","17.9851","0.0018","8.41","0.0008","20.1083","0.0019","90","","90.563","0.002","90","","3041.3","0.5","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C8 H5 K N4 O10.5 S2 Tb -","- C8 H5 K N4 O10.5 S2 Tb -","- C64 H40 K8 N32 O84 S16 Tb8 -","8","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0199","0.019","","","0.0455","0.0461","","","","","","1.083","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216680","8.2691","0.0006","10.3254","0.0007","10.9614","0.0012","102.769","0.001","109.274","0.001","111.52","0.001","756.93","0.11","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H14 K2 La2 N4 O21 S2 -","- C16 H12 K2 La2 N4 O21 S2 -","- C16 H12 K2 La2 N4 O21 S2 -","1","0.5","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0261","0.0234","","","0.0622","0.0637","","","","","","1.092","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216681","8.2471","0.0012","10.2753","0.0014","10.915","0.002","102.534","0.003","109.195","0.003","112.16","0.002","745","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H14 Ce2 K2 N4 O21 S2 -","- C16 H12 Ce2 K2 N4 O21 S2 -","- C16 H12 Ce2 K2 N4 O21 S2 -","1","0.5","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0444","0.0384","","","0.0814","0.0852","","","","","","1.048","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216682","7.0404","0.0003","13.0015","0.0006","13.7338","0.0006","90","","100.881","0.001","90","","1234.53","0.09","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C12 H4 La2 N6 O14 S3 -","- C12 La2 N6 O14 S3 -","- C24 La4 N12 O28 S6 -","2","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0283","0.0279","","","0.0908","0.091","","","","","","1.102","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216683","6.975","0.005","12.901","0.008","13.551","0.009","90","","100.729","0.011","90","","1198.1","1.4","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C12 H4 Ce2 N6 O14 S3 -","- C12 Ce2 N6 O14 S3 -","- C24 Ce4 N12 O28 S6 -","2","1","","Zhao, Tingting; Zhang, Lirong; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Rational design and synthesis of a series of 3D lanthanide metal‒organic frameworks with different structures driven by reaction conditions","CrystEngComm","2014","16","44","10181","","10.1039/C4CE00858H","","","0.71073","MoKα","","0.0766","0.0718","","","0.1759","0.1796","","","","","","1.007","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216684","18.7481","0.0018","20.0714","0.0019","32.865","0.003","90","","98.535","0.001","90","","12230","2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C155 H111 Co10 N9 O43 -","- C155 H95 Co10 N9 O43 -","- C310 H190 Co20 N18 O86 -","2","0.5","","Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng","Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties","CrystEngComm","2014","16","33","7790","","10.1039/C4CE00890A","","","0.71073","MoKα","","0.1164","0.064","","","0.1975","0.2584","","","","","","1.093","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216685","22.476","0.005","7.706","0.0018","22.255","0.005","90","","102.056","0.011","90","","3769.6","1.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H28 Co3 N2 O14 -","- C40 H24 Co3 N2 O14 -","- C160 H96 Co12 N8 O56 -","4","0.5","","Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng","Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties","CrystEngComm","2014","16","33","7790","","10.1039/C4CE00890A","","","0.71073","MoKα","","0.0315","0.0288","","","0.0798","0.0817","","","","","","1.063","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216686","17.343","0.017","15.231","0.015","8.426","0.012","90","","117.09","0.02","90","","1982","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 N2 O5 Zn -","- C19 H11 N O4 Zn -","- C76 H44 N4 O16 Zn4 -","4","0.5","","Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng","Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties","CrystEngComm","2014","16","33","7790","","10.1039/C4CE00890A","","","0.71073","MoKα","","0.0404","0.0366","","","0.107","0.1088","","","","","","1.152","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216687","9.69","0.003","11.998","0.004","19.891","0.007","96.548","0.004","99.122","0.004","113.712","0.004","2049.7","1.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H36 Co2 N4 O12 -","- C38 H22 Co2 N2 O10 -","- C76 H44 Co4 N4 O20 -","2","1","","Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng","Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties","CrystEngComm","2014","16","33","7790","","10.1039/C4CE00890A","","","0.71073","MoKα","","0.0571","0.051","","","0.1576","0.166","","","","","","1.129","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216688","9.6769","0.0017","10.0627","0.0018","12.108","0.002","72.146","0.002","66.911","0.002","74.995","0.002","1019.3","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 Mn N2 O6 -","- C22 H18 Mn N2 O6 -","- C44 H36 Mn2 N4 O12 -","2","1","","Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng","Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties","CrystEngComm","2014","16","33","7790","","10.1039/C4CE00890A","","","0.71073","MoKα","","0.0796","0.06","","","0.1709","0.203","","","","","","1.122","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216689","10.469","0.01","10.611","0.011","11.429","0.011","89.177","0.014","65.827","0.013","66.661","0.013","1046.8","1.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H18 Co N2 O5 -","- C22 H18 Co N2 O5 -","- C44 H36 Co2 N4 O10 -","2","1","","Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng","Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties","CrystEngComm","2014","16","33","7790","","10.1039/C4CE00890A","","","0.71073","MoKα","","0.0727","0.064","","","0.1829","0.1916","","","","","","1.041","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216690","10.0616","0.0008","12.9846","0.0011","13.0016","0.0011","75.44","0.002","78.837","0.002","83.287","0.002","1608.8","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H34 Cu3 N16 O20 -","- C48 H34 Cu3 N16 O20 -","- C48 H34 Cu3 N16 O20 -","1","0.5","","Chen, Jin-Xiang; Zhao, Hai-Qing; Li, Huan-Huan; Huang, Sheng-Li; Ding, Ni-Ni; Chen, Wen-Hua; Young, David J.; Zhang, Wen-Hua; Andy Hor, T. S.","Bent tritopic carboxylates for coordination networks: clues to the origin of self-penetration","CrystEngComm","2014","16","33","7722","","10.1039/C4CE00830H","","","0.71073","MoKα","","0.0836","0.0771","","","0.2283","0.2358","","","","","","1.098","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216691","7.1089","0.0014","13.125","0.003","13.376","0.003","93.524","0.003","93.563","0.003","99.823","0.004","1224.1","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 Cu N3 O12 -","- C21 H27 Cu N3 O12 -","- C42 H54 Cu2 N6 O24 -","2","1","","Chen, Jin-Xiang; Zhao, Hai-Qing; Li, Huan-Huan; Huang, Sheng-Li; Ding, Ni-Ni; Chen, Wen-Hua; Young, David J.; Zhang, Wen-Hua; Andy Hor, T. S.","Bent tritopic carboxylates for coordination networks: clues to the origin of self-penetration","CrystEngComm","2014","16","33","7722","","10.1039/C4CE00830H","","","0.71073","MoKα","","0.0364","0.0335","","","0.0901","0.0923","","","","","","1.031","","","","has coordinates","180497","2020-10-21","18:00:00",""
"7216692","13.9922","0.0013","15.9422","0.0015","16.2434","0.0015","70.832","0.002","69.321","0.002","88.235","0.002","3187.1","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C105 H69 Cu3 N17 O32 -","- C105 H69 Cu3 N17 O32 -","- C105 H69 Cu3 N17 O32 -","1","0.5","","Chen, Jin-Xiang; Zhao, Hai-Qing; Li, Huan-Huan; Huang, Sheng-Li; Ding, Ni-Ni; Chen, Wen-Hua; Young, David J.; Zhang, Wen-Hua; Andy Hor, T. S.","Bent tritopic carboxylates for coordination networks: clues to the origin of self-penetration","CrystEngComm","2014","16","33","7722","","10.1039/C4CE00830H","","","0.71073","MoKα","","0.0896","0.0737","","","0.2108","0.2254","","","","","","1.069","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216693","30.925","0.003","13.245","0.0011","19.2577","0.0015","90","","106.047","0.002","90","","7580.6","1.1","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C66 H48 Cu3 N10 O21 -","- C66 H48 Cu3 N10 O21 -","- C264 H192 Cu12 N40 O84 -","4","0.5","","Chen, Jin-Xiang; Zhao, Hai-Qing; Li, Huan-Huan; Huang, Sheng-Li; Ding, Ni-Ni; Chen, Wen-Hua; Young, David J.; Zhang, Wen-Hua; Andy Hor, T. S.","Bent tritopic carboxylates for coordination networks: clues to the origin of self-penetration","CrystEngComm","2014","16","33","7722","","10.1039/C4CE00830H","","","0.71073","MoKα","","0.1","0.0787","","","0.2443","0.2613","","","","","","1.062","","","","has coordinates,has disorder","180497","2020-10-21","18:00:00",""
"7216702","22.267","0.003","22.267","0.003","23.162","0.003","90","","90","","90","","11484","3","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H48 Cu4 I4 N16 O10 -","- C40 H48 Cu4 I4 N16 O10 -","- C320 H384 Cu32 I32 N128 O80 -","8","0.5","","Hong, Xu-Jia; Liu, Xiang; Zhang, Jing-Bo; Lin, Chu-Ling; Wu, Xiao; Ou, Yan-Jun; Yang, Jian; Jin, Hong-Guang; Cai, Yue-Peng","Two low-dimensional Schiff base copper(i/ii) complexes: synthesis, characterization and catalytic activity for degradation of organic dyes","CrystEngComm","2014","16","34","7926","","10.1039/C4CE01207K","","","0.71073","MoKα","","0.1293","0.0591","","","0.1323","0.1712","","","","","","1.012","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216703","16.408","0.005","23.207","0.007","16.67","0.005","90","","98.473","0.005","90","","6278","3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H47 Cu6 I6 N17 O8 -","- C42 H47 Cu6 I6 N17 O8 -","- C168 H188 Cu24 I24 N68 O32 -","4","1","","Hong, Xu-Jia; Liu, Xiang; Zhang, Jing-Bo; Lin, Chu-Ling; Wu, Xiao; Ou, Yan-Jun; Yang, Jian; Jin, Hong-Guang; Cai, Yue-Peng","Two low-dimensional Schiff base copper(i/ii) complexes: synthesis, characterization and catalytic activity for degradation of organic dyes","CrystEngComm","2014","16","34","7926","","10.1039/C4CE01207K","","","0.71073","MoKα","","0.1358","0.0589","","","0.1398","0.1799","","","","","","1.002","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7216704","11.541","0.003","13.901","0.003","20.769","0.004","91.178","0.003","90.148","0.003","107.497","0.003","3177","1.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H106 Cu10 I10 N36 O17 -","- C88 H104 Cu10 I10 N36 O17 -","- C88 H104 Cu10 I10 N36 O17 -","1","0.5","","Hong, Xu-Jia; Liu, Xiang; Zhang, Jing-Bo; Lin, Chu-Ling; Wu, Xiao; Ou, Yan-Jun; Yang, Jian; Jin, Hong-Guang; Cai, Yue-Peng","Two low-dimensional Schiff base copper(i/ii) complexes: synthesis, characterization and catalytic activity for degradation of organic dyes","CrystEngComm","2014","16","34","7926","","10.1039/C4CE01207K","","","0.71073","MoKα","","0.108","0.0655","","","0.2214","0.2463","","","","","","0.989","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216705","14.999","0.003","4.603","0.0009","16.068","0.003","90","","108.53","0.03","90","","1051.8","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Urea : 4,4'bipyridine Form I","","","- C11 H12 N4 O -","- C11 H12 N4 O -","- C44 H48 N16 O4 -","4","0.5","","Tothadi, Srinu","Polymorphism in cocrystals of urea:4,4′-bipyridine and salicylic acid:4,4′-bipyridine","CrystEngComm","2014","16","32","7587","","10.1039/C4CE00866A","","","0.71073","MoKα","","0.0481","0.0408","","","0.1373","0.1566","","","","","","1.254","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216706","25.07","0.004","9.1849","0.0015","4.5943","0.0008","90","","90","","90","","1057.9","0.3","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Urea : 4,4'bipyridine Form II","","","- C11 H12 N4 O -","- C11 H12 N4 O -","- C44 H48 N16 O4 -","4","0.5","","Tothadi, Srinu","Polymorphism in cocrystals of urea:4,4′-bipyridine and salicylic acid:4,4′-bipyridine","CrystEngComm","2014","16","32","7587","","10.1039/C4CE00866A","","","0.71073","MoKα","","0.064","0.0513","","","0.131","0.1371","","","","","","1.141","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216707","7.86","0.008","8.308","0.008","8.547","0.008","87.812","0.014","82.149","0.003","65.9","0.014","504.6","0.9","150","2","150","2","","","","","","","","4","P -1","-P 1","2","salicylic acid:4,4'-bipyridine Form I","","","- C24 H20 N2 O6 -","- C24 H20 N2 O6 -","- C24 H20 N2 O6 -","1","0.5","","Tothadi, Srinu","Polymorphism in cocrystals of urea:4,4′-bipyridine and salicylic acid:4,4′-bipyridine","CrystEngComm","2014","16","32","7587","","10.1039/C4CE00866A","","","0.71073","MoKα","","0.0483","0.0442","","","0.1194","0.1228","","","","","","1.077","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216708","9.92","0.009","4.919","0.004","23.046","0.018","90","","114.28","0.03","90","","1025.1","1.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","salicylic acid:4,4'-bipyridine Form II","","","- C24 H20 N2 O6 -","- C24 H20 N2 O6 -","- C48 H40 N4 O12 -","2","0.5","","Tothadi, Srinu","Polymorphism in cocrystals of urea:4,4′-bipyridine and salicylic acid:4,4′-bipyridine","CrystEngComm","2014","16","32","7587","","10.1039/C4CE00866A","","","0.71073","MoKα","","0.0696","0.0582","","","0.1461","0.166","","","","","","1.06","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216709","7.1","0.005","23.968","0.005","10.935","0.005","90","","103.945","0.005","90","","1806","1.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","3","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0406","0.0328","","","0.0731","0.0753","","","","","","1.009","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216710","7.119","0.005","23.688","0.005","10.909","0.005","90","","103.36","0.005","90","","1789.9","1.5","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19.3333 N5 Ni O4 -","- C42 H116 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.032","0.0251","","","0.0575","0.0607","","","","","","1.017","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216711","7.146","0.005","23.684","0.005","10.944","0.005","90","","103.455","0.005","90","","1801.4","1.6","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19.3333 N5 Ni O4 -","- C42 H116 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0334","0.0252","","","0.0585","0.0624","","","","","","1.025","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216712","7.17","0.005","23.69","0.005","10.982","0.005","90","","103.569","0.005","90","","1813.3","1.6","200","2","200","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19.3333 N5 Ni O4 -","- C42 H116 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0345","0.0249","","","0.0569","0.0614","","","","","","1.039","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216713","7.202","0.005","23.718","0.005","11.025","0.005","90","","103.746","0.005","90","","1829.3","1.6","250","2","250","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19.3333 N5 Ni O4 -","- C42 H116 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0409","0.0278","","","0.0609","0.0666","","","","","","1.023","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216714","7.235","0.005","23.768","0.005","11.072","0.005","90","","103.92","0.005","90","","1848","1.6","298","2","298","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19.3333 N5 Ni O4 -","- C42 H116 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0478","0.0305","","","0.065","0.0724","","","","","","1.022","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216715","7.104","0.005","23.968","0.005","10.941","0.005","90","","103.958","0.005","90","","1807.9","1.6","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","3","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0403","0.0318","","","0.071","0.0732","","","","","","0.998","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216716","7.103","0.005","23.963","0.005","10.942","0.005","90","","103.964","0.005","90","","1807.4","1.6","115","2","115","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","3","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.042","0.0327","","","0.0719","0.0742","","","","","","0.987","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216717","7.101","0.005","23.928","0.005","10.936","0.005","90","","103.958","0.005","90","","1803.3","1.6","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","3","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0522","0.0404","","","0.0988","0.1034","","","","","","0.983","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216718","7.096","0.005","23.843","0.005","10.917","0.005","90","","103.788","0.005","90","","1793.8","1.6","125","2","125","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0481","0.0359","","","0.0871","0.0911","","","","","","1.023","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216719","7.102","0.005","23.707","0.005","10.91","0.005","90","","103.541","0.005","90","","1785.8","1.5","130","2","130","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0462","0.0352","","","0.0896","0.0931","","","","","","1.007","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216720","7.108","0.005","23.656","0.005","10.909","0.005","90","","103.439","0.005","90","","1784.1","1.5","135","2","135","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dinitro-(3,3-diamino-N-methyldipropylamine)nickel(II)","","- C7 H19 N5 Ni O4 -","- C7 H19 N5 Ni O4 -","- C42 H114 N30 Ni6 O24 -","6","1.5","","Hatcher, Lauren E.; Bigos, Edward J.; Bryant, Mathew J.; MacCready, Emily M.; Robinson, Thomas P.; Saunders, Lucy K.; Thomas, Lynne H.; Beavers, Christine M.; Teat, Simon J.; Christensen, Jeppe; Raithby, Paul R.","Thermal and photochemical control of nitro‒nitrito linkage isomerism in single-crystals of [Ni(medpt)(NO2)(η2-ONO)]","CrystEngComm","2014","16","35","8263","","10.1039/C4CE00675E","","","0.71073","MoKα","","0.0414","0.0304","","","0.0757","0.079","","","","","","1.02","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216721","11.3768","0.0009","21.2361","0.0015","12.4255","0.0009","90","","100.766","0.004","90","","2949.1","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H34.8 N4 O9.4 P3 -","- C23 H34 N4 O9.395 P3 -","- C92 H136 N16 O37.58 P12 -","4","1","","Singh, Udai P.; Narang, Shikha","A supramolecular approach towards the construction of molecular salts using phosphonic acid and pyrazole","CrystEngComm","2014","16","33","7777","","10.1039/C4CE00484A","","","0.71073","MoKα","","0.1468","0.0581","","","0.1338","0.1821","","","","","","0.916","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216722","11.4912","0.0009","9.4729","0.0007","22.7526","0.0018","90","","118.245","0.004","90","","2181.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H30 N4 O8 P2 -","- C13 H24 N4 O7 P2 -","- C52 H96 N16 O28 P8 -","4","1","","Singh, Udai P.; Narang, Shikha","A supramolecular approach towards the construction of molecular salts using phosphonic acid and pyrazole","CrystEngComm","2014","16","33","7777","","10.1039/C4CE00484A","","","0.71073","MoKα","","0.1032","0.0759","","","0.2319","0.2439","","","","","","1.056","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216723","15.269","0.003","8.82","0.002","21.635","0.005","90","","90","","90","","2913.6","1.1","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C25 H41 N8 O6 P -","- C25 H41 N8 O6 P -","- C100 H164 N32 O24 P4 -","4","1","","Singh, Udai P.; Narang, Shikha","A supramolecular approach towards the construction of molecular salts using phosphonic acid and pyrazole","CrystEngComm","2014","16","33","7777","","10.1039/C4CE00484A","","","0.71073","MoKα","","0.0858","0.0541","","","0.1342","0.1532","","","","","","0.933","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216724","26.1677","0.001","16.0917","0.0008","8.6296","0.0004","90","","90","","90","","3633.8","0.3","296","2","296","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C34 H46 N8 O6 P2 -","- C34 H46 N8 O6 P2 -","- C136 H184 N32 O24 P8 -","4","1","","Singh, Udai P.; Narang, Shikha","A supramolecular approach towards the construction of molecular salts using phosphonic acid and pyrazole","CrystEngComm","2014","16","33","7777","","10.1039/C4CE00484A","","","0.71073","MoKα","","0.1077","0.0494","","","0.1125","0.1441","","","","","","1","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216725","10.364","0.003","16.227","0.004","11.093","0.003","90","","102.843","0.012","90","","1818.9","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H23 N4 O5 P -","- C14 H23 N4 O5 P -","- C56 H92 N16 O20 P4 -","4","1","","Singh, Udai P.; Narang, Shikha","A supramolecular approach towards the construction of molecular salts using phosphonic acid and pyrazole","CrystEngComm","2014","16","33","7777","","10.1039/C4CE00484A","","","0.71073","MoKα","","0.1719","0.0368","","","0.1236","0.1534","","","","","","1.082","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216726","11.6984","0.0005","19.793","0.0008","25.4741","0.0011","90","","92.012","0.002","90","","5894.8","0.4","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H44 N4 O7 P2 -","- C20.9975 H44 N4 O7 P2 -","- C167.98 H352 N32 O56 P16 -","8","4","","Singh, Udai P.; Narang, Shikha","A supramolecular approach towards the construction of molecular salts using phosphonic acid and pyrazole","CrystEngComm","2014","16","33","7777","","10.1039/C4CE00484A","","","0.71073","MoKα","","0.0888","0.0485","","","0.1033","0.1211","","","","","","0.995","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216727","24.4212","0.0006","8.3161","0.0002","13.2973","0.0004","90","","92.341","0.002","90","","2698.28","0.12","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H10 N2 O4 S -","- C13 H10 N2 O4 S -","- C104 H80 N16 O32 S8 -","8","1","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; El-Mosslamy, El-Sayed H.; Mak, Thomas C. W.","Efficient solvent-controlled crystallization of pure polymorphs of 1-nitro-4-(4-nitrophenylmethylthio)benzene","CrystEngComm","2014","16","38","8960","","10.1039/C4CE00753K","","","0.71073","MoKα","","0.1009","0.0461","","","0.1219","0.1494","","","","","","1","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216728","6.1653","0.0007","17.4934","0.0018","12.4757","0.0013","90","","104.928","0.007","90","","1300.1","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N2 O4 S -","- C13 H10 N2 O4 S -","- C52 H40 N8 O16 S4 -","4","1","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; El-Mosslamy, El-Sayed H.; Mak, Thomas C. W.","Efficient solvent-controlled crystallization of pure polymorphs of 1-nitro-4-(4-nitrophenylmethylthio)benzene","CrystEngComm","2014","16","38","8960","","10.1039/C4CE00753K","","","0.71073","MoKα","","0.1101","0.0838","","","0.2643","0.2906","","","","","","1.185","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216729","4.0558","0.0003","20.4472","0.0016","16.1833","0.0012","90","","102.878","0.005","90","","1308.32","0.17","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N2 O4 S -","- C13 H10 N2 O4 S -","- C52 H40 N8 O16 S4 -","4","1","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; El-Mosslamy, El-Sayed H.; Mak, Thomas C. W.","Efficient solvent-controlled crystallization of pure polymorphs of 1-nitro-4-(4-nitrophenylmethylthio)benzene","CrystEngComm","2014","16","38","8960","","10.1039/C4CE00753K","","","0.71073","MoKα","","0.071","0.0489","","","0.1227","0.1365","","","","","","1.078","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216730","13.103","0.0007","13.866","0.0008","15.6862","0.001","81.809","0.004","71.861","0.003","79.628","0.003","2652.7","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H10 N2 O4 S -","- C13 H10 N2 O4 S -","- C104 H80 N16 O32 S8 -","8","4","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; El-Mosslamy, El-Sayed H.; Mak, Thomas C. W.","Efficient solvent-controlled crystallization of pure polymorphs of 1-nitro-4-(4-nitrophenylmethylthio)benzene","CrystEngComm","2014","16","38","8960","","10.1039/C4CE00753K","","","0.71073","MoKα","","0.234","0.0877","","","0.2065","0.2894","","","","","","0.987","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216731","3.9606","0.0003","12.1751","0.0008","31.027","0.002","90","","93.629","0.003","90","","1493.14","0.18","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N2 O5 S -","- C13 H10 N2 O5 S -","- C52 H40 N8 O20 S4 -","4","1","","Wan, Chong-Qing; Li, Ai-Min; Al-Thabaiti, Shaeel A.; El-Mosslamy, El-Sayed H.; Mak, Thomas C. W.","Efficient solvent-controlled crystallization of pure polymorphs of 1-nitro-4-(4-nitrophenylmethylthio)benzene","CrystEngComm","2014","16","38","8960","","10.1039/C4CE00753K","","","0.71073","MoKα","","0.0702","0.0576","","","0.1757","0.1888","","","","","","1.064","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216732","13.041","0.005","14.26","0.005","20.45","0.005","77.812","0.005","78.2","0.005","66.431","0.005","3376.4","1.9","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H64 N12 Na Nb14 O60 V -","- C10 H50 N12 Na Nb14 O60 V -","- C20 H100 N24 Na2 Nb28 O120 V2 -","2","1","","Huang, Peng; Zhou, En-Long; Wang, Xin-Long; Sun, Chun-Yi; Wang, Hai-Ning; Xing, Yan; Shao, Kui-Zhan; Su, Zhong-Min","New heteropolyniobates based on a bicapped Keggin-type {VNb14} cluster with selective adsorption and photocatalytic properties","CrystEngComm","2014","16","41","9582","","10.1039/C4CE00960F","","","0.71073","MoKα","","0.0657","0.0455","","","0.1298","0.1405","","","","","","1.054","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216733","32.849","0.005","32.849","0.005","13.718","0.005","90","","90","","90","","14803","6","293","2","293","2","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- H62 K7 N2 Na4 Nb14 O79 V -","- K7 N2 Na4 Nb14 O72 V -","- K56 N16 Na32 Nb112 O576 V8 -","8","1","","Huang, Peng; Zhou, En-Long; Wang, Xin-Long; Sun, Chun-Yi; Wang, Hai-Ning; Xing, Yan; Shao, Kui-Zhan; Su, Zhong-Min","New heteropolyniobates based on a bicapped Keggin-type {VNb14} cluster with selective adsorption and photocatalytic properties","CrystEngComm","2014","16","41","9582","","10.1039/C4CE00960F","","","0.71069","MoKα","","0.0733","0.059","","","0.1524","0.1665","","","","","","1.055","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216734","9.835","0.007","10.222","0.007","16.06","0.01","83.79","0.01","76.41","0.01","87.92","0.01","1560.1","1.8","293","2","293","2","","","","","","","","2","P -1","-P 1","2","","","","- C28 H22 -","- C28 H22 -","- C84 H66 -","3","1.5","","Bacchi, A.; Brillante, A.; Crocco, D.; Chierotti, M. R.; Della Valle, R. G.; Girlando, A.; Masino, M.; Pelagatti, P.; Venuti, E.","Exploration of the polymorph landscape for 1,1,4,4-tetraphenyl-1,3-butadiene","CrystEngComm","2014","16","35","8205","","10.1039/C4CE01046A","","","0.71073","MoKα","","0.0782","0.0582","","","0.1615","0.1822","","","","","","1.039","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216735","8.846","0.003","8.839","0.003","10.016","0.003","74.927","0.006","64.092","0.005","68.128","0.006","649.3","0.4","293","2","293","2","","","","","","","","2","P -1","-P 1","2","","","","- C34 H34 -","- C34 H34 -","- C34 H34 -","1","0.5","","Bacchi, A.; Brillante, A.; Crocco, D.; Chierotti, M. R.; Della Valle, R. G.; Girlando, A.; Masino, M.; Pelagatti, P.; Venuti, E.","Exploration of the polymorph landscape for 1,1,4,4-tetraphenyl-1,3-butadiene","CrystEngComm","2014","16","35","8205","","10.1039/C4CE01046A","","","0.71073","MoKα","","0.1203","0.0677","","","0.195","0.2321","","","","","","0.976","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216755","13.478","0.004","11.259","0.004","15.046","0.003","90","","93.77","0.03","90","","2278.3","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 Cl4 Cu2 N4 O2 -","- C18 H26 Cl4 Cu2 N4 O2 -","- C72 H104 Cl16 Cu8 N16 O8 -","4","0.5","","Shi, Wen-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Assembly of dinuclear copper(ii) secondary building units into polymeric complexes: crystal structures and magnetic properties","CrystEngComm","2014","16","34","8027","","10.1039/C4CE01082E","","","0.71073","MoKα","","0.0586","0.0544","","","0.1409","0.1464","","","","","","1.039","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216756","9.2753","0.0006","22.6255","0.0017","13.334","0.0008","90","","110.287","0.002","90","","2624.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H30 Cl Cu2 N7 O7 -","- C21 H30 Cl Cu2 N7 O7 -","- C84 H120 Cl4 Cu8 N28 O28 -","4","1","","Shi, Wen-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Assembly of dinuclear copper(ii) secondary building units into polymeric complexes: crystal structures and magnetic properties","CrystEngComm","2014","16","34","8027","","10.1039/C4CE01082E","","","0.71073","MoKα","","0.1638","0.0691","","","0.1434","0.2025","","","","","","1.024","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216757","4.4013","0.0009","8.2656","0.0017","12.976","0.003","82.02","0.03","87","0.03","79.24","0.03","459.1","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 Cu2 N4 O2 -","- C14 H22 Cl2 Cu2 N4 O2 -","- C14 H22 Cl2 Cu2 N4 O2 -","1","0.5","","Shi, Wen-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Assembly of dinuclear copper(ii) secondary building units into polymeric complexes: crystal structures and magnetic properties","CrystEngComm","2014","16","34","8027","","10.1039/C4CE01082E","","","0.71073","MoKα","","0.0447","0.0382","","","0.098","0.1037","","","","","","1.086","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216758","13.095","0.005","13.001","0.005","13.439","0.005","90","","106.17","0.01","90","","2197.5","1.4","143","2","143","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Cu2 N10 O2 -","- C18 H22 Cu2 N10 O2 -","- C72 H88 Cu8 N40 O8 -","4","1","","Shi, Wen-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Assembly of dinuclear copper(ii) secondary building units into polymeric complexes: crystal structures and magnetic properties","CrystEngComm","2014","16","34","8027","","10.1039/C4CE01082E","","","0.710747","MoKα","","0.0996","0.0668","","","0.1691","0.1844","","","","","","1.008","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216759","11.7941","0.0017","10.9501","0.0016","22.359","0.003","90","","90","","90","","2887.6","0.7","298","","298","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- Cr4 Gd4 Mo24 O139.92 -","- Cr4 Gd4 Mo24 O139.92 -","- Cr4 Gd4 Mo24 O139.92 -","1","0.25","","Kumar, Dinesh; Ahmad, Shahab; Prakash, G. Vijaya; Ramanujachary, Kandalam V.; Ramanan, Arunachalam","Photoluminescent chromium molybdate cluster coordinated with rare earth cations: synthesis, structure, optical and magnetic properties","CrystEngComm","2014","16","30","7097","","10.1039/C4CE00865K","","","0.71073","MoKα","","0.0286","0.0284","","","0.0647","0.0648","","","","","","1.19","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216760","23.459","0.007","13.337","0.004","24.725","0.008","90","","102.957","0.005","90","","7539","4","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 Cr Gd Mo6 N2 O36 -","- C12 H10 Cr Gd Mo6 N2 O36 -","- C96 H80 Cr8 Gd8 Mo48 N16 O288 -","8","1","","Kumar, Dinesh; Ahmad, Shahab; Prakash, G. Vijaya; Ramanujachary, Kandalam V.; Ramanan, Arunachalam","Photoluminescent chromium molybdate cluster coordinated with rare earth cations: synthesis, structure, optical and magnetic properties","CrystEngComm","2014","16","30","7097","","10.1039/C4CE00865K","","","0.71073","MoKα","","0.0678","0.0635","","","0.1183","0.1202","","","","","","1.322","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216761","18.389","0.002","12.5427","0.0014","17.963","0.002","90","","104.117","0.002","90","","4018","0.8","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 Cr Mo6 N2 O38 Tb -","- C12 H10 Cr Mo6 N2 O38 Tb -","- C48 H40 Cr4 Mo24 N8 O152 Tb4 -","4","0.5","","Kumar, Dinesh; Ahmad, Shahab; Prakash, G. Vijaya; Ramanujachary, Kandalam V.; Ramanan, Arunachalam","Photoluminescent chromium molybdate cluster coordinated with rare earth cations: synthesis, structure, optical and magnetic properties","CrystEngComm","2014","16","30","7097","","10.1039/C4CE00865K","","","0.71073","MoKα","","0.0329","0.0313","","","0.0878","0.0972","","","","","","1.297","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216762","18.4316","0.0014","12.5601","0.001","17.9491","0.0014","90","","104.3","0.001","90","","4026.5","0.5","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 Cr Mo6 N2 O38 Sm -","- C12 H10 Cr Mo6 N2 O38 Sm -","- C48 H40 Cr4 Mo24 N8 O152 Sm4 -","4","0.5","","Kumar, Dinesh; Ahmad, Shahab; Prakash, G. Vijaya; Ramanujachary, Kandalam V.; Ramanan, Arunachalam","Photoluminescent chromium molybdate cluster coordinated with rare earth cations: synthesis, structure, optical and magnetic properties","CrystEngComm","2014","16","30","7097","","10.1039/C4CE00865K","","","0.71073","MoKα","","0.0376","0.0323","","","0.0785","0.081","","","","","","1.04","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216769","9.961","0.005","17.323","0.004","10.814","0.005","90","","94.871","0.005","90","","1859.3","1.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","coordination Polymer","","","- C18 H16 N4 O6 S Zn -","- C18 H12 N4 O6 S Zn -","- C72 H48 N16 O24 S4 Zn4 -","4","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71073","MoKα","","0.074","0.0527","","","0.1315","0.1822","","","","","","1.118","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216770","10.1448","0.0012","11.9933","0.0014","13.9849","0.0016","90","","90","","90","","1701.5","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Coordination polymer","","","- C18 H12 Co N4 O4 S -","- C18 H12 Co N4 O4 S -","- C72 H48 Co4 N16 O16 S4 -","4","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71073","MoKα","","0.0439","0.0372","","","0.084","0.0908","","","","","","1.097","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216771","7.2476","0.0006","17.4087","0.0015","15.9969","0.0014","90","","90.364","0.002","90","","2018.3","0.3","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","coordination polymer","","","- C19 H14 Co N4 O7 S -","- C19 H12 Co N4 O7 S -","- C76 H48 Co4 N16 O28 S4 -","4","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71073","MoKα","","0.1036","0.068","","","0.1669","0.1904","","","","","","1.032","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216772","7.2709","0.0015","17.234","0.003","16.173","0.003","90","","90.215","0.004","90","","2026.6","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","coordination Polymer","","","- C19 H14 N4 O7 S Zn -","- C19 H12 N4 O7 S Zn -","- C76 H48 N16 O28 S4 Zn4 -","4","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71073","MoKα","","0.1077","0.0738","","","0.1935","0.2412","","","","","","1.084","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216773","28.205","0.006","12.181","0.002","15.442","0.003","90","","108.09","0.03","90","","5043.1","1.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Coordination polymer","","","- C24 H20 Co N4 O7 S -","- C24 H16 Co N4 O5 S -","- C192 H128 Co8 N32 O40 S8 -","8","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71073","MoKα","","0.0549","0.0431","","","0.1155","0.1334","","","","","","1.091","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216774","28.266","0.006","12.094","0.002","15.364","0.003","90","","107.51","0.03","90","","5008.8","1.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Coordination polymer","","","- C24 H20 N4 O7 S Zn -","- C24 H16 N4 O5 S Zn -","- C192 H128 N32 O40 S8 Zn8 -","8","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71073","MoKα","","0.0874","0.0529","","","0.1108","0.1207","","","","","","0.98","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216775","9.611","0.004","10.082","0.005","18.355","0.005","80.514","0.005","85.412","0.003","82.853","0.005","1737.4","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Coordination polymer","","","- C36 H26 Mn2 N8 O9 S2 -","- C36 H26 Mn2 N8 O9 S2 -","- C72 H52 Mn4 N16 O18 S4 -","2","1","","Singh, Namita; Anantharaman, Ganapathi","Structural diversity and luminescence properties of coordination polymers based on mixed ligands, 2,5-bis(imidazol-1-yl)thiophene (thim2) and aromatic multicarboxylates","CrystEngComm","2014","16","34","7914","","10.1039/C4CE00927D","","","0.71069","MoKα","","0.0751","0.0529","","","0.1219","0.1419","","","","","","1.072","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216776","37.8858","0.0015","13.3212","0.0006","15.7766","0.0006","90","","101.541","0.002","90","","7801.2","0.6","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H35 Cl3 N5 O5 S -","- C41 H35 Cl3 N5 O5 S -","- C328 H280 Cl24 N40 O40 S8 -","8","2","","Chadha, Renu; Bhandari, Swati; Haneef, Jamshed; Khullar, Sadhika; Mandal, Sanjay","Cocrystals of telmisartan: characterization, structure elucidation, in vivo and toxicity studies","CrystEngComm","2014","16","36","8375","","10.1039/C4CE00797B","","","0.71073","MoKα","","0.178","0.063","","","0.1372","0.1738","","","","","","0.846","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216777","8.7267","0.0018","21.838","0.006","8.408","0.003","90","","118.243","0.008","90","","1411.6","0.7","293.15","","293.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Isopropanol","","- C3 H8 O -","- C3 H8 O -","- C48 H128 O16 -","16","4","","Ridout, Joe; Probert, Michael R.","Low-temperature and high-pressure polymorphs of isopropyl alcohol","CrystEngComm","2014","16","32","7397","","10.1039/C4CE01012D","","x-ray","0.56087","AgKα","K-L~3~","0.1056","0.0585","","","0.1183","0.1429","","","","","","1.109","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216778","6.542","0.003","13.415","0.014","14.469","0.011","90","","99.79","0.02","90","","1251.3","1.7","180","","180","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Isopropanol","","- C3 H8 O -","- C3 H8 O -","- C36 H96 O12 -","12","3","","Ridout, Joe; Probert, Michael R.","Low-temperature and high-pressure polymorphs of isopropyl alcohol","CrystEngComm","2014","16","32","7397","","10.1039/C4CE01012D","","x-ray","0.71073","MoKα","K-L~3~","0.0718","0.0468","","","0.109","0.1231","","","","","","1.002","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216785","26.4001","0.0012","8.6506","0.0004","16.5796","0.0008","90","","115.898","0.001","90","","3406.1","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 N2 Ni O7 -","- C14 H18 N2 Ni O7 -","- C112 H144 N16 Ni8 O56 -","8","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0308","0.0255","","","0.0663","0.0694","","","","","","1.036","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216786","17.3192","0.0014","14.3739","0.0012","23.819","0.002","90","","90","","90","","5929.6","0.9","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H26 N4 Ni2 O9 -","- C28 H26 N4 Ni2 O9 -","- C224 H208 N32 Ni16 O72 -","8","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.068","0.0344","","","0.0677","0.0799","","","","","","1.025","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216787","13.7216","0.0012","7.2942","0.0006","16.2528","0.0014","90","","92.989","0.001","90","","1624.5","0.2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 Cl2 N2 Ni O4 -","- C14 H14 Cl2 N2 Ni O4 -","- C56 H56 Cl8 N8 Ni4 O16 -","4","0.5","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0376","0.0351","","","0.0974","0.0996","","","","","","1.061","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216788","11.761","0.004","16.623","0.005","13.751","0.003","90","","123.915","0.019","90","","2231","1.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 Cd2 N2 O14 S -","- C14 H24 Cd2 N2 O14 S -","- C56 H96 Cd8 N8 O56 S4 -","4","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0903","0.0781","","","0.2097","0.2295","","","","","","1.037","","","","has coordinates,has disorder","180498","2020-10-21","18:00:00",""
"7216789","7.5497","0.0009","8.1071","0.001","12.7747","0.0016","108.251","0.002","92.214","0.002","100.358","0.002","726.67","0.15","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Cd N2 O5 -","- C14 H14 Cd N2 O5 -","- C28 H28 Cd2 N4 O10 -","2","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0277","0.0235","","","0.0541","0.0563","","","","","","1.047","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216790","26.521","0.002","8.8621","0.0007","16.7474","0.0013","90","","117.78","0.001","90","","3482.5","0.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Cu N2 O7 -","- C14 H18 Cu N2 O7 -","- C112 H144 Cu8 N16 O56 -","8","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0443","0.0346","","","0.0894","0.0955","","","","","","1.042","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216791","26.42","0.002","8.6861","0.0007","16.7178","0.0013","90","","115.668","0.001","90","","3457.9","0.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Co N2 O7 -","- C14 H18 Co N2 O7 -","- C112 H144 Co8 N16 O56 -","8","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0289","0.0247","","","0.0657","0.0687","","","","","","1.061","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216792","10.0704","0.0005","10.189","0.0005","7.1745","0.0004","90","","101.797","0.001","90","","720.61","0.06","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Mn N2 O6 -","- C14 H16 Mn N2 O6 -","- C28 H32 Mn2 N4 O12 -","2","0.5","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.024","0.023","","","0.0632","0.0639","","","","","","1.099","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216793","12.912","0.002","9.1366","0.0016","14.7843","0.0017","90","","122.411","0.009","90","","1472.4","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 N2 O4 Pb -","- C14 H12 N2 O4 Pb -","- C56 H48 N8 O16 Pb4 -","4","1","","Li, Cheng-Peng; Chen, Jing; Liu, Peng-Wen; Du, Miao","Structural diversity of 5-methylnicotinate coordination assemblies regulated by metal-ligating tendency and metal-dependent anion effect","CrystEngComm","2014","16","28","6433","","10.1039/c4ce00187g","","","0.71073","MoKα","","0.0378","0.03","","","0.0743","0.0794","","","","","","1.017","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216794","28.732","0.0001","13.5996","0.0001","17.575","0.0001","90","","90","","90","","6867.32","0.07","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C33 H24 Cl Mn0.5 N4 -","- C33 H24 Cl Mn0.5 N4 -","- C264 H192 Cl8 Mn4 N32 -","8","1","","Hua, Carol; D'Alessandro, Deanna M.","A Mn(ii) coordination framework incorporating the redox-active tris(4-(pyridin-4-yl)phenyl)amine ligand (NPy3): electrochemical and spectral properties","CrystEngComm","2014","16","28","6331","","10.1039/c3ce42603c","","","1.54178","CuKα","","0.0371","0.0342","","","0.0896","0.0941","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7216795","15.9628","0.0009","15.9628","0.0009","14.4867","0.0016","90","","90","","120","","3196.8","0.4","296","2","296","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C4 H12 N8 Ni O8 V2 -","- C4 H12 N8 Ni O8 V2 -","- C36 H108 N72 Ni9 O72 V18 -","9","0.5","","Wang, Xiu-Li; Gong, Chun-Hua; Zhang, Ju-Wen; Hou, Li-Li; Luan, Jian; Liu, Guo-Cheng","Substituent position-induced diverse architectures of polyoxovanadate-based hybrid materials constructed from a linear trinuclear transition metal complex and a hexanuclear [V6O18]6−cluster","CrystEngComm","2014","16","33","7745","","10.1039/C4CE00988F","","","0.71073","MoKα","","0.0687","0.0523","","","0.1532","0.1633","","","","","","1.074","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216796","9.7732","0.0006","10.5394","0.0006","11.4624","0.0007","105.693","0.001","91.6","0.001","114.386","0.001","1022.05","0.11","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H32 N24 Ni3 O22 V6 -","- C12 H32 N24 Ni3 O22 V6 -","- C12 H32 N24 Ni3 O22 V6 -","1","0.5","","Wang, Xiu-Li; Gong, Chun-Hua; Zhang, Ju-Wen; Hou, Li-Li; Luan, Jian; Liu, Guo-Cheng","Substituent position-induced diverse architectures of polyoxovanadate-based hybrid materials constructed from a linear trinuclear transition metal complex and a hexanuclear [V6O18]6−cluster","CrystEngComm","2014","16","33","7745","","10.1039/C4CE00988F","","","0.71073","MoKα","","0.0348","0.0293","","","0.0797","0.0822","","","","","","1.02","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216797","9.8432","0.0007","10.5655","0.0007","11.5289","0.0008","105.811","0.001","91.594","0.001","114.252","0.001","1038.38","0.12","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H32 Co3 N24 O22 V6 -","- C12 H32 Co3 N24 O22 V6 -","- C12 H32 Co3 N24 O22 V6 -","1","0.5","","Wang, Xiu-Li; Gong, Chun-Hua; Zhang, Ju-Wen; Hou, Li-Li; Luan, Jian; Liu, Guo-Cheng","Substituent position-induced diverse architectures of polyoxovanadate-based hybrid materials constructed from a linear trinuclear transition metal complex and a hexanuclear [V6O18]6−cluster","CrystEngComm","2014","16","33","7745","","10.1039/C4CE00988F","","","0.71073","MoKα","","0.0507","0.0402","","","0.1094","0.1143","","","","","","1.04","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216798","9.844","0.0005","10.5676","0.0005","11.543","0.0006","105.887","0.001","91.797","0.001","114.183","0.001","1039.38","0.09","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H32 N24 O22 V6 Zn3 -","- C12 H32 N24 O22 V6 Zn3 -","- C12 H32 N24 O22 V6 Zn3 -","1","0.5","","Wang, Xiu-Li; Gong, Chun-Hua; Zhang, Ju-Wen; Hou, Li-Li; Luan, Jian; Liu, Guo-Cheng","Substituent position-induced diverse architectures of polyoxovanadate-based hybrid materials constructed from a linear trinuclear transition metal complex and a hexanuclear [V6O18]6−cluster","CrystEngComm","2014","16","33","7745","","10.1039/C4CE00988F","","","0.71073","MoKα","","0.0285","0.0273","","","0.1072","0.1092","","","","","","1.001","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216799","24.8443","0.0007","12.8836","0.0004","15.0538","0.0005","90","","96.709","0.003","90","","4785.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H47 Ce2 N3 O21 -","- C33 H23 Ce2 N O17 -","- C132 H92 Ce8 N4 O68 -","4","0.5","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0456","0.0343","","","0.0962","0.1011","","","","","","1.047","","","","has coordinates","180498","2020-10-21","18:00:00",""
"7216800","24.7168","0.0007","13.0121","0.0004","14.9778","0.0005","90","","96.682","0.003","90","","4784.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H47 N3 O21 Pr2 -","- C33 H23 N O17 Pr2 -","- C132 H92 N4 O68 Pr8 -","4","0.5","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0484","0.0344","","","0.0958","0.1019","","","","","","1.061","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216801","24.5711","0.0007","13.2963","0.0004","14.7313","0.0005","90","","96.735","0.003","90","","4779.6","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H47 Eu2 N3 O21 -","- C33 H23 Eu2 N O17 -","- C132 H92 Eu8 N4 O68 -","4","0.5","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.068","0.0488","","","0.132","0.1476","","","","","","1.074","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216802","20.2686","0.0003","18.9736","0.0002","27.9855","0.0004","90","","107.632","0.001","90","","10256.7","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H48.5 La2 N2.5 O20 -","- C40 H38.5 La2 N2.5 O20.5 -","- C320 H308 La16 N20 O164 -","8","1","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.1005","0.0819","","","0.2049","0.2214","","","","","","1.013","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216803","19.8953","0.0003","18.6848","0.0002","27.9037","0.0004","90","","107.266","0.001","90","","9905.5","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H48.5 N2.5 O20 Sm2 -","- C40 H38.5 N2.5 O20.5 Sm2 -","- C320 H308 N20 O164 Sm16 -","8","1","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0527","0.0359","","","0.0825","0.0933","","","","","","1.077","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216804","19.8267","0.0003","18.6253","0.0002","27.8685","0.0004","90","","107.1","0.001","90","","9836.3","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H48.5 Eu2 N2.5 O20 -","- C40 H38.5 Eu2 N2.5 O20.5 -","- C320 H308 Eu16 N20 O164 -","8","1","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0859","0.0636","","","0.1451","0.1611","","","","","","1.041","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216805","19.7427","0.0003","18.433","0.0002","27.8981","0.0004","90","","107.333","0.001","90","","9691.6","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H48.5 N2.5 O20 Tb2 -","- C40 H38.5 N2.5 O21.5 Tb2 -","- C320 H308 N20 O172 Tb16 -","8","1","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0754","0.0609","","","0.1556","0.1681","","","","","","1.033","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216806","24.8112","0.0008","13.7461","0.0004","13.6627","0.0004","90","","99.153","0.003","90","","4600.4","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H21 O9 S2 Sm -","- C18.542 H17.626 O8 S1.771 Sm -","- C148.336 H141.008 O64 S14.168 Sm8 -","8","1","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0471","0.0399","","","0.1111","0.1162","","","","","","1.086","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216807","24.8718","0.0008","13.7591","0.0004","13.6832","0.0004","90","","98.949","0.003","90","","4625.6","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H21 Nd O9 S2 -","- C18.56 H17.68 Nd O8 S1.78 -","- C148.48 H141.44 Nd8 O64 S14.24 -","8","1","","Li, Xiang-Ying; Lin, Zu-Jin; Yang, Yan-Yan; Cao, Rong","Synthesis, structures and luminescent properties of lanthanide coordination polymers involving biphenyl-3,4′,5-tricarboxylate","CrystEngComm","2014","16","28","6425","","10.1039/c4ce00158c","","","0.71073","MoKα","","0.0446","0.0379","","","0.1085","0.1136","","","","","","1.093","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216808","36.0605","0.0019","5.2677","0.0002","19.4061","0.001","90","","113.793","0.007","90","","3373","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 Co2 N10 O12 -","- C32 H32 Co2 N10 O12 -","- C128 H128 Co8 N40 O48 -","4","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0358","0.0309","","","0.0743","0.0772","","","","","","1.06","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216809","36.364","0.002","5.3141","0.0003","19.5932","0.0011","90","","113.105","0.009","90","","3482.5","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 Mn2 N10 O12 -","- C32 H32 Mn2 N10 O12 -","- C128 H128 Mn8 N40 O48 -","4","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0556","0.0382","","","0.0819","0.0896","","","","","","1.023","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216810","8.9623","0.0013","10.1747","0.0011","12.1422","0.001","100.966","0.009","110.157","0.011","103.494","0.011","965.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H38 Mn2 N12 O10 -","- C36 H38 Mn2 N12 O10 -","- C36 H38 Mn2 N12 O10 -","1","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0504","0.0372","","","0.0781","0.0857","","","","","","1.062","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216811","9.2436","0.0005","11.0384","0.0005","22.7044","0.0009","91.226","0.004","91.585","0.004","113.366","0.005","2124.51","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H40 N10 Ni2 O16 -","- C32 H34 N10 Ni2 O16 -","- C64 H68 N20 Ni4 O32 -","2","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0876","0.062","","","0.1687","0.1915","","","","","","1.037","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216812","11.5342","0.0008","20.5261","0.0012","19.3153","0.0013","90","","126.053","0.005","90","","3697.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 Cu2 N10 O13 -","- C32 H30 Cu2 N10 O13 -","- C128 H120 Cu8 N40 O52 -","4","1","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.1123","0.0589","","","0.1016","0.1244","","","","","","1.03","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216813","13.5928","0.0009","8.7066","0.0005","18.2172","0.001","90","","94.9","0.006","90","","2148.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H46 Cu2 N12 O14 -","- C36 H46 Cu2 N12 O14 -","- C72 H92 Cu4 N24 O28 -","2","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0958","0.0553","","","0.1","0.117","","","","","","1.024","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216814","9.7409","0.0014","10.3056","0.0016","11.2358","0.0018","116.914","0.016","96.328","0.013","109.365","0.014","902.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H36 N10 O14 Zn2 -","- C32 H36 N10 O14 Zn2 -","- C32 H36 N10 O14 Zn2 -","1","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0875","0.0526","","","0.0769","0.0917","","","","","","1.048","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216815","18.574","0.001","11.8625","0.0006","16.8934","0.0008","90","","112.071","0.006","90","","3449.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H30 N10 O11 Zn2 -","- C32 H28 N10 O11 Zn2 -","- C128 H112 N40 O44 Zn8 -","4","0.5","","Yang, Yan; Yang, Jin; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang","A series of metal‒organic frameworks based on a semi-rigid bifunctional ligand 5-[(1H-1,2,4-triazol-1-yl)methoxy] isophthalic acid and flexible N-donor bridging ligands","CrystEngComm","2014","16","28","6380","","10.1039/c3ce42625d","","","0.71073","MoKα","","0.0789","0.0472","","","0.0909","0.1058","","","","","","1.018","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216816","26.713","0.003","10.186","0.0006","26.764","0.003","90","","114.765","0.012","90","","6612.7","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C71 H50 N9 O15 Zn4 -","- C71 H50 N9 O15 Zn4 -","- C284 H200 N36 O60 Zn16 -","4","1","","Du, Peng; Yang, Yan; Kang, Da-Wei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Four cluster-containing highly connected coordination networks: syntheses, structures, and properties","CrystEngComm","2014","16","28","6372","","10.1039/c4ce00098f","","","0.71069","MoKα","","0.1439","0.0693","","","0.1325","0.1653","","","","","","0.993","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216817","10.491","0.0005","14.442","0.0008","15.738","0.0009","97.903","0.004","107.597","0.005","95.036","0.004","2230.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H72 N6 O34 Zn8 -","- C96 H72 N6 O34 Zn8 -","- C96 H72 N6 O34 Zn8 -","1","0.5","","Du, Peng; Yang, Yan; Kang, Da-Wei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Four cluster-containing highly connected coordination networks: syntheses, structures, and properties","CrystEngComm","2014","16","28","6372","","10.1039/c4ce00098f","","","0.71069","MoKα","","0.0467","0.036","","","0.0809","0.0889","","","","","","1.038","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216818","10.412","0.0003","14.861","0.0006","15.616","0.0006","103.206","0.003","92.815","0.003","97.125","0.003","2326.73","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C98 H74 Cd8 N2 O37 -","- C98 H72 Cd8 N2 O37 -","- C98 H72 Cd8 N2 O37 -","1","0.5","","Du, Peng; Yang, Yan; Kang, Da-Wei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Four cluster-containing highly connected coordination networks: syntheses, structures, and properties","CrystEngComm","2014","16","28","6372","","10.1039/c4ce00098f","","","0.71069","MoKα","","0.0385","0.028","","","0.0596","0.0642","","","","","","1.027","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216819","11.014","0.005","13.17","0.005","14.773","0.0008","88.002","0.004","83.199","0.004","86.478","0.003","2123","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H70 Cd5 N24 O22 -","- C84 H58 Cd5 N24 O22 -","- C84 H58 Cd5 N24 O22 -","1","0.5","","Du, Peng; Yang, Yan; Kang, Da-Wei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang","Four cluster-containing highly connected coordination networks: syntheses, structures, and properties","CrystEngComm","2014","16","28","6372","","10.1039/c4ce00098f","","","0.71069","MoKα","","0.042","0.0324","","","0.0743","0.0801","","","","","","1.033","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216820","10.9347","0.0006","12.6382","0.0007","12.7232","0.0007","61.42","0.001","66.901","0.001","68.104","0.001","1382.4","0.13","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H32 F N4 O6 -","- C30 H32 F N4 O6 -","- C60 H64 F2 N8 O12 -","2","1","","Zhang, Tingting; Yang, Yan; Zhao, Xiaojun; Jia, Jiangtao; Su, Hongmin; He, Hongming; Gu, Jingkai; Zhu, Guangshan","Dissolution and pharmacokinetic properties of two paliperidone cocrystals with 4-hydroxybenzoic and 4-aminobenzoic acid","CrystEngComm","2014","16","33","7667","","10.1039/C4CE00784K","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","209037","2020-10-21","18:00:00",""
"7216821","10.9374","0.0007","12.6162","0.0008","12.7201","0.0008","61.396","0.001","66.853","0.001","68.137","0.001","1379.57","0.15","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H33 F N5 O5 -","- C30 H33 F N5 O5 -","- C60 H66 F2 N10 O10 -","2","1","","Zhang, Tingting; Yang, Yan; Zhao, Xiaojun; Jia, Jiangtao; Su, Hongmin; He, Hongming; Gu, Jingkai; Zhu, Guangshan","Dissolution and pharmacokinetic properties of two paliperidone cocrystals with 4-hydroxybenzoic and 4-aminobenzoic acid","CrystEngComm","2014","16","33","7667","","10.1039/C4CE00784K","","","0.71073","MoKα","","0.0673","0.0549","","","0.1494","0.1577","","","","","","1.068","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216822","18.006","0.001","15.3229","0.0009","20.969","0.001","90","","90","","90","","5785.4","0.5","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C25.5 H26 I N9 O3.5 Zn -","- C25.5 H12 I N9 O3.5 Zn -","- C204 H96 I8 N72 O28 Zn8 -","8","2","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.71073","MoKα","","0.1367","0.0931","","","0.2607","0.2969","","","","","","1.036","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216823","26.47","0.02","15.79","0.01","13.591","0.009","90","","105.64","0.02","90","","5470","7","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H28 Cl0.5 I0.5 N9 O8 Zn -","- C22 H14 Cl0.5 I0.5 N9 O8 Zn -","- C176 H112 Cl4 I4 N72 O64 Zn8 -","8","1","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.71073","MoKα","","0.0913","0.0598","","","0.1471","0.1635","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216824","15.4187","0.0002","12.4644","0.0002","21.6037","0.0003","90","","90.208","0.001","90","","4151.88","0.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H38 I N9 O5 Zn -","- C42 H27 I N9 O5 Zn -","- C168 H108 I4 N36 O20 Zn4 -","4","1","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.68898","synchrotron","","0.1326","0.1162","","","0.3266","0.3389","","","","","","0.933","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216825","21.5","0.011","21.5","0.011","22.454","0.012","90","","90","","90","","10379","9","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C54.5 H52 I N9 O7.5 Zn -","- C54.5 H37 I N9 O7.5 Zn -","- C436 H296 I8 N72 O60 Zn8 -","8","2","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.71073","MoKα","","0.1357","0.089","","","0.2329","0.2519","","","","","","0.983","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216826","44.006","0.001","44.006","0.001","28.267","0.001","90","","90","","120","","47406","2","85","2","85","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C40 H46 I N11 O10 Zn -","- C40 H22 I N11 O10 Zn -","- C1440 H792 I36 N396 O360 Zn36 -","36","1","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.689","synchrotron","","0.161","0.124","","","0.3556","0.3849","","","","","","1.365","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216827","15.1138","0.0001","18.5709","0.0001","15.6792","0.0001","90","","117.212","0.002","90","","3913.71","0.08","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H37 I N12 O Zn -","- C41 H34.5 I N12 O Zn -","- C164 H138 I4 N48 O4 Zn4 -","4","1","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.68899","synchrotron","","0.0752","0.0657","","","0.1794","0.1873","","","","","","1.054","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216828","23.1344","0.0002","14.7104","0.0001","26.8906","0.0003","90","","110.411","0.0003","90","","8576.72","0.14","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C65 H83 I6 N23 O11 Zn4 -","- C65 H72 I6 N23 O11 Zn4 -","- C260 H288 I24 N92 O44 Zn16 -","4","1","","Kojima, Tatsuhiro; Yamada, Tomofumi; Yakiyama, Yumi; Ishikawa, Eri; Morita, Yasushi; Ebihara, Masahiro; Kawano, Masaki","The diversity of Zn(ii) coordination networks composed of multi-interactive ligand TPHAP−via weak intermolecular interaction","CrystEngComm","2014","16","28","6335","","10.1039/c3ce42382d","","","0.75002","synchrotron","","0.0831","0.0663","","","0.176","0.1878","","","","","","1.051","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216829","7.0884","0.0003","7.715","0.0002","11.634","0.0005","80.755","0.003","78.037","0.004","83.455","0.003","612.18","0.04","296.15","","296.15","","","","","","","","","4","P -1","-P 1","2","","bis-1,2,3-Triamino-2,4,6-triazinium ethylenetriaminetetraacetate diaqua","","- C16 H32 N14 O10 -","- C16 H32 N14 O10 -","- C16 H32 N14 O10 -","1","0.5","","Vella-Zarb, Liana; Braga, Dario; Guy Orpen, A.; Baisch, Ulrich","The influence of hydrogen bonding on the planar arrangement of melamine in crystal structures of its solvates, cocrystals and salts","CrystEngComm","2014","16","35","8147","","10.1039/C4CE00748D","","","0.71073","MoKα","","0.0655","0.0339","","","0.0832","0.0892","","","","","","0.897","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216830","7.4296","0.0006","12.3333","0.0011","11.9384","0.0011","90","","114.07","0.006","90","","998.81","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Melamine DMSO solvate","","- C5 H12 N6 O S -","- C5 H12 N6 O S -","- C20 H48 N24 O4 S4 -","4","1","","Vella-Zarb, Liana; Braga, Dario; Guy Orpen, A.; Baisch, Ulrich","The influence of hydrogen bonding on the planar arrangement of melamine in crystal structures of its solvates, cocrystals and salts","CrystEngComm","2014","16","35","8147","","10.1039/C4CE00748D","","","0.71073","MoKα","","0.0662","0.0386","","","0.0774","0.0868","","","","","","1.063","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216831","18.041","0.002","10.6373","0.0014","14.289","0.002","90","","103.652","0.014","90","","2664.7","0.6","296.15","","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dimelaminium sulfate","","- C6 H14 N12 O4 S -","- C6 H14 N12 O4 S -","- C48 H112 N96 O32 S8 -","8","1","","Vella-Zarb, Liana; Braga, Dario; Guy Orpen, A.; Baisch, Ulrich","The influence of hydrogen bonding on the planar arrangement of melamine in crystal structures of its solvates, cocrystals and salts","CrystEngComm","2014","16","35","8147","","10.1039/C4CE00748D","","","0.71073","MoKα","","0.2244","0.0493","","","0.0745","0.0972","","","","","","0.771","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216832","7.771","0.0014","9.8924","0.0018","12.186","0.002","90","","101.198","0.009","90","","919","0.3","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","melaminium dinitrate","","- C3 H8 N8 O6 -","- C3 H8 N8 O6 -","- C12 H32 N32 O24 -","4","1","","Vella-Zarb, Liana; Braga, Dario; Guy Orpen, A.; Baisch, Ulrich","The influence of hydrogen bonding on the planar arrangement of melamine in crystal structures of its solvates, cocrystals and salts","CrystEngComm","2014","16","35","8147","","10.1039/C4CE00748D","","","1.54178","CuKα","","0.3022","0.0335","","","0.0905","0.1046","","","","","","1.049","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216833","14.3308","0.0008","16.2228","0.001","13.1104","0.001","90","","109.388","0.007","90","","2875.1","0.3","150.15","","150.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","tri-theobromine melamine","","- C24 H30 N18 O6 -","- C24 H30 N18 O6 -","- C96 H120 N72 O24 -","4","0.5","","Vella-Zarb, Liana; Braga, Dario; Guy Orpen, A.; Baisch, Ulrich","The influence of hydrogen bonding on the planar arrangement of melamine in crystal structures of its solvates, cocrystals and salts","CrystEngComm","2014","16","35","8147","","10.1039/C4CE00748D","","","1.54184","CuKα","","0.0839","0.0685","","","0.205","0.2244","","","","","","1.033","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216834","38.315","0.003","12.5251","0.001","29.193","0.002","90","","109.401","0.002","90","","13214.2","1.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","ST318","","","- C60 H84.6 Cl2 Mn2 O12.3 S3.3 -","- C60 H81.6 Cl2 Mn2 O12.3 S3.3 -","- C480 H652.8 Cl16 Mn16 O98.4 S26.4 -","8","1","","Taylor, Stephanie M.; Frost, Jamie M.; McLellan, Ross; McIntosh, Ruaraidh D.; Brechin, Euan K.; Dalgarno, Scott J.","Assembly of a calix[4]arene-supported MnIIIMnIIcluster mediated by halogen interactions","CrystEngComm","2014","16","35","8098","","10.1039/C4CE00729H","","","0.71073","MoKα","","0.1447","0.093","","","0.2335","0.2546","","","","","","1.575","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216835","11.9272","0.0015","13.954","0.003","20.185","0.002","90","","90","","90","","3359.4","0.9","150","2","150","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C14.7 H17.3 Cu0.5 N3.4 O3.9 -","- C10.5 H6.5 Cu0.5 N2 O2.5 -","- C84 H52 Cu4 N16 O20 -","8","1","","Coghlan, Campbell J.; Sumby, Christopher J.; Doonan, Christian J.","Utilising hinged ligands in MOF synthesis: a covalent linking strategy for forming 3D MOFs","CrystEngComm","2014","16","28","6364","","10.1039/c4ce00181h","","","0.71073","MoKα","","0.2069","0.1268","","","0.3509","0.3829","","","","","","0.994","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216836","23.269","0.005","10.602","0.002","24.34","0.005","90","","111.28","0.03","90","","5595","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 N5 O5 Zn -","- C21 H13 N4 O4 Zn -","- C168 H104 N32 O32 Zn8 -","8","1","","Coghlan, Campbell J.; Sumby, Christopher J.; Doonan, Christian J.","Utilising hinged ligands in MOF synthesis: a covalent linking strategy for forming 3D MOFs","CrystEngComm","2014","16","28","6364","","10.1039/c4ce00181h","","","0.71073","synchrotron","","0.0767","0.0706","","","0.1961","0.2007","","","","","","1.088","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216837","23.324","0.003","10.2514","0.0006","25.426","0.002","90","","116.19","0.015","90","","5455.3","1.1","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26.25 H25.25 Cd N5.75 O5.75 -","- C21 H13 Cd N4 O4 -","- C168 H104 Cd8 N32 O32 -","8","1","","Coghlan, Campbell J.; Sumby, Christopher J.; Doonan, Christian J.","Utilising hinged ligands in MOF synthesis: a covalent linking strategy for forming 3D MOFs","CrystEngComm","2014","16","28","6364","","10.1039/c4ce00181h","","","0.71073","MoKα","","0.0933","0.0619","","","0.1366","0.1476","","","","","","1.035","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216838","10.0477","0.0003","15.2023","0.001","22.6589","0.0007","90","","90","","90","","3461.1","0.3","109","2","109","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C13.5 H16.5 Co0.5 N3 O4.5 -","- C10.5 H9.5 Co0.5 N2 O3.5 -","- C84 H76 Co4 N16 O28 -","8","1","","Coghlan, Campbell J.; Sumby, Christopher J.; Doonan, Christian J.","Utilising hinged ligands in MOF synthesis: a covalent linking strategy for forming 3D MOFs","CrystEngComm","2014","16","28","6364","","10.1039/c4ce00181h","","","0.71073","MoKα","","0.0755","0.0574","","","0.1698","0.1791","","","","","","1.087","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216839","8.245","0.001","29.405","0.004","10.8415","0.0015","90","","108.285","0.006","90","","2495.7","0.6","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 Cu2 I2 N6 O2 -","- C22 H17 Cu2 I2 N6 O2 -","- C88 H68 Cu8 I8 N24 O8 -","4","1","","Argyle, Victoria J.; Roxburgh, Marina; Hanton, Lyall R.","Use of the oxime‒oximato binding mode to stabilise mixed valence copper iodide polymer networks using dipyridyl ketone oxime ligands","CrystEngComm","2014","16","28","6345","","10.1039/c3ce42481b","","","0.71069","MoKα","","0.0449","0.0434","","","0.1446","0.1473","","","","","","1.206","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216840","8.4693","0.0006","14.305","0.001","15.7364","0.0014","90","","90","","90","","1906.5","0.3","90","2","90","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H16 Cu N6 O2 -","- C22 H16 Cu N6 O2 -","- C88 H64 Cu4 N24 O8 -","4","0.5","","Argyle, Victoria J.; Roxburgh, Marina; Hanton, Lyall R.","Use of the oxime‒oximato binding mode to stabilise mixed valence copper iodide polymer networks using dipyridyl ketone oxime ligands","CrystEngComm","2014","16","28","6345","","10.1039/c3ce42481b","","","0.71069","MoKα","","0.0396","0.0313","","","0.0745","0.0787","","","","","","1.102","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216841","11.639","0.0009","15.3802","0.0012","14.9492","0.0011","90","","99.34","0.0004","90","","2640.6","0.3","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 Cu2 I2 N7 O2 -","- C24 H20 Cu2 I2 N7 O2 -","- C96 H80 Cu8 I8 N28 O8 -","4","1","","Argyle, Victoria J.; Roxburgh, Marina; Hanton, Lyall R.","Use of the oxime‒oximato binding mode to stabilise mixed valence copper iodide polymer networks using dipyridyl ketone oxime ligands","CrystEngComm","2014","16","28","6345","","10.1039/c3ce42481b","","","0.71069","MoKα","","0.0163","0.0161","","","0.0383","0.0384","","","","","","1.15","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216842","8.6202","0.0006","9.025","0.0006","9.257","0.0007","69.48","0.004","69.496","0.004","84.874","0.004","631.29","0.08","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H9 Cu I N3 O -","- C11 H9 Cu I N3 O -","- C22 H18 Cu2 I2 N6 O2 -","2","1","","Argyle, Victoria J.; Roxburgh, Marina; Hanton, Lyall R.","Use of the oxime‒oximato binding mode to stabilise mixed valence copper iodide polymer networks using dipyridyl ketone oxime ligands","CrystEngComm","2014","16","28","6345","","10.1039/c3ce42481b","","","0.71069","MoKα","","0.0163","0.0154","","","0.0472","0.063","","","","","","1.397","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216843","12.6943","0.0003","32.7813","0.0007","24.8035","0.0005","90","","97.313","0.002","90","","10237.7","0.4","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C63 H66 Cu8 I8 N15 O7 -","- C63 H66 Cu8 I8 N15 O7 -","- C252 H264 Cu32 I32 N60 O28 -","4","0.5","","Argyle, Victoria J.; Roxburgh, Marina; Hanton, Lyall R.","Use of the oxime‒oximato binding mode to stabilise mixed valence copper iodide polymer networks using dipyridyl ketone oxime ligands","CrystEngComm","2014","16","28","6345","","10.1039/c3ce42481b","","","0.71069","MoKα","","0.0434","0.0364","","","0.0963","0.1006","","","","","","1.054","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216844","10.817","0.013","15.965","0.019","26.71","0.03","90","","112.31","0.04","90","","4267","9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 Cd2 N4 O10 -","- C48 H32 Cd2 N4 O10 -","- C192 H128 Cd8 N16 O40 -","4","1","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.0565","0.0319","","","0.0497","0.0553","","","","","","1.17","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216845","8.804","0.009","14.094","0.015","20.83","0.02","70.715","0.013","86.903","0.013","88.517","0.013","2436","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H42 Co2 N8 O13 -","- C52 H34 Co2 N8 O13 -","- C104 H68 Co4 N16 O26 -","2","1","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.0878","0.0575","","","0.1452","0.1674","","","","","","1.013","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7216846","13.226","0.008","19.61","0.013","23.292","0.015","90","","101.312","0.007","90","","5924","7","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C57 H49 Mn3 N5 O20 -","- C57 H45 Mn3 N5 O20 -","- C228 H180 Mn12 N20 O80 -","4","1","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.0431","0.0399","","","0.1038","0.1067","","","","","","1.026","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216847","13.6","0.012","16.319","0.014","16.769","0.014","79.265","0.012","80.064","0.012","72.401","0.012","3458","5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H44 Mn2 N8 O10 -","- C64 H44 Mn2 N8 O10 -","- C128 H88 Mn4 N16 O20 -","2","1","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.1164","0.0561","","","0.0931","0.1031","","","","","","0.991","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216848","8.5322","0.0017","22.025","0.008","15.088","0.003","90","","90","","90","","2835.4","1.3","293","2","293","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C64 H46 Co2 N8 O11 -","- C64 H44 Co2 N8 O11 -","- C128 H88 Co4 N16 O22 -","2","0.25","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.1238","0.1162","","","0.2665","0.2721","","","","","","1.237","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216849","12.268","0.003","14.467","0.003","17.269","0.004","89.58","0.03","75.03","0.03","77.58","0.03","2887.8","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C132 H90 Co5 N6 O32 -","- C132 H90 Co5 N6 O32 -","- C132 H90 Co5 N6 O32 -","1","0.5","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.1203","0.0857","","","0.1844","0.2051","","","","","","1.128","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216850","11.624","0.002","13.395","0.003","21.378","0.004","108.23","0.03","96.32","0.03","103.03","0.03","3020.9","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C126 H108 N10 Ni4 O29 -","- C126 H98 N10 Ni4 O29 -","- C126 H98 N10 Ni4 O29 -","1","0.5","","Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping","Ligand geometry-directed assembly of seven entangled coordination polymers","CrystEngComm","2014","16","28","6354","","10.1039/c3ce42545b","","","0.71073","MoKα","","0.116","0.0848","","","0.2499","0.2634","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216851","8.2996","0.0005","31.6381","0.0018","27.3595","0.0016","90","","95.45","0.001","90","","7151.7","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H12 Ag14 F30 N6 O20 -","- C48 H12 Ag14 F30 N6 O20 -","- C192 H48 Ag56 F120 N24 O80 -","4","1","","Hu, Ting; Yang, Jin; Mak, Thomas C. W.","Assembly of organometallic networks with multinuclear silver(i)‒ethynediide supramolecular synthon, trifluoroacetate and ligands derived from isomeric dicyanobenzenes","CrystEngComm","2014","16","28","6316","","10.1039/c3ce41671b","","","0.71073","MoKα","","0.0907","0.0804","","","0.1952","0.2043","","","","","","1.099","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216852","19.8943","0.0009","26.2204","0.0012","17.9454","0.0013","90","","119.636","0.001","90","","8136.4","0.8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H16 Ag15 F30 N9 O23 -","- C56 H16 Ag15 F30 N9 O23 -","- C224 H64 Ag60 F120 N36 O92 -","4","0.5","","Hu, Ting; Yang, Jin; Mak, Thomas C. W.","Assembly of organometallic networks with multinuclear silver(i)‒ethynediide supramolecular synthon, trifluoroacetate and ligands derived from isomeric dicyanobenzenes","CrystEngComm","2014","16","28","6316","","10.1039/c3ce41671b","","","0.71073","MoKα","","0.0623","0.054","","","0.1477","0.1573","","","","","","1.07","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216853","6.9041","0.0005","18.7425","0.0016","22.4191","0.0019","90","","97.687","0.001","90","","2875","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H12 Ag6 F6 O13 -","- C22 H12 Ag6 F6 O13 -","- C88 H48 Ag24 F24 O52 -","4","1","","Hu, Ting; Yang, Jin; Mak, Thomas C. W.","Assembly of organometallic networks with multinuclear silver(i)‒ethynediide supramolecular synthon, trifluoroacetate and ligands derived from isomeric dicyanobenzenes","CrystEngComm","2014","16","28","6316","","10.1039/c3ce41671b","","","0.71073","MoKα","","0.0589","0.0483","","","0.1261","0.136","","","","","","1.022","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216854","18.999","0.003","17.422","0.002","8.2616","0.0011","90","","96.619","0.002","90","","2716.4","0.6","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H9 Ag6 F6 N O10 -","- C22 H9 Ag6 F6 N O10 -","- C88 H36 Ag24 F24 N4 O40 -","4","1","","Hu, Ting; Yang, Jin; Mak, Thomas C. W.","Assembly of organometallic networks with multinuclear silver(i)‒ethynediide supramolecular synthon, trifluoroacetate and ligands derived from isomeric dicyanobenzenes","CrystEngComm","2014","16","28","6316","","10.1039/c3ce41671b","","","0.71073","MoKα","","0.1126","0.0981","","","0.2317","0.2472","","","","","","1.077","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216855","8.2222","0.0007","16.2247","0.0014","16.4614","0.0014","93.275","0.002","95.797","0.001","97.895","0.001","2158.4","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H16 Ag8 F12 N2 O16 -","- C26 H8 Ag8 F12 N2 O16 -","- C52 H16 Ag16 F24 N4 O32 -","2","1","","Hu, Ting; Yang, Jin; Mak, Thomas C. W.","Assembly of organometallic networks with multinuclear silver(i)‒ethynediide supramolecular synthon, trifluoroacetate and ligands derived from isomeric dicyanobenzenes","CrystEngComm","2014","16","28","6316","","10.1039/c3ce41671b","","","0.71073","MoKα","","0.1017","0.0901","","","0.2299","0.2435","","","","","","1.052","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216856","27.31","0.003","8.4645","0.0008","32.75","0.003","90","","109.776","0.002","90","","7124.2","1.2","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H20 Ag16 F18 N4 O24 -","- C56 H20 Ag16 F18 N4 O24 -","- C224 H80 Ag64 F72 N16 O96 -","4","1","","Hu, Ting; Yang, Jin; Mak, Thomas C. W.","Assembly of organometallic networks with multinuclear silver(i)‒ethynediide supramolecular synthon, trifluoroacetate and ligands derived from isomeric dicyanobenzenes","CrystEngComm","2014","16","28","6316","","10.1039/c3ce41671b","","","0.71073","MoKα","","0.1059","0.0854","","","0.2163","0.2364","","","","","","1.114","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216857","23.0358","0.0018","11.6305","0.0009","14.5521","0.0012","90","","114.492","0.001","90","","3548","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 N2 O6 Zn -","- C18 H14 N2 O6 Zn -","- C144 H112 N16 O48 Zn8 -","8","1","","Cui, Pei-Pei; Zhao, Yue; Lv, Gao-Chao; Liu, Qing; Zhao, Xiao-Liang; Lu, Yi; Sun, Wei-Yin","Synthesis, characterization and selective hysteretic sorption property of metal‒organic frameworks with 3,5-di(pyridine-4-yl)benzoate","CrystEngComm","2014","16","28","6300","","10.1039/c3ce42260g","","","0.71073","MoKα","","0.0458","0.0394","","","0.1135","0.1183","","","","","","1.034","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216858","15.0968","0.0014","23.363","0.002","16.7676","0.0016","90","","90","","90","","5914","0.9","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C34 H22 Cd N4 O4 -","- C34 H22 Cd N4 O4 -","- C272 H176 Cd8 N32 O32 -","8","1","","Cui, Pei-Pei; Zhao, Yue; Lv, Gao-Chao; Liu, Qing; Zhao, Xiao-Liang; Lu, Yi; Sun, Wei-Yin","Synthesis, characterization and selective hysteretic sorption property of metal‒organic frameworks with 3,5-di(pyridine-4-yl)benzoate","CrystEngComm","2014","16","28","6300","","10.1039/c3ce42260g","","","0.71073","MoKα","","0.0613","0.0456","","","0.1353","0.1505","","","","","","1.053","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216859","18.601","0.003","13.5351","0.0019","14.0326","0.0019","90","","94.773","0.002","90","","3520.7","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H15 Co N2 O5 -","- C21 H15 Co N2 O5 -","- C168 H120 Co8 N16 O40 -","8","1","","Cui, Pei-Pei; Zhao, Yue; Lv, Gao-Chao; Liu, Qing; Zhao, Xiao-Liang; Lu, Yi; Sun, Wei-Yin","Synthesis, characterization and selective hysteretic sorption property of metal‒organic frameworks with 3,5-di(pyridine-4-yl)benzoate","CrystEngComm","2014","16","28","6300","","10.1039/c3ce42260g","","","0.71073","MoKα","","0.1368","0.0512","","","0.1016","0.1307","","","","","","0.94","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216862","14.8357","0.0007","14.8357","0.0007","6.7854","0.0006","90","","90","","90","","1493.45","0.17","291","2","291","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C32 H16 Ca4 F16 O24 -","- C32 H16 Ca4 F16 O24 -","- C32 H16 Ca4 F16 O24 -","1","0.125","","Chen, Sheng-Chun; Tian, Feng; Huang, Kun-Lin; Li, Cheng-Peng; Zhong, Jing; He, Ming-Yang; Zhang, Zhi-Hui; Wang, Hong-Ning; Du, Miao; Chen, Qun","Solvent-mediated assembly of chiral/achiral hydrophilic Ca(ii)-tetrafluoroterephthalate coordination frameworks: 3D chiral water aggregation, structural transformation and selective CO2adsorption","CrystEngComm","2014","16","33","7673","","10.1039/C4CE01019A","","","0.71073","MoKα","","0.056","0.0525","","","0.1281","0.1287","","","","","","1.042","","","","has coordinates,has disorder","180499","2020-10-21","18:00:00",""
"7216863","10.95","0.02","17.7","0.03","7.843","0.015","90","","102.33","0.04","90","","1485","5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 Ca F4 O6 -","- C10 H8 Ca F4 O6 -","- C40 H32 Ca4 F16 O24 -","4","0.5","","Chen, Sheng-Chun; Tian, Feng; Huang, Kun-Lin; Li, Cheng-Peng; Zhong, Jing; He, Ming-Yang; Zhang, Zhi-Hui; Wang, Hong-Ning; Du, Miao; Chen, Qun","Solvent-mediated assembly of chiral/achiral hydrophilic Ca(ii)-tetrafluoroterephthalate coordination frameworks: 3D chiral water aggregation, structural transformation and selective CO2adsorption","CrystEngComm","2014","16","33","7673","","10.1039/C4CE01019A","","","0.71073","MoKα","","0.0796","0.0639","","","0.1978","0.2168","","","","","","1.035","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7216864","3.7395","0.0012","22.568","0.007","6.767","0.002","90","","93.286","0.006","90","","570.1","0.3","296","2","296","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C8 H8 Ca F4 O8 -","- C8 H8 Ca F4 O8 -","- C16 H16 Ca2 F8 O16 -","2","0.5","","Chen, Sheng-Chun; Tian, Feng; Huang, Kun-Lin; Li, Cheng-Peng; Zhong, Jing; He, Ming-Yang; Zhang, Zhi-Hui; Wang, Hong-Ning; Du, Miao; Chen, Qun","Solvent-mediated assembly of chiral/achiral hydrophilic Ca(ii)-tetrafluoroterephthalate coordination frameworks: 3D chiral water aggregation, structural transformation and selective CO2adsorption","CrystEngComm","2014","16","33","7673","","10.1039/C4CE01019A","","","0.71073","MoKα","","0.0302","0.0298","","","0.0791","0.0794","","","","","","1.067","","","","has coordinates","180499","2020-10-21","18:00:00",""
"7217008","5.288","0.0001","31.171","0.002","11.312","0.001","90","","90.158","0.002","90","","1864.6","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C9 H11.5 Br0.5 N O2 -","- C9 H11.5 Br0.5 N O2 -","- C72 H92 Br4 N8 O16 -","8","4","","Surekha, R.; Gunaseelan, R.; Sagayaraj, P.; Ambujam, K.","l-Phenylalaninel-phenylalaninium bromide ‒ a new nonlinear optical material","CrystEngComm","2014","16","34","7979","","10.1039/C4CE00718B","","","0.71073","MoKα","","0.0799","0.0578","","","0.1379","0.1475","","","","","","1.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217013","12.9551","0.0002","11.293","0.00015","14.6992","0.0003","90","","115.648","0.002","90","","1938.63","0.06","110","2","110","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H19 N3 -","- C26 H19 N3 -","- C104 H76 N12 -","4","1","","Percino, M. Judith; Cerón, Margarita; Soriano-Moro, Guillermo; Castro, M. Eugenia; Chapela, Víctor M.; Bonilla, José; Reyes-Reyes, Marisol; López-Sandoval, Román","The effect of the supramolecular network of (Z)-3-(4-(diphenylamino)phenyl)-2-(pyridin-2-yl)-acrylonitrile on the fluorescence behavior of a single crystal: experimental and theoretical studies","CrystEngComm","2014","16","36","8591","","10.1039/C4CE00327F","","","0.71073","MoKα","","0.0427","0.038","","","0.0972","0.1","","","","","","1.066","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217023","9.6133","0.0002","45.6542","0.0012","10.5801","0.0003","90","","113.202","0.001","90","","4267.92","0.19","120","2","120","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C38 H39 N4 Ni O8.5 P2 S4 -","- C38 H39 N4 Ni O8.5 P2 S4 -","- C152 H156 N16 Ni4 O34 P8 S16 -","4","2","","Crespo Alonso, M.; Arca, M.; Isaia, F.; Lai, R.; Lippolis, V.; Callear, S. K.; Caricato, M.; Pasini, D.; Coles, S. J.; Aragoni, M. C.","Stereospecific generation of homochiral helices in coordination polymers built from enantiopure binaphthyl-based ligands","CrystEngComm","2014","16","36","8582","","10.1039/C4CE01101E","","","0.71073","MoKα","","0.0894","0.0587","","","0.1199","0.1325","","","","","","1.019","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217024","15.332","0.002","8.6055","0.001","34.795","0.004","90","","90","","90","","4590.8","1","120","2","120","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C42 H46 N4 Ni O8 P2 S4 -","- C42 H46 N4 Ni O8 P2 S4 -","- C168 H184 N16 Ni4 O32 P8 S16 -","4","1","","Crespo Alonso, M.; Arca, M.; Isaia, F.; Lai, R.; Lippolis, V.; Callear, S. K.; Caricato, M.; Pasini, D.; Coles, S. J.; Aragoni, M. C.","Stereospecific generation of homochiral helices in coordination polymers built from enantiopure binaphthyl-based ligands","CrystEngComm","2014","16","36","8582","","10.1039/C4CE01101E","","","0.71073","MoKα","","0.2125","0.1495","","","0.2815","0.3147","","","","","","1.162","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217025","8.157","0.003","9.405","0.004","12.802","0.008","105.22","0.008","98.276","0.008","107.826","0.006","874.9","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","1","","","- C20 H15 Co N4 O5 -","- C20 H15 Co N4 O5 -","- C40 H30 Co2 N8 O10 -","2","1","","Su, Feng; Lu, Liping; Feng, Sisi; Zhu, Miaoli","Self-assembly and magnetic properties of Ni(ii)/Co(ii) coordination polymers based on 1,4-bis(imidazol-1-yl)benzene and varying biphenyltetracarboxylates","CrystEngComm","2014","16","34","7990","","10.1039/C4CE01020E","","","0.71073","MoKα","","0.0429","0.0321","","","0.0718","0.0765","","","","","","1.082","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217026","8.1587","0.0009","9.3411","0.0012","12.7338","0.0012","105.254","0.002","98.139","0.002","107.777","0.002","865.17","0.17","298","2","298","2","","","","","","","","5","P -1","-P 1","2","2","","","- C20 H15 N4 Ni O5 -","- C20 H15 N4 Ni O5 -","- C40 H30 N8 Ni2 O10 -","2","1","","Su, Feng; Lu, Liping; Feng, Sisi; Zhu, Miaoli","Self-assembly and magnetic properties of Ni(ii)/Co(ii) coordination polymers based on 1,4-bis(imidazol-1-yl)benzene and varying biphenyltetracarboxylates","CrystEngComm","2014","16","34","7990","","10.1039/C4CE01020E","","","0.71073","MoKα","","0.1183","0.0592","","","0.1375","0.1717","","","","","","0.851","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217027","11.0648","0.0016","12.6093","0.0017","15.0869","0.0017","90","","119.371","0.008","90","","1834.4","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C20 H17 Co N4 O6 -","- C20 H17 Co N4 O6 -","- C80 H68 Co4 N16 O24 -","4","1","","Su, Feng; Lu, Liping; Feng, Sisi; Zhu, Miaoli","Self-assembly and magnetic properties of Ni(ii)/Co(ii) coordination polymers based on 1,4-bis(imidazol-1-yl)benzene and varying biphenyltetracarboxylates","CrystEngComm","2014","16","34","7990","","10.1039/C4CE01020E","","","0.71073","MoKα","","0.077","0.0402","","","0.0722","0.0854","","","","","","1.011","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217028","24.343","0.009","12.291","0.004","18.868","0.008","90","","121.369","0.01","90","","4820","3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4","","","- C40 H48 N12 Ni2 O15 -","- C40 H48 N12 Ni2 O15 -","- C160 H192 N48 Ni8 O60 -","4","0.5","","Su, Feng; Lu, Liping; Feng, Sisi; Zhu, Miaoli","Self-assembly and magnetic properties of Ni(ii)/Co(ii) coordination polymers based on 1,4-bis(imidazol-1-yl)benzene and varying biphenyltetracarboxylates","CrystEngComm","2014","16","34","7990","","10.1039/C4CE01020E","","","0.71073","MoKα","","0.1017","0.0583","","","0.1464","0.1743","","","","","","1.028","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217029","24.579","0.005","11.8337","0.0018","18.816","0.003","90","","121.09","0.005","90","","4686.7","1.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","5","","","- C26 H20 N6 Ni O5 -","- C26 H20 N6 Ni O5 -","- C208 H160 N48 Ni8 O40 -","8","1","","Su, Feng; Lu, Liping; Feng, Sisi; Zhu, Miaoli","Self-assembly and magnetic properties of Ni(ii)/Co(ii) coordination polymers based on 1,4-bis(imidazol-1-yl)benzene and varying biphenyltetracarboxylates","CrystEngComm","2014","16","34","7990","","10.1039/C4CE01020E","","","0.71073","MoKα","","0.1322","0.0751","","","0.2206","0.2673","","","","","","0.997","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217032","7.7413","0.0007","17.8726","0.0016","11.0065","0.001","90","","97.879","0.001","90","","1508.5","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","sulfacetamide4-aminopyridineSalt","N-4-aminophenylsulfonylacetamidePyridine-4-amine","","- C13 H16 N4 O3 S -","- C13 H16 N4 O3 S -","- C52 H64 N16 O12 S4 -","4","1","","Rajesh Goud, N.; Khan, Ronaq Ali; Nangia, Ashwini","Modulating the solubility of sulfacetamide by means of cocrystals","CrystEngComm","2014","16","26","5859","","10.1039/c4ce00103f","","","0.71073","MoKα","","0.0552","0.0496","","","0.1195","0.1226","","","","","","1.191","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217033","11.6469","0.0009","10.467","0.0006","12.4421","0.0009","90","","116.51","0.01","90","","1357.3","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","sulfacetamide4,4'bipyridinecocrystal","N-4-aminophenylsulfonylacetamide4,4'bipyridine","","- C13 H14 N3 O3 S -","- C13 H14 N3 O3 S -","- C52 H56 N12 O12 S4 -","4","1","","Rajesh Goud, N.; Khan, Ronaq Ali; Nangia, Ashwini","Modulating the solubility of sulfacetamide by means of cocrystals","CrystEngComm","2014","16","26","5859","","10.1039/c4ce00103f","","","0.71073","MoKα","","0.0501","0.0404","","","0.1059","0.1131","","","","","","1.035","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217034","7.1821","0.0006","30.43","0.003","8.8188","0.0007","90","","107.679","0.001","90","","1836.3","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","SulfacetamideCaffeinecocrystal","N-4-aminophenylsulfonylacetamide3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione","","- C16 H20 N6 O5 S -","- C16 H20 N6 O5 S -","- C64 H80 N24 O20 S4 -","4","1","","Rajesh Goud, N.; Khan, Ronaq Ali; Nangia, Ashwini","Modulating the solubility of sulfacetamide by means of cocrystals","CrystEngComm","2014","16","26","5859","","10.1039/c4ce00103f","","","0.71073","MoKα","","0.0464","0.0436","","","0.1138","0.1158","","","","","","1.074","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217035","10.7667","0.0004","9.7508","0.0004","21.1014","0.0007","90","","96.176","0.003","90","","2202.45","0.14","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","SulfacetamideIsonicotinamidecocrystal","N-4-aminophenylsulfonylacetamidePyridine-4-carboxamide","","- C20 H22 N6 O5 S -","- C20 H22 N6 O5 S -","- C80 H88 N24 O20 S4 -","4","1","","Rajesh Goud, N.; Khan, Ronaq Ali; Nangia, Ashwini","Modulating the solubility of sulfacetamide by means of cocrystals","CrystEngComm","2014","16","26","5859","","10.1039/c4ce00103f","","","0.71073","MoKα","","0.0545","0.0407","","","0.0963","0.1057","","","","","","1.065","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217036","8.664","0.0007","14.9675","0.0013","15.3632","0.0015","110.234","0.002","106.365","0.001","97.283","0.001","1737.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","SulfacetamideTheophyllinecocrystal","N-4-aminophenylsulfonylacetamide1,3-dimethyl-7H-purine-2,6-dione","","- C15 H18 N6 O5 S -","- C15 H18 N6 O5 S -","- C60 H72 N24 O20 S4 -","4","2","","Rajesh Goud, N.; Khan, Ronaq Ali; Nangia, Ashwini","Modulating the solubility of sulfacetamide by means of cocrystals","CrystEngComm","2014","16","26","5859","","10.1039/c4ce00103f","","","0.71073","MoKα","","0.059","0.0505","","","0.1232","0.1297","","","","","","0.953","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217037","15.9288","0.0003","6.9261","0.0002","7.8324","0.0002","90","","90","","90","","864.11","0.04","170","2","170","2","","","","","","","","4","P n m a","-P 2ac 2n","62","1,1,3-trichloro-1H-isoindole","","","- C8 H4 Cl3 N -","- C8 H4 Cl3 N -","- C32 H16 Cl12 N4 -","4","0.5","","Ayhan, Mehmet Menaf; Zorlu, Yunus; Gökdemir, Özlem; Gürek, Ayşe Gül; Dumoulin, Fabienne; Ahsen, Vefa; Hirel, Catherine","Optimized synthesis and crystal growth by sublimation of 1,3,3-trichloroisoindolenines, key building blocks for crosswise phthalocyanines","CrystEngComm","2014","16","29","6556","","10.1039/c4ce00189c","","","0.71073","MoKα","","0.023","0.022","","","0.0615","0.0623","","","","","","1.172","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217038","7.8916","0.0007","7.1079","0.0007","9.4988","0.0011","90","","97.514","0.007","90","","528.24","0.09","299","2","299","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","1,1,3,4,5,6,7-heptachloro-1H-isoindole","","","- C8 H2 Cl5 N -","- C8 H2 Cl5 N -","- C16 H4 Cl10 N2 -","2","0.5","","Ayhan, Mehmet Menaf; Zorlu, Yunus; Gökdemir, Özlem; Gürek, Ayşe Gül; Dumoulin, Fabienne; Ahsen, Vefa; Hirel, Catherine","Optimized synthesis and crystal growth by sublimation of 1,3,3-trichloroisoindolenines, key building blocks for crosswise phthalocyanines","CrystEngComm","2014","16","29","6556","","10.1039/c4ce00189c","","","0.71073","MoKα","","0.0376","0.0322","","","0.0946","0.0984","","","","","","1.143","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217039","7.408","0.001","14.011","0.002","21.402","0.004","90","","90","","90","","2221.4","0.6","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","{[Cu2(Hsersal)2(H2O)].H2O}n","","","- C20 H26 Cu2 N2 O10 -","- C20 H26 Cu2 N2 O10 -","- C80 H104 Cu8 N8 O40 -","4","1","","Kumar, Navnita; Khullar, Sadhika; Singh, Yogesh; Mandal, Sanjay K.","Hierarchical importance of coordination and hydrogen bonds in the formation of homochiral 2D coordination polymers and 2D supramolecular assemblies","CrystEngComm","2014","16","29","6730","","10.1039/c4ce00387j","","","0.71073","MoKα","","0.0561","0.0415","","","0.0882","0.0954","","","","","","0.966","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217040","7.4137","0.0004","13.3645","0.0007","13.4407","0.0007","90","","103.816","0.002","90","","1293.18","0.12","180","2","180","2","","","","","","","","6","P 1 21 1","P 2yb","4","[Cu2(Hser-5Cl-sal)2(H2O)].CH3OH","","","- C21 H26 Cl2 Cu2 N2 O10 -","- C21 H26 Cl2 Cu2 N2 O10 -","- C42 H52 Cl4 Cu4 N4 O20 -","2","1","","Kumar, Navnita; Khullar, Sadhika; Singh, Yogesh; Mandal, Sanjay K.","Hierarchical importance of coordination and hydrogen bonds in the formation of homochiral 2D coordination polymers and 2D supramolecular assemblies","CrystEngComm","2014","16","29","6730","","10.1039/c4ce00387j","","","0.71073","MoKα","","0.0213","0.0202","","","0.0408","0.041","","","","","","1.148","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217041","25.187","0.005","6.6672","0.0013","10.488","0.002","90","","100.653","0.011","90","","1730.9","0.6","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","[Cu2(4,4?-bpy)(Hsersal)2].2H2O","","","- C30 H34 Cu2 N4 O10 -","- C30 H30 Cu2 N4 O10 -","- C60 H60 Cu4 N8 O20 -","2","0.5","","Kumar, Navnita; Khullar, Sadhika; Singh, Yogesh; Mandal, Sanjay K.","Hierarchical importance of coordination and hydrogen bonds in the formation of homochiral 2D coordination polymers and 2D supramolecular assemblies","CrystEngComm","2014","16","29","6730","","10.1039/c4ce00387j","","","0.71073","MoKα","","0.0558","0.0524","","","0.1632","0.1657","","","","","","1.091","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217042","24.8013","0.0018","6.8049","0.0006","10.5081","0.0007","90","","100.988","0.004","90","","1740.9","0.2","180","2","180","2","","","","","","","","5","C 1 2 1","C 2y","5","[Cu2(4,4'-bpy)(Hser-5-OMe-sal)2].CH3OH","","","- C33 H38 Cu2 N4 O11 -","- C33 H37 Cu2 N4 O11 -","- C66 H74 Cu4 N8 O22 -","2","0.5","","Kumar, Navnita; Khullar, Sadhika; Singh, Yogesh; Mandal, Sanjay K.","Hierarchical importance of coordination and hydrogen bonds in the formation of homochiral 2D coordination polymers and 2D supramolecular assemblies","CrystEngComm","2014","16","29","6730","","10.1039/c4ce00387j","","","0.71073","MoKα","","0.0534","0.049","","","0.1434","0.1518","","","","","","1.098","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217043","23.4854","0.0018","6.8789","0.0005","13.6839","0.0011","90","","101.685","0.004","90","","2164.9","0.3","180","2","180","2","","","","","","","","6","C 1 2 1","C 2y","5","[Cu2(4,4'-bpy)(Hser-5-NO2-sal)2].3DMSO","","","- C36 H46 Cu2 N6 O15 S3 -","- C36 H40 Cu2 N6 O15 S3 -","- C72 H80 Cu4 N12 O30 S6 -","2","0.5","","Kumar, Navnita; Khullar, Sadhika; Singh, Yogesh; Mandal, Sanjay K.","Hierarchical importance of coordination and hydrogen bonds in the formation of homochiral 2D coordination polymers and 2D supramolecular assemblies","CrystEngComm","2014","16","29","6730","","10.1039/c4ce00387j","","","0.71073","MoKα","","0.0654","0.0494","","","0.1315","0.1451","","","","","","0.935","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217044","6.8225","0.0006","8.6115","0.0009","10.7203","0.0012","67.906","0.01","86.057","0.008","78.308","0.008","571.46","0.11","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C11 H9 F N2 O5 -","- C11 H9 F N2 O5 -","- C22 H18 F2 N4 O10 -","2","1","","Li, Song; Chen, Jia-Mei; Lu, Tong-Bu","Synthon polymorphs of 1 : 1 co-crystal of 5-fluorouracil and 4-hydroxybenzoic acid: their relative stability and solvent polarity dependence of grinding outcomes","CrystEngComm","2014","16","28","6450","","10.1039/c4ce00221k","","","1.54178","CuKα","","0.063","0.0456","","","0.1106","0.1266","","","","","","1.054","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217045","7.0356","0.0003","14.9022","0.0013","10.2665","0.0004","90","","99.418","0.004","90","","1061.89","0.11","150.02","0.11","150.02","0.11","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H9 F N2 O5 -","- C11 H9 F N2 O5 -","- C44 H36 F4 N8 O20 -","4","1","","Li, Song; Chen, Jia-Mei; Lu, Tong-Bu","Synthon polymorphs of 1 : 1 co-crystal of 5-fluorouracil and 4-hydroxybenzoic acid: their relative stability and solvent polarity dependence of grinding outcomes","CrystEngComm","2014","16","28","6450","","10.1039/c4ce00221k","","","1.54178","CuKα","","0.1014","0.0617","","","0.149","0.1844","","","","","","1.055","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217046","18.65","0.03","7.982","0.011","27.53","0.04","90","","109.469","0.016","90","","3864","10","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H32 Cd2 N4 O18 -","- C41 H32 Cd2 N4 O18 -","- C164 H128 Cd8 N16 O72 -","4","0.5","","Chang, Xin-Hong; Zhao, Ying; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Five Cd(ii) coordination polymers based on 2,3′,5,5′-biphenyltetracarboxylic acid and N-donor coligands: syntheses, structures and fluorescent properties","CrystEngComm","2014","16","28","6417","","10.1039/c4ce00355a","","","0.71073","MoKα","","0.1269","0.0806","","","0.1987","0.2398","","","","","","1.064","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217047","10.3863","0.0012","12.9737","0.0015","10.8834","0.0013","90","","113.582","0.001","90","","1344.1","0.3","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H24 Cd2 N4 O10 -","- C26 H24 Cd2 N4 O10 -","- C52 H48 Cd4 N8 O20 -","2","1","","Chang, Xin-Hong; Zhao, Ying; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Five Cd(ii) coordination polymers based on 2,3′,5,5′-biphenyltetracarboxylic acid and N-donor coligands: syntheses, structures and fluorescent properties","CrystEngComm","2014","16","28","6417","","10.1039/c4ce00355a","","","0.71073","MoKα","","0.0191","0.0182","","","0.0388","0.0391","","","","","","1.032","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217048","11.128","0.005","14.055","0.006","22.979","0.01","90","","103.992","0.005","90","","3487","3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 Cd2 N4 O13 -","- C30 H30 Cd2 N4 O13 -","- C120 H120 Cd8 N16 O52 -","4","1","","Chang, Xin-Hong; Zhao, Ying; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Five Cd(ii) coordination polymers based on 2,3′,5,5′-biphenyltetracarboxylic acid and N-donor coligands: syntheses, structures and fluorescent properties","CrystEngComm","2014","16","28","6417","","10.1039/c4ce00355a","","","0.71073","MoKα","","0.0454","0.0305","","","0.064","0.0698","","","","","","1.028","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217049","17.246","0.006","17.018","0.006","10.945","0.004","90","","91.414","0.004","90","","3211","2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 Cd N4 O9 -","- C36 H28 Cd N4 O9 -","- C144 H112 Cd4 N16 O36 -","4","1","","Chang, Xin-Hong; Zhao, Ying; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Five Cd(ii) coordination polymers based on 2,3′,5,5′-biphenyltetracarboxylic acid and N-donor coligands: syntheses, structures and fluorescent properties","CrystEngComm","2014","16","28","6417","","10.1039/c4ce00355a","","","0.71073","MoKα","","0.0624","0.037","","","0.0665","0.0753","","","","","","1.021","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217050","13.3294","0.0017","16.202","0.002","20.283","0.003","90","","99.496","0.002","90","","4320.4","1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H20 Cd2 N6 O9 -","- C31 H20 Cd2 N6 O9 -","- C124 H80 Cd8 N24 O36 -","4","1","","Chang, Xin-Hong; Zhao, Ying; Han, Min-Le; Ma, Lu-Fang; Wang, Li-Ya","Five Cd(ii) coordination polymers based on 2,3′,5,5′-biphenyltetracarboxylic acid and N-donor coligands: syntheses, structures and fluorescent properties","CrystEngComm","2014","16","28","6417","","10.1039/c4ce00355a","","","0.71073","MoKα","","0.1021","0.059","","","0.1463","0.1622","","","","","","0.987","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217051","32.366","0.005","32.366","0.005","32.366","0.005","90","","90","","90","","33905","9","173","2","173","2","","","","","","","","5","P m -3 m","-P 4 2 3","221","","","","- C312 H176 N8 O148 Zn28 -","- C312 H120 O124 Zn28 -","- C312 H120 O124 Zn28 -","1","0.0208333","","Kim, Dongwook; Liu, Xinfang; Oh, Minhak; Song, Xiaokai; Zou, Yang; Singh, Devendra; Kim, Kwang S.; Lah, Myoung Soo","Isoreticular MOFs based on a rhombic dodecahedral MOP as a tertiary building unit","CrystEngComm","2014","16","28","6391","","10.1039/c4ce00017j","","","0.71073","MoKα","","0.3461","0.2841","","","0.5272","0.556","","","","","","1.693","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217052","31.102","0.004","31.102","0.004","31.102","0.004","90","","90","","90","","30086","7","100","2","100","2","","","","","","","","5","P m -3","-P 2 2 3","200","","","","- C288 H200 N32 O172 Zn28 -","- C288 H144 N24 O148 Zn28 -","- C288 H144 N24 O148 Zn28 -","1","0.0416667","","Kim, Dongwook; Liu, Xinfang; Oh, Minhak; Song, Xiaokai; Zou, Yang; Singh, Devendra; Kim, Kwang S.; Lah, Myoung Soo","Isoreticular MOFs based on a rhombic dodecahedral MOP as a tertiary building unit","CrystEngComm","2014","16","28","6391","","10.1039/c4ce00017j","","","1","synchrotron","","0.1366","0.1101","","","0.266","0.2876","","","","","","1.062","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7217053","7.8156","0.0008","10.3153","0.0017","20.747","0.002","101.272","0.011","100.209","0.008","97.106","0.012","1592.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H38 Cu N2 O6 -","- C34 H38 Cu N2 O6 -","- C68 H76 Cu2 N4 O12 -","2","1","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.0854","0.0467","","","0.1188","0.1336","","","","","","1.029","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217054","31.05","0.14","9.83","0.04","20.58","0.09","90","","101.19","0.08","90","","6162","5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C70 H76 Mn2 N4 O10 -","- C70 H76 Mn2 N4 O10 -","- C280 H304 Mn8 N16 O40 -","4","0.5","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.0687","0.0577","","","0.1522","0.1628","","","","","","1.057","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217055","31.01","0.07","9.72","0.02","20.78","0.05","90","","101.99","0.03","90","","6127","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C68 H76 N4 O12 Zn2 -","- C68 H76 N4 O12 Zn2 -","- C272 H304 N16 O48 Zn8 -","4","0.5","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.0519","0.0479","","","0.1346","0.1456","","","","","","1.191","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217056","20.2631","0.0003","20.2631","0.0003","13.8155","0.0005","90","","90","","90","","5672.6","0.2","150","2","150","2","","","","","","","","5","I 41","I 4bw","80","","","","- C32 H32 Mn N2 O5 -","- C32 H32 Mn N2 O5 -","- C256 H256 Mn8 N16 O40 -","8","1","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.0319","0.0273","","","0.0614","0.0631","","","","","","1.019","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217057","20.572","0.0008","20.572","0.0014","13.725","0.002","90","","90","","90","","5808.5","1","293","2","293","2","","","","","","","","5","I 41","I 4bw","80","","","","- C32 H32 Cu N2 O5 -","- C32 H32 Cu N2 O5 -","- C256 H256 Cu8 N16 O40 -","8","1","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.1035","0.0432","","","0.091","0.1063","","","","","","1.023","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217058","12.0429","0.0009","11.3433","0.0005","14.8837","0.0007","90","","98.784","0.005","90","","2009.4","0.2","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H54 N2 O4 Zn -","- C42 H54 N2 O4 Zn -","- C84 H108 N4 O8 Zn2 -","2","0.25","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.0504","0.0383","","","0.1023","0.1075","","","","","","1.064","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217059","13.211","0.008","11.69","0.007","14.445","0.009","90","","99.835","0.011","90","","2198","2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Mn N2 O5 -","- C23 H26 Mn N2 O5 -","- C92 H104 Mn4 N8 O20 -","4","1","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71075","MoKα","","0.0954","0.0814","","","0.1557","0.1625","","","","","","1.194","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217060","28.204","0.0018","11.495","0.0015","15.042","0.0009","90","","114.001","0.005","90","","4455","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H50 N4 O9 S Zn2 -","- C46 H50 N4 O9 S Zn2 -","- C184 H200 N16 O36 S4 Zn8 -","4","0.5","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.0561","0.0321","","","0.0793","0.0882","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217061","22.74","0.12","28.36","0.13","10.39","0.05","90","","101.66","0.08","90","","6562","6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H28 N2 O8 P2 Zn -","- C34 H28 N2 O8 P2 Zn -","- C272 H224 N16 O64 P16 Zn8 -","8","1","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71073","MoKα","","0.1634","0.1326","","","0.3206","0.3494","","","","","","1.31","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217062","9.6304","0.0007","9.6386","0.0007","10.013","0.0007","85.443","0.001","72.785","0.001","72.761","0.001","847.89","0.11","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H21 N5 O14 S2 Sm2 -","- C34 H21 N5 O14 S2 Sm2 -","- C34 H21 N5 O14 S2 Sm2 -","1","0.5","","Zhang, Yi-Hua; Li, Xia; Song, Shuang; Yang, Hong-Yu; Ma, Dou; Liu, Yi-Heng","Lanthanide coordination frameworks: crystal structure, down- and up-conversion luminescence and white light emission","CrystEngComm","2014","16","36","8390","","10.1039/C4CE00923A","","","0.71073","MoKα","","0.028","0.0253","","","0.0607","0.0624","","","","","","1.038","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217063","10.551","0.002","10.62","0.002","15.094","0.004","74.956","0.018","69.597","0.011","72.234","0.011","1487.2","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H21 Eu N5 O8 S2 -","- C31 H21 Eu N5 O8 S2 -","- C62 H42 Eu2 N10 O16 S4 -","2","1","","Zhang, Yi-Hua; Li, Xia; Song, Shuang; Yang, Hong-Yu; Ma, Dou; Liu, Yi-Heng","Lanthanide coordination frameworks: crystal structure, down- and up-conversion luminescence and white light emission","CrystEngComm","2014","16","36","8390","","10.1039/C4CE00923A","","","0.71073","MoKα","","0.0879","0.0568","","","0.128","0.1412","","","","","","1.083","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217064","10.544","0.0014","10.5785","0.0015","15.068","0.002","92.469","0.003","110.42","0.002","107.942","0.003","1476.9","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H21 Gd N5 O8 S2 -","- C31 H21 Gd N5 O8 S2 -","- C62 H42 Gd2 N10 O16 S4 -","2","1","","Zhang, Yi-Hua; Li, Xia; Song, Shuang; Yang, Hong-Yu; Ma, Dou; Liu, Yi-Heng","Lanthanide coordination frameworks: crystal structure, down- and up-conversion luminescence and white light emission","CrystEngComm","2014","16","36","8390","","10.1039/C4CE00923A","","","0.71073","MoKα","","0.0827","0.0568","","","0.1091","0.1215","","","","","","1.012","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217065","10.5381","0.0014","10.5712","0.0013","15.041","0.002","75.114","0.004","69.497","0.002","72.006","0.002","1471.7","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H21 N5 O8 S2 Tb -","- C31 H21 N5 O8 S2 Tb -","- C62 H42 N10 O16 S4 Tb2 -","2","1","","Zhang, Yi-Hua; Li, Xia; Song, Shuang; Yang, Hong-Yu; Ma, Dou; Liu, Yi-Heng","Lanthanide coordination frameworks: crystal structure, down- and up-conversion luminescence and white light emission","CrystEngComm","2014","16","36","8390","","10.1039/C4CE00923A","","","0.71073","MoKα","","0.0875","0.0583","","","0.1155","0.1308","","","","","","0.999","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217066","10.542","0.003","10.561","0.003","14.961","0.004","75.527","0.006","69.711","0.006","71.721","0.006","1464.7","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H21 Er N5 O8 S2 -","- C31 H21 Er N5 O8 S2 -","- C62 H42 Er2 N10 O16 S4 -","2","1","","Zhang, Yi-Hua; Li, Xia; Song, Shuang; Yang, Hong-Yu; Ma, Dou; Liu, Yi-Heng","Lanthanide coordination frameworks: crystal structure, down- and up-conversion luminescence and white light emission","CrystEngComm","2014","16","36","8390","","10.1039/C4CE00923A","","","0.71073","MoKα","","0.1437","0.0818","","","0.1494","0.1837","","","","","","0.956","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217067","10.5522","0.0009","10.5726","0.001","14.9134","0.0013","75.774","0.002","69.835","0.001","71.559","0.001","1464.1","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H21 N5 O8 S2 Yb -","- C31 H21 N5 O8 S2 Yb -","- C62 H42 N10 O16 S4 Yb2 -","2","1","","Zhang, Yi-Hua; Li, Xia; Song, Shuang; Yang, Hong-Yu; Ma, Dou; Liu, Yi-Heng","Lanthanide coordination frameworks: crystal structure, down- and up-conversion luminescence and white light emission","CrystEngComm","2014","16","36","8390","","10.1039/C4CE00923A","","","0.71073","MoKα","","0.0393","0.0333","","","0.0811","0.0849","","","","","","0.98","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217068","9.2918","0.0008","20.1508","0.0017","25.42","0.002","90","","90","","90","","4759.6","0.7","133","2","133","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C58 H54 Cl2 O2 P2 Pd -","- C58 H54 Cl2 O2 P2 Pd -","- C232 H216 Cl8 O8 P8 Pd4 -","4","1","","Wang, Hui; Hu, Ruo Xin; Pang, Xue; Gao, Hai Yue; Jin, Wei Jun","The phosphorescent co-crystals of 1,4-diiodotetrafluorobenzene and bent 3-ring-N-heterocyclic hydrocarbons by C‒I⋯N and C‒I⋯π halogen bonds","CrystEngComm","2014","16","34","7942","","10.1039/C4CE00813H","","","0.71073","MoKα","","0.0297","0.0258","","","0.0599","0.0621","","","","","","1.015","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217069","9.7484","0.0007","19.9815","0.0015","25.907","0.0019","90","","90","","90","","5046.4","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C59 H55 Cl O2 P2 Pd -","- C59 H55 Cl O2 P2 Pd -","- C236 H220 Cl4 O8 P8 Pd4 -","4","1","","Wang, Hui; Hu, Ruo Xin; Pang, Xue; Gao, Hai Yue; Jin, Wei Jun","The phosphorescent co-crystals of 1,4-diiodotetrafluorobenzene and bent 3-ring-N-heterocyclic hydrocarbons by C‒I⋯N and C‒I⋯π halogen bonds","CrystEngComm","2014","16","34","7942","","10.1039/C4CE00813H","","","0.71073","MoKα","","0.0349","0.0311","","","0.0744","0.0761","","","","","","1.036","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217070","11.3703","0.0005","18.4887","0.001","13.6456","0.0008","90","","113.629","0.003","90","","2628.1","0.2","143","2","416","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C56 H55 Cl O8 P2 Pd -","- C56 H55 Cl O8 P2 Pd -","- C112 H110 Cl2 O16 P4 Pd2 -","2","1","","Wang, Hui; Hu, Ruo Xin; Pang, Xue; Gao, Hai Yue; Jin, Wei Jun","The phosphorescent co-crystals of 1,4-diiodotetrafluorobenzene and bent 3-ring-N-heterocyclic hydrocarbons by C‒I⋯N and C‒I⋯π halogen bonds","CrystEngComm","2014","16","34","7942","","10.1039/C4CE00813H","","","1.54178","CuKα","","0.1837","0.0896","","","0.2273","0.2672","","","","","","0.932","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217071","25.8844","0.0002","14.2964","0.0002","14.2795","0.0002","90","","122.98","0.01","90","","4432.7","0.5","298","2","298","","","","100","","","","","4","C 1 2 1","C 2y","5","Rifampicin","(7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17,27,29-pentahydroxy-11- methoxy-3,7,12,14,16,18,22-heptamethyl-26-{(E)-[(4-methylpiperazin-1-yl)imino] methyl}-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1 (28),2,4,9,19,21,25(29),26-octaen-13-yl acetate","","- C43 H58 N4 O12 -","- C43 H58 N4 O12 -","- C172 H232 N16 O48 -","4","1","","Ibiapino, Amanda Laura; Seiceira, Rafael Cardoso; Pitaluga, Altivo; Trindade, Antonio Carlos; Ferreira, Fabio Furlan","Structural characterization of form I of anhydrous rifampicin","CrystEngComm","2014","16","36","8555","","10.1039/C4CE01157K","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","0.00847","0.01984","1.767","","","","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217074","21.9035","0.0006","14.5496","0.0004","27.9653","0.0006","90","","90","","90","","8912.2","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C42 H41 Cd3 N3 O21 -","- C42 H41 Cd3 N3 O21 -","- C336 H328 Cd24 N24 O168 -","8","1","","Yang, De-Liang; Zhang, Xin; Yao, Yuan-Gen; Zhang, Jian","Structure versatility of coordination polymers constructed from a semirigid ligand and polynuclear metal clusters","CrystEngComm","2014","16","34","8047","","10.1039/C4CE01032A","","","0.71073","MoKα","","0.0709","0.0492","","","0.1372","0.1608","","","","","","0.999","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217075","12.0047","0.0007","10.9563","0.0007","21.0767","0.0015","90","","106.389","0.007","90","","2659.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Ca Cd N2 O11 -","- C24 H24 Ca Cd N2 O11 -","- C96 H96 Ca4 Cd4 N8 O44 -","4","1","","Yang, De-Liang; Zhang, Xin; Yao, Yuan-Gen; Zhang, Jian","Structure versatility of coordination polymers constructed from a semirigid ligand and polynuclear metal clusters","CrystEngComm","2014","16","34","8047","","10.1039/C4CE01032A","","","0.71073","MoKα","","0.0465","0.0362","","","0.0804","0.0868","","","","","","1.099","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217076","9.9912","0.0003","21.7677","0.0009","10.2461","0.0004","90","","91.975","0.003","90","","2227.05","0.14","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 Ca Cd N O12 -","- C20 H19 Ca Cd N O12 -","- C80 H76 Ca4 Cd4 N4 O48 -","4","1","","Yang, De-Liang; Zhang, Xin; Yao, Yuan-Gen; Zhang, Jian","Structure versatility of coordination polymers constructed from a semirigid ligand and polynuclear metal clusters","CrystEngComm","2014","16","34","8047","","10.1039/C4CE01032A","","","0.71073","MoKα","","0.0407","0.0322","","","0.068","0.0728","","","","","","1.05","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217077","10.2726","0.0004","13.3346","0.0005","15.2745","0.0006","100.554","0.004","107.524","0.004","99.341","0.003","1907.96","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Ba2 N O22 Zn0 -","- C36 H28 Ba2 N O22 -","- C72 H56 Ba4 N2 O44 -","2","1","","Yang, De-Liang; Zhang, Xin; Yao, Yuan-Gen; Zhang, Jian","Structure versatility of coordination polymers constructed from a semirigid ligand and polynuclear metal clusters","CrystEngComm","2014","16","34","8047","","10.1039/C4CE01032A","","","0.71073","MoKα","","0.0418","0.0328","","","0.0769","0.0824","","","","","","1.03","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217078","10.2724","0.0006","13.3126","0.0007","15.2949","0.001","100.307","0.005","107.572","0.006","100.414","0.005","1899.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H28 Ba2 N O22 -","- C35 H28 Ba2 N O22 -","- C70 H56 Ba4 N2 O44 -","2","1","","Yang, De-Liang; Zhang, Xin; Yao, Yuan-Gen; Zhang, Jian","Structure versatility of coordination polymers constructed from a semirigid ligand and polynuclear metal clusters","CrystEngComm","2014","16","34","8047","","10.1039/C4CE01032A","","","0.71073","MoKα","","0.0672","0.0447","","","0.0941","0.1102","","","","","","1.006","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217081","9.8077","0.0009","5.595","0.0005","16.0481","0.0015","90","","91.848","0.002","90","","880.17","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 O8 P2 U -","- C14 H12 O8 P2 U -","- C28 H24 O16 P4 U2 -","2","0.5","","Yang, Weiting; Wang, Hao; Du, Zi-Yi; Tian, Wan-Guo; Sun, Zhong-Ming","Isolation of a series of uranium organophosphinates","CrystEngComm","2014","16","34","8073","","10.1039/C4CE01172D","","","0.71073","MoKα","","0.0774","0.0378","","","0.0777","0.0944","","","","","","0.962","","","","has coordinates,has disorder","180501","2020-10-21","18:00:00",""
"7217082","9.382","0.002","11.204","0.003","12.243","0.003","67.981","0.006","85.397","0.006","71.885","0.006","1133","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H42 N4 O16 P4 U2 -","- C40 H42 N4 O16 P4 U2 -","- C40 H42 N4 O16 P4 U2 -","1","0.5","","Yang, Weiting; Wang, Hao; Du, Zi-Yi; Tian, Wan-Guo; Sun, Zhong-Ming","Isolation of a series of uranium organophosphinates","CrystEngComm","2014","16","34","8073","","10.1039/C4CE01172D","","","0.71073","MoKα","","0.0626","0.0469","","","0.0802","0.0872","","","","","","0.983","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217083","10.5513","0.0007","17.4551","0.0011","11.0376","0.0007","90","","118.459","0.001","90","","1787.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C14 H13 N2 O7 P U -","- C14 H11 N2 O7 P U -","- C56 H44 N8 O28 P4 U4 -","4","1","","Yang, Weiting; Wang, Hao; Du, Zi-Yi; Tian, Wan-Guo; Sun, Zhong-Ming","Isolation of a series of uranium organophosphinates","CrystEngComm","2014","16","34","8073","","10.1039/C4CE01172D","","","0.71073","MoKα","","0.0514","0.0354","","","0.0966","0.1065","","","","","","1.056","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217084","21.949","0.006","17.918","0.004","24.002","0.006","90","","113.989","0.004","90","","8624","4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C76 H74 N4 O34 P6 U4 -","- C76 H74 N4 O34 P6 U4 -","- C304 H296 N16 O136 P24 U16 -","4","1","","Yang, Weiting; Wang, Hao; Du, Zi-Yi; Tian, Wan-Guo; Sun, Zhong-Ming","Isolation of a series of uranium organophosphinates","CrystEngComm","2014","16","34","8073","","10.1039/C4CE01172D","","","0.71073","MoKα","","0.1119","0.0515","","","0.114","0.1398","","","","","","0.954","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217085","8.946","0.006","11.706","0.007","13.404","0.008","87.195","0.01","76.239","0.012","85.236","0.012","1358.1","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H22 N2 O7 P U -","- C27 H22 N2 O7 P U -","- C54 H44 N4 O14 P2 U2 -","2","1","","Yang, Weiting; Wang, Hao; Du, Zi-Yi; Tian, Wan-Guo; Sun, Zhong-Ming","Isolation of a series of uranium organophosphinates","CrystEngComm","2014","16","34","8073","","10.1039/C4CE01172D","","","0.71073","MoKα","","0.0703","0.0515","","","0.1123","0.1217","","","","","","1.016","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217090","25.3903","0.0015","14.1304","0.0006","9.1996","0.0006","90","","99.658","0.005","90","","3253.8","0.3","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H9 Br Hg I2 N2 O -","- C12 H9 Br Hg I2 N2 O -","- C96 H72 Br8 Hg8 I16 N16 O8 -","8","1","","Khavasi, Hamid Reza; Esmaeili, Maryam","Temperature-dependent halogen⋯halogen synthon crossover in coordination compounds","CrystEngComm","2014","16","36","8479","","10.1039/C4CE00692E","","","0.71073","MoKα","","0.0862","0.064","","","0.1406","0.1517","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217091","24.3489","0.0018","4.92","0.0006","28.395","0.002","90","","125.751","0.004","90","","2760.6","0.5","294","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H18 Br2 Hg I2 N4 O2 -","- C24 H18 Br2 Hg I2 N4 O2 -","- C96 H72 Br8 Hg4 I8 N16 O8 -","4","0.5","","Khavasi, Hamid Reza; Esmaeili, Maryam","Temperature-dependent halogen⋯halogen synthon crossover in coordination compounds","CrystEngComm","2014","16","36","8479","","10.1039/C4CE00692E","","","0.71073","MoKα","","0.0772","0.0489","","","0.1203","0.128","","","","","","0.885","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217092","37.962","0.009","21.391","0.004","24.996","0.004","90","","119.84","0.004","90","","17607","6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H34 Cu N12 O41 P W12 -","- C36 H34 Cu N12 O41 P W12 -","- C288 H272 Cu8 N96 O328 P8 W96 -","8","1","","Luo, Yu-Hui; Lu, Xin-Xin; Zhang, Hong","An ultrastable, flexible POM-based coordination polymer with redox properties","CrystEngComm","2014","16","34","7865","","10.1039/C4CE01123F","","","0.71073","MoKα","","0.1202","0.0763","","","0.2168","0.2394","","","","","","1.028","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217115","14.333","0.006","21.282","0.008","17.076","0.007","90","","91.043","0.007","90","","5208","4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 Br8 N8 O10 Zn2 -","- C40 H40 Br8 N8 O10 Zn2 -","- C160 H160 Br32 N32 O40 Zn8 -","4","1","","Yan, Zhi-Hao; Han, Lu-Lu; Zhao, Ya-Qin; Li, Xiao-Yu; Wang, Xing-Po; Wang, Lei; Sun, Di","Three mixed-ligand coordination networks modulated by flexible N-donor ligands: syntheses, topological structures, and temperature-sensitive luminescence properties","CrystEngComm","2014","16","37","8747","","10.1039/C4CE01270D","","","0.71073","MoKα","","0.1736","0.1","","","0.2657","0.3123","","","","","","1.04","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217116","8.491","0.011","9.107","0.013","9.21","0.012","71.18","0.02","84.23","0.02","65.21","0.018","611.5","1.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H20 Br4 Cd N6 O8 -","- C16 H20 Br4 Cd N6 O8 -","- C16 H20 Br4 Cd N6 O8 -","1","0.5","","Yan, Zhi-Hao; Han, Lu-Lu; Zhao, Ya-Qin; Li, Xiao-Yu; Wang, Xing-Po; Wang, Lei; Sun, Di","Three mixed-ligand coordination networks modulated by flexible N-donor ligands: syntheses, topological structures, and temperature-sensitive luminescence properties","CrystEngComm","2014","16","37","8747","","10.1039/C4CE01270D","","","0.71073","MoKα","","0.0343","0.0297","","","0.075","0.077","","","","","","1.053","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217117","9.6238","0.0008","17.24","0.0014","12.7886","0.001","90","","91.914","0.002","90","","2120.6","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 Br4 N6 O4 Zn -","- C15 H10 Br4 N6 O4 Zn -","- C60 H40 Br16 N24 O16 Zn4 -","4","1","","Yan, Zhi-Hao; Han, Lu-Lu; Zhao, Ya-Qin; Li, Xiao-Yu; Wang, Xing-Po; Wang, Lei; Sun, Di","Three mixed-ligand coordination networks modulated by flexible N-donor ligands: syntheses, topological structures, and temperature-sensitive luminescence properties","CrystEngComm","2014","16","37","8747","","10.1039/C4CE01270D","","","0.71073","MoKα","","0.0618","0.0341","","","0.0683","0.0773","","","","","","0.955","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217118","10.271","0.005","18.615","0.003","10.814","0.005","90","","105.695","0.005","90","","1990.5","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Co N2 O6 -","- C22 H16 Co N2 O6 -","- C88 H64 Co4 N8 O24 -","4","1","","Ahmad, Musheer; Das, Raja; Mrozinski, Jerzy; Bienko, Alina; Poddar, Pankaj; Bharadwaj, Parimal K.","Interchain relay of antiferromagnetic ordering in 1D Co(ii) coordination polymers via π‒π interactions","CrystEngComm","2014","16","36","8523","","10.1039/C4CE01010H","","","0.71073","MoKα","","0.0886","0.0603","","","0.1542","0.1825","","","","","","1.072","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217119","8.515","0.005","12.058","0.005","17.046","0.005","90","","101.675","0.005","90","","1714","1.3","100","2","100","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C20 H12 Co N2 O6 -","- C20 H12 Co N2 O6 -","- C80 H48 Co4 N8 O24 -","4","1","","Ahmad, Musheer; Das, Raja; Mrozinski, Jerzy; Bienko, Alina; Poddar, Pankaj; Bharadwaj, Parimal K.","Interchain relay of antiferromagnetic ordering in 1D Co(ii) coordination polymers via π‒π interactions","CrystEngComm","2014","16","36","8523","","10.1039/C4CE01010H","","","0.71073","MoKα","","0.0641","0.0465","","","0.1229","0.1608","","","","","","1.163","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217120","7.286","0.008","12.218","0.014","24.76","0.03","90","","90.484","0.014","90","","2204","4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H42 N8 Ni2 O15 S2 -","- C44 H42 N8 Ni2 O15 S2 -","- C88 H84 N16 Ni4 O30 S4 -","2","0.5","","Gao, Xiao Lin; Gong, Yun; Zhang, Pan; Yang, Yong Xi; Meng, Jiang Ping; Zhang, Miao Miao; Yin, Jun Li; Lin, Jian Hua","Metal(ii) complexes based on 4-(2,6-di(pyridin-4-yl)pyridin-4-yl)benzonitrile: structures and electrocatalysis in hydrogen evolution reaction from water","CrystEngComm","2014","16","36","8492","","10.1039/C4CE01259C","","","0.71073","MoKα","","0.0831","0.0468","","","0.1052","0.1279","","","","","","1.035","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7217121","14.616","0.0014","12.1893","0.0011","25.892","0.003","90","","106.274","0.002","90","","4428.1","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H42 Co2 N8 O15 S2 -","- C44 H42 Co2 N8 O15 S2 -","- C176 H168 Co8 N32 O60 S8 -","4","1","","Gao, Xiao Lin; Gong, Yun; Zhang, Pan; Yang, Yong Xi; Meng, Jiang Ping; Zhang, Miao Miao; Yin, Jun Li; Lin, Jian Hua","Metal(ii) complexes based on 4-(2,6-di(pyridin-4-yl)pyridin-4-yl)benzonitrile: structures and electrocatalysis in hydrogen evolution reaction from water","CrystEngComm","2014","16","36","8492","","10.1039/C4CE01259C","","","0.71073","MoKα","","0.098","0.0553","","","0.1146","0.1347","","","","","","1.054","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217122","14.8543","0.0014","12.3149","0.0011","26.163","0.003","90","","106.126","0.002","90","","4597.7","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H42 Cd2 N8 O15 S2 -","- C44 H42 Cd2 N8 O15 S2 -","- C176 H168 Cd8 N32 O60 S8 -","4","1","","Gao, Xiao Lin; Gong, Yun; Zhang, Pan; Yang, Yong Xi; Meng, Jiang Ping; Zhang, Miao Miao; Yin, Jun Li; Lin, Jian Hua","Metal(ii) complexes based on 4-(2,6-di(pyridin-4-yl)pyridin-4-yl)benzonitrile: structures and electrocatalysis in hydrogen evolution reaction from water","CrystEngComm","2014","16","36","8492","","10.1039/C4CE01259C","","","0.71073","MoKα","","0.1198","0.0595","","","0.1384","0.1871","","","","","","1.098","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217123","10.944","0.003","13.623","0.004","13.884","0.004","64.73","0.004","73.057","0.005","69.711","0.004","1730.5","0.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C28 H44 Cu4 N24 Na O41 P W12 -","- C28 H44 Cu4 N24 Na O41 P W12 -","- C28 H44 Cu4 N24 Na O41 P W12 -","1","0.5","","Zhang, He; Yu, Kai; Gao, Song; Wang, Chun-Mei; Wang, Chun-Xiao; Wang, Hai-Yan; Zhou, Bai-Bin","Two unusual organic‒inorganic hybrid 3-D frameworks based on Keggin-type heteropoly blue anion-chains, 40-membered macrocycles, and sodium linker units","CrystEngComm","2014","16","36","8449","","10.1039/C4CE01029A","","","0.71073","MoKα","","0.0512","0.0661","","","0.0987","0.1032","","","","","","1.176","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217124","10.9694","0.0011","13.6637","0.0014","13.9341","0.0014","64.8306","0.0013","73.1694","0.0015","69.7887","0.0015","1748.6","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C28 H44 Ag4 N24 Na O41 P W12 -","- C28 H44 Ag4 N24 Na O41 P W12 -","- C28 H44 Ag4 N24 Na O41 P W12 -","1","0.5","","Zhang, He; Yu, Kai; Gao, Song; Wang, Chun-Mei; Wang, Chun-Xiao; Wang, Hai-Yan; Zhou, Bai-Bin","Two unusual organic‒inorganic hybrid 3-D frameworks based on Keggin-type heteropoly blue anion-chains, 40-membered macrocycles, and sodium linker units","CrystEngComm","2014","16","36","8449","","10.1039/C4CE01029A","","","0.71","MoKα","","0.0513","0.0659","","","0.0942","0.1076","","","","","","1.167","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217126","8.9158","0.0003","11.144","0.0004","14.0968","0.0006","83.256","0.002","72.321","0.002","84.057","0.002","1321.83","0.09","110","2","110","2","","","","","","","","6","P 1","P 1","1","","","","- C49 H27 I4 Mn N6 O2 -","- C49 H27 I4 Mn N6 O2 -","- C49 H27 I4 Mn N6 O2 -","1","1","","Nandi, Goutam; Goldberg, Israel","The effects of halogen bonding and molecular design on the self-assembly of coordination polymers of Mn(iii)-tetraarylporphyrin with axial bridging ligands","CrystEngComm","2014","16","36","8327","","10.1039/C4CE01125B","","","0.71073","MoKα","","0.05","0.0394","","","0.0972","0.1018","","","","","","1.053","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217127","34.108","0.002","9.5282","0.0006","19.5702","0.0013","90","","116.626","0.002","90","","5685.6","0.6","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H28 I4 Mn N5 O2 -","- C50 H28 I4 Mn N5 O2 -","- C200 H112 I16 Mn4 N20 O8 -","4","0.5","","Nandi, Goutam; Goldberg, Israel","The effects of halogen bonding and molecular design on the self-assembly of coordination polymers of Mn(iii)-tetraarylporphyrin with axial bridging ligands","CrystEngComm","2014","16","36","8327","","10.1039/C4CE01125B","","","0.71073","MoKα","","0.0373","0.0328","","","0.1006","0.1039","","","","","","0.92","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217128","8.3814","0.0002","10.2345","0.0002","13.8672","0.0009","90","","105.897","0.008","90","","1144.03","0.09","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","8-acety1-1-dimethylaminonaphthalene, 7","","- C14 H15 N O -","- C14 H15 N O -","- C56 H60 N4 O4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71075","MoKα","","0.0419","0.0378","","","0.0974","0.0998","","","","","","1.071","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217129","9.37","0.02","9.34","0.02","15.72","0.04","90","","90","","90","","1376","5","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-dimethylamino-8-isopropylnaphthalene 8","","- C16 H19 N O -","- C16 H19 N O -","- C64 H76 N4 O4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.6889","","","0.0492","0.0476","","","0.1335","0.1347","","","","","","1.214","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217130","10.4848","0.0006","12.0004","0.0007","12.0396","0.0008","73.685","0.005","85.342","0.006","83.541","0.006","1442.66","0.16","100","2","100","","","","","","","","","4","P -1","-P 1","2","","1-dimethylamino-8-(2,2-dimethylpropanoyl)naphthalene 9","","- C17 H21 N O -","- C17 H21 N O -","- C68 H84 N4 O4 -","4","2","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71075","MoKα","","0.0484","0.0393","","","0.1026","0.1059","","","","","","1.106","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217131","9.0485","0.0004","11.967","0.0005","14.4409","0.0006","90","","107.512","0.005","90","","1491.24","0.12","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","8-Benzoyl-1-dimethylaminonaphthalene, 10","","- C19 H17 N O -","- C19 H17 N O -","- C76 H68 N4 O4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71073","MoKα","","0.0776","0.0559","","","0.1052","0.1138","","","","","","1.075","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217132","12.5626","0.0008","7.4932","0.0004","13.1887","0.0009","90","","98.319","0.006","90","","1228.44","0.13","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-dimethylamino-8-trifluoroacetylnaphthalene 11","","- C14 H12 F3 N O -","- C14 H12 F3 N O -","- C56 H48 F12 N4 O4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71073","MoKα","","0.0806","0.0517","","","0.0884","0.1017","","","","","","1.046","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217133","7.2319","0.0013","8.6574","0.0013","19.901","0.003","90","","90","","90","","1246","0.3","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-Dimethylamino-4-trifluoroacetylnaphthalene 13","","- C14 H12 F3 N O -","- C14 H12 F3 N O -","- C56 H48 F12 N4 O4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71073","","","0.092","0.0602","","","0.114","0.1298","","","","","","1.067","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217134","11.3796","0.0003","10.5436","0.0002","11.0577","0.0003","90","","97.604","0.002","90","","1315.06","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-1,1,2-trimethyl-1,2-dihydrobenzo[cd]indol-1-ium chloride monohydrate, 7-H.Cl.H2O","","- C14 H18 Cl N O2 -","- C14 H18 Cl N O2 -","- C56 H72 Cl4 N4 O8 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.7107","MoKα","","0.0529","0.0417","","","0.0963","0.1043","","","","","","1.047","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217135","13.8475","0.001","7.7466","0.0004","15.6785","0.0009","90","","106.669","0.006","90","","1611.17","0.18","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-2-methyl-1,1-dimethyl-1,2-dihydrobenzo[cd]indol-1-ium triflate at 150K 7-H.triflate","","- C15 H16 F3 N O4 S -","- C15 H16 F3 N O4 S -","- C60 H64 F12 N4 O16 S4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.7107","MoKα","","0.1289","0.1027","","","0.211","0.2254","","","","","","1.235","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217136","6.2039","0.0002","10.6675","0.0003","23.5777","0.0008","90","","97.541","0.003","90","","1546.88","0.09","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-2-isopropyl-1,1-dimethyl-1,2-dihydrobenzo[cd]indol-1-ium tetrafluoroborate, 8-H.BF4","","- C16 H20 B F4 N O -","- C16 H20 B F4 N O -","- C64 H80 B4 F16 N4 O4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71073","MoKα","","0.0777","0.0582","","","0.1321","0.1424","","","","","","1.047","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217137","21.072","0.004","11.828","0.003","16.397","0.004","90","","112.765","0.014","90","","3768.4","1.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-dimethylammonium-8-(2,2-dimethylpropanoyl)naphthalene triflate 9-H.triflate","","- C18 H22 F3 N O4 S -","- C18 H22 F3 N O4 S -","- C144 H176 F24 N8 O32 S8 -","8","2","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71075","MoKα","","0.0476","0.0419","","","0.0846","0.0882","","","","","","1.036","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217138","13.6452","0.0005","13.5547","0.0004","18.2545","0.0008","90","","90","","90","","3376.3","0.2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","N,N-Dimethyl-N-(8-benzoylnaphth-1-yl)ammonium tetrafluoroborate, 10-H.BF4","","- C19 H18 B F4 N O -","- C19 H18 B F4 N O -","- C152 H144 B8 F32 N8 O8 -","8","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71073","MoKα","","0.1055","0.0767","","","0.1518","0.166","","","","","","1.114","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7217139","10.3782","0.0007","17.4219","0.0008","9.9913","0.0004","90","","103.321","0.007","90","","1757.9","0.17","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-2-trifluoromethyl-1,1-dimethyl-1,2-dihydrobenzo[cd]indol-1-ium triflate monohydrate 11-H.triflate.H2O","","- C15 H15 F6 N O5 S -","- C15 H15 F6 N O5 S -","- C60 H60 F24 N4 O20 S4 -","4","1","","Mercadal, Nerea; Day, Stephen P.; Jarmyn, Andrew; Pitak, Mateusz B.; Coles, Simon J.; Wilson, Claire; Rees, Gregory J.; Hanna, John V.; Wallis, John D.","O- vs. N-protonation of 1-dimethylaminonaphthalene-8-ketones: formation of a peri N‒C bond or a hydrogen bond to the pi-electron density of a carbonyl group","CrystEngComm","2014","16","36","8363","","10.1039/C4CE00981A","","","0.71075","MoKα","","0.0395","0.0322","","","0.0753","0.0783","","","","","","1.057","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217140","26.3596","0.0011","5.8523","0.0003","32.3137","0.0011","90","","105.987","0.004","90","","4792.1","0.4","240","0.1","240","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 F2 N8 O11 S2 -","- C16 H20 F2 N8 O11 S2 -","- C128 H160 F16 N64 O88 S16 -","8","1","","Wang, Lin; Wen, Xiaonan; Li, Ping; Wang, Jianming; Yang, Ping; Zhang, Hailu; Deng, Zongwu","2 : 1 5-Fluorocytosine‒acesulfame CAB cocrystal and 1 : 1 5-fluorocytosine‒acesulfame salt hydrate with enhanced stability against hydration","CrystEngComm","2014","16","36","8537","","10.1039/C4CE01150C","","","0.71073","MoKα","","0.0672","0.0451","","","0.0978","0.1066","","","","","","1.01","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217141","7.2613","0.0002","10.5289","0.0003","11.6662","0.0004","66.818","0.0011","82.022","0.0012","78.567","0.0012","801.81","0.04","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H13 F2 N7 O6 S -","- C12 H13 F2 N7 O6 S -","- C24 H26 F4 N14 O12 S2 -","2","1","","Wang, Lin; Wen, Xiaonan; Li, Ping; Wang, Jianming; Yang, Ping; Zhang, Hailu; Deng, Zongwu","2 : 1 5-Fluorocytosine‒acesulfame CAB cocrystal and 1 : 1 5-fluorocytosine‒acesulfame salt hydrate with enhanced stability against hydration","CrystEngComm","2014","16","36","8537","","10.1039/C4CE01150C","","","0.71073","MoKα","","0.0335","0.0305","","","0.084","0.0866","","","","","","1.057","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217146","5.809","0.0007","20.942","0.003","6.6746","0.0008","90","","107.509","0.002","90","","774.36","0.17","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N,N'</i>-(1,4-phenylenedimethylidyne)<i>bis</i>[2-fluorobenzenamine]","","- C20 H14 F2 N2 -","- C20 H14 F2 N2 -","- C40 H28 F4 N4 -","2","0.5","","Ojala, William H.; Balidemaj, Barjeta; Johnson, Jenna A.; Larson, Sarah N.; Ojala, Charles R.","Molecular symmetry and fluorine-containing supramolecular synthons as structure-differentiating agents in some “bridge-flipped” isomeric bis-benzylideneanilines","CrystEngComm","2014","16","31","7226","","10.1039/C3CE42540A","","","0.71073","MoKα","","0.0591","0.0389","","","0.0876","0.0951","","","","","","1.047","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217147","9.4317","0.0014","3.952","0.0006","20.303","0.003","90","","94.204","0.002","90","","754.7","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N,N'</i>-(1,4-phenylenedimethylidyne)<i>bis</i>[3-fluorobenzenamine]","","- C20 H14 F2 N2 -","- C20 H14 F2 N2 -","- C40 H28 F4 N4 -","2","0.5","","Ojala, William H.; Balidemaj, Barjeta; Johnson, Jenna A.; Larson, Sarah N.; Ojala, Charles R.","Molecular symmetry and fluorine-containing supramolecular synthons as structure-differentiating agents in some “bridge-flipped” isomeric bis-benzylideneanilines","CrystEngComm","2014","16","31","7226","","10.1039/C3CE42540A","","","0.71073","MoKα","","0.0611","0.0539","","","0.1382","0.1416","","","","","","1.139","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7217148","7.468","0.0011","5.6986","0.0008","36.149","0.005","90","","95.239","0.002","90","","1532","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N,N'</i>-(1,4-phenylenedimethylidyne)<i>bis</i>[4-fluorobenzenamine]","","- C20 H14 F2 N2 -","- C20 H14 F2 N2 -","- C80 H56 F8 N8 -","4","1","","Ojala, William H.; Balidemaj, Barjeta; Johnson, Jenna A.; Larson, Sarah N.; Ojala, Charles R.","Molecular symmetry and fluorine-containing supramolecular synthons as structure-differentiating agents in some “bridge-flipped” isomeric bis-benzylideneanilines","CrystEngComm","2014","16","31","7226","","10.1039/C3CE42540A","","","0.71073","MoKα","","0.054","0.0411","","","0.1154","0.1243","","","","","","1.055","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217149","6.9517","0.0006","11.5713","0.001","10.0545","0.0008","90","","104.618","0.001","90","","782.61","0.11","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N,N'</i>-<i>bis</i>[(2-fluorophenyl)methylene]-1,4-benzenediamine","","- C20 H14 F2 N2 -","- C20 H14 F2 N2 -","- C40 H28 F4 N4 -","2","0.5","","Ojala, William H.; Balidemaj, Barjeta; Johnson, Jenna A.; Larson, Sarah N.; Ojala, Charles R.","Molecular symmetry and fluorine-containing supramolecular synthons as structure-differentiating agents in some “bridge-flipped” isomeric bis-benzylideneanilines","CrystEngComm","2014","16","31","7226","","10.1039/C3CE42540A","","","0.71073","MoKα","","0.0498","0.0387","","","0.0925","0.0994","","","","","","1.074","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217150","17.2826","0.0017","6.1796","0.0006","7.0765","0.0007","90","","92.71","0.001","90","","754.92","0.13","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N,N'</i>-<i>bis</i>[(3-fluorophenyl)methylene]-1,4-benzenediamine","","- C20 H14 F2 N2 -","- C20 H14 F2 N2 -","- C40 H28 F4 N4 -","2","0.5","","Ojala, William H.; Balidemaj, Barjeta; Johnson, Jenna A.; Larson, Sarah N.; Ojala, Charles R.","Molecular symmetry and fluorine-containing supramolecular synthons as structure-differentiating agents in some “bridge-flipped” isomeric bis-benzylideneanilines","CrystEngComm","2014","16","31","7226","","10.1039/C3CE42540A","","","0.71073","MoKα","","0.0453","0.0379","","","0.1027","0.1092","","","","","","1.05","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217151","7.17","0.003","7.181","0.003","9.831","0.004","73.511","0.004","73.892","0.004","89.122","0.004","465.2","0.3","176","2","176","2","","","","","","","","5","P -1","-P 1","2","","","","- C4 As N2 O6 U -","- C4 As N2 O6 U -","- C8 As2 N4 O12 U2 -","2","1","","Wylie, E. M.; Smith, P. A.; Peruski, K. M.; Smith, J. S.; Dustin, M. K.; Burns, P. C.","Effects of ionic liquid media on the cation selectivity of uranyl structural units in five new compounds produced using the ionothermal technique","CrystEngComm","2014","16","31","7236","","10.1039/C4CE00270A","","","0.71073","MoKα","","0.0412","0.0319","","","0.0627","0.0659","","","","","","1.013","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217152","18.86","0.002","18.01","0.002","11.1408","0.0013","90","","90","","90","","3784.2","0.7","174","2","174","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 N4 O23 Se5 U4 -","- C16 N4 O23 Se5 U4 -","- C64 N16 O92 Se20 U16 -","4","0.5","","Wylie, E. M.; Smith, P. A.; Peruski, K. M.; Smith, J. S.; Dustin, M. K.; Burns, P. C.","Effects of ionic liquid media on the cation selectivity of uranyl structural units in five new compounds produced using the ionothermal technique","CrystEngComm","2014","16","31","7236","","10.1039/C4CE00270A","","","0.71073","MoKα","","0.068","0.0499","","","0.1046","0.1103","","","","","","1.149","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217153","9.954","0.007","10.264","0.007","19.566","0.014","90","","101.758","0.01","90","","1957","2","174","2","174","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 N4 O22 P4 U3 -","- C20 N4 O22 P4 U3 -","- C40 N8 O44 P8 U6 -","2","0.5","","Wylie, E. M.; Smith, P. A.; Peruski, K. M.; Smith, J. S.; Dustin, M. K.; Burns, P. C.","Effects of ionic liquid media on the cation selectivity of uranyl structural units in five new compounds produced using the ionothermal technique","CrystEngComm","2014","16","31","7236","","10.1039/C4CE00270A","","","0.71073","MoKα","","0.1448","0.0497","","","0.1014","0.1326","","","","","","0.979","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217154","9.987","0.007","10.251","0.007","20.957","0.014","90","","90","","90","","2146","3","174","2","174","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C10 N2 O16 Se3 U2 -","- C10 N2 O16 Se3 U2 -","- C40 N8 O64 Se12 U8 -","4","0.5","","Wylie, E. M.; Smith, P. A.; Peruski, K. M.; Smith, J. S.; Dustin, M. K.; Burns, P. C.","Effects of ionic liquid media on the cation selectivity of uranyl structural units in five new compounds produced using the ionothermal technique","CrystEngComm","2014","16","31","7236","","10.1039/C4CE00270A","","","0.71073","MoKα","","0.0941","0.0647","","","0.1623","0.1784","","","","","","1.033","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217155","9.5152","0.0009","33.144","0.003","9.6569","0.001","90","","93.211","0.001","90","","3040.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 N2 O31 P4 U5 -","- C4 N2 O31 P4 U5 -","- C16 N8 O124 P16 U20 -","4","1","","Wylie, E. M.; Smith, P. A.; Peruski, K. M.; Smith, J. S.; Dustin, M. K.; Burns, P. C.","Effects of ionic liquid media on the cation selectivity of uranyl structural units in five new compounds produced using the ionothermal technique","CrystEngComm","2014","16","31","7236","","10.1039/C4CE00270A","","","0.71073","MoKα","","0.0684","0.045","","","0.1036","0.1163","","","","","","1.015","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217156","38.4736","0.0012","12.0047","0.001","19.0031","0.0016","90","","104.334","0.003","90","","8503.6","1","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C70 H62 Cd3 N28 O8 S5 W2 -","- C70 H62 Cd3 N28 O8 S5 W2 -","- C280 H248 Cd12 N112 O32 S20 W8 -","4","0.5","","Yang, Dan; Zhou, Hu; Yuan, Ai-Hua; Li, Yi-Zhi","Sandwich-like octacyanometalate-based cadmium assemblies with the 4,4′-dipyridyl sulfide ligand","CrystEngComm","2014","16","36","8344","","10.1039/C4CE00965G","","","0.71073","MoKα","","0.0464","0.0461","","","0.1163","0.1164","","","","","","1.073","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217157","38.0659","0.0011","11.9553","0.0012","18.9714","0.001","90","","103.936","0.0012","90","","8379.5","1","340","2","340","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C70 H56 Cd3 N28 O5 S5 W2 -","- C70 H56 Cd3 N28 O5 S5 W2 -","- C280 H224 Cd12 N112 O20 S20 W8 -","4","1","","Yang, Dan; Zhou, Hu; Yuan, Ai-Hua; Li, Yi-Zhi","Sandwich-like octacyanometalate-based cadmium assemblies with the 4,4′-dipyridyl sulfide ligand","CrystEngComm","2014","16","36","8344","","10.1039/C4CE00965G","","","0.71073","MoKα","","0.0452","0.0409","","","0.1001","0.1004","","","","","","1.017","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217158","37.855","0.005","11.8053","0.0015","18.885","0.002","90","","104.534","0.002","90","","8169.4","1.7","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C66 H56 Cd3 N26 O8 S5 W2 -","- C66 H56 Cd3 N26 O8 S5 W2 -","- C264 H224 Cd12 N104 O32 S20 W8 -","4","0.5","","Yang, Dan; Zhou, Hu; Yuan, Ai-Hua; Li, Yi-Zhi","Sandwich-like octacyanometalate-based cadmium assemblies with the 4,4′-dipyridyl sulfide ligand","CrystEngComm","2014","16","36","8344","","10.1039/C4CE00965G","","","0.71073","MoKα","","0.0532","0.0389","","","0.0869","0.0915","","","","","","1.071","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217159","37.571","0.005","11.9361","0.0015","19.196","0.002","90","","104.686","0.002","90","","8327.2","1.8","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C70 H60 Cd3 N26 O6 S5 W2 -","- C70 H60 Cd3 N26 O6 S5 W2 -","- C280 H240 Cd12 N104 O24 S20 W8 -","4","0.5","","Yang, Dan; Zhou, Hu; Yuan, Ai-Hua; Li, Yi-Zhi","Sandwich-like octacyanometalate-based cadmium assemblies with the 4,4′-dipyridyl sulfide ligand","CrystEngComm","2014","16","36","8344","","10.1039/C4CE00965G","","","0.71073","MoKα","","0.0354","0.0259","","","0.0628","0.0658","","","","","","1.043","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217171","11.4682","0.0002","8.8977","0.0001","15.6872","0.0002","90","","94.074","0.001","90","","1596.69","0.04","100","2","100","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C29 H33 Cu2 N5 O14 -","- C29 H33 Cu2 N5 O14 -","- C58 H66 Cu4 N10 O28 -","2","1","","Llano-Tomé, Francisco; Bazán, Begoña; Urtiaga, Miren-Karmele; Barandika, Gotzone; Lezama, Luis; Arriortua, María-Isabel","CuII‒PDC-bpe frameworks (PDC = 2,5-pyridinedicarboxylate, bpe = 1,2-di(4-pyridyl)ethylene): mapping of herringbone-type structures","CrystEngComm","2014","16","37","8726","","10.1039/C4CE00989D","","","1.54184","CuKα","","0.0317","0.0296","","","0.0767","0.0782","","","","","","1.041","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217172","11.3256","0.0003","8.9352","0.0002","15.1672","0.0004","90","","93.037","0.003","90","","1532.71","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 Cu N2 O7 -","- C13 H10 Cu N2 O7 -","- C52 H40 Cu4 N8 O28 -","4","1","","Llano-Tomé, Francisco; Bazán, Begoña; Urtiaga, Miren-Karmele; Barandika, Gotzone; Lezama, Luis; Arriortua, María-Isabel","CuII‒PDC-bpe frameworks (PDC = 2,5-pyridinedicarboxylate, bpe = 1,2-di(4-pyridyl)ethylene): mapping of herringbone-type structures","CrystEngComm","2014","16","37","8726","","10.1039/C4CE00989D","","","1.54184","CuKα","","0.0542","0.0481","","","0.1372","0.1445","","","","","","1.014","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217173","15.0263","0.0003","15.0263","0.0003","17.6363","0.0006","90","","90","","120","","3448.6","0.15","296","2","296","2","","","","","","","","5","P 6/m","-P 6","175","[Ba~5~(L)~3~(H~2~O)~6~].25H~2~O.10DMF.2Me~2~NH~2~^+^","","","- C154 H214 Ba5 N12 O65 -","- C120 H72 Ba5 O30 -","- C120 H72 Ba5 O30 -","1","0.0833333","","Chen, Xiao; He, Sha; Chen, Feiyan; Feng, Yunlong","Synthesis, characterization, and luminescence modulation of a rare barium-tetracarboxylate framework with I2O1connectivity","CrystEngComm","2014","16","37","8706","","10.1039/C4CE01059K","","","0.71073","MoKα","","0.0772","0.0504","","","0.1651","0.1785","","","","","","1","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217174","25.926","0.005","13.837","0.003","15.243","0.003","90","","90","","90","","5468.2","1.9","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","{[Mn3L2(pbbm)]CH3CN}n","","","- C63 H45 Mn3 N5 O12 -","- C63 H45 Mn3 N5 O12 -","- C252 H180 Mn12 N20 O48 -","4","1","","Liu, Lu; Lv, Xiaofeng; Zhang, Lin; Guo, Li'an; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Mn(ii) coordination polymers assembled from 8 or 9-connected trinuclear secondary building units: topology analysis and research of magnetic properties","CrystEngComm","2014","16","37","8736","","10.1039/C4CE01184H","","","0.71073","MoKα","","0.1189","0.0885","","","0.1574","0.1754","","","","","","1.001","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217175","8.8451","0.0018","10.334","0.002","11.762","0.002","77.05","0.03","81.5","0.03","75.82","0.03","1010.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[Mn3L2(CH3CN)2]n","","","- C46 H28 Mn3 N2 O12 -","- C46 H28 Mn3 N2 O12 -","- C46 H28 Mn3 N2 O12 -","1","0.5","","Liu, Lu; Lv, Xiaofeng; Zhang, Lin; Guo, Li'an; Wu, Jie; Hou, Hongwei; Fan, Yaoting","Mn(ii) coordination polymers assembled from 8 or 9-connected trinuclear secondary building units: topology analysis and research of magnetic properties","CrystEngComm","2014","16","37","8736","","10.1039/C4CE01184H","","","0.71073","MoKα","","0.0651","0.051","","","0.121","0.1377","","","","","","0.995","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217180","28.3148","0.0006","15.8506","0.0003","18.226","0.0004","90","","118.09","0.01","90","","7216.4","0.7","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70.5 H95.5 Cl1.5 N4 O7 S2 -","- C70.5 H95.5 Cl1.5 N4 O7 S2 -","- C282 H382 Cl6 N16 O28 S8 -","4","0.5","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","","0.71073","Mo-Kα","","0.1129","0.0962","","","0.2708","0.2888","","","","","","1.071","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7217181","12.6122","0.0005","30.9836","0.0012","18.6901","0.0007","90","","92.349","0.01","90","","7297.4","0.5","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C75.5 H87.5 Cl4.5 N6 O6 -","- C75.5 H87.5 Cl4.5 N6 O6 -","- C302 H350 Cl18 N24 O24 -","4","1","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","x-ray","0.71073","MoKα","K-L~3~","0.1638","0.0852","","","0.233","0.2683","","","","","","1.004","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7217182","19.5803","0.0005","20.1679","0.0005","18.2981","0.0005","90","","111.82","0.03","90","","6708.1","1.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C69 H91 N4 O8 S2 -","- C69 H91 N4 O8 S2 -","- C276 H364 N16 O32 S8 -","4","1","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","x-ray","0.71073","MoKα","K-L~3~","0.1991","0.0936","","","0.2441","0.2932","","","","","","1.056","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7217183","12.1816","0.0003","24.5969","0.0007","26.7522","0.0007","102.923","0.01","95.542","0.01","98.546","0.01","7655.6","0.6","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C80 H100 N8 O8 S2 -","- C80 H100 N8 O8 S2 -","- C320 H400 N32 O32 S8 -","4","2","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","","0.71073","Mo-Kα","","0.1123","0.06","","","0.1502","0.1766","","","","","","1.031","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7217184","21.951","0.004","12.163","0.003","21.185","0.003","90","","91.17","0.01","90","","5655","1.9","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C61 H84 N2 O7 -","- C61 H84 N2 O7 -","- C244 H336 N8 O28 -","4","0.5","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","","0.71073","Mo-Kα","","0.0784","0.0649","","","0.1746","0.1923","","","","","","1.029","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7217185","10.0646","0.0011","15.6235","0.0017","20.246","0.002","90","","90","","90","","3183.6","0.6","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H36 Cl2 N2 O4 -","- C37 H36 Cl2 N2 O4 -","- C148 H144 Cl8 N8 O16 -","4","1","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","","0.71073","MoKα","","0.07","0.047","","","0.0789","0.086","","","","","","0.982","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217186","27.48","0.02","20.311","0.015","19.585","0.014","90","","92.34","0.06","90","","10922","14","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","06kma022","","","- C60 H82 N2 O4 -","- C60 H82 N2 O4 -","- C480 H656 N16 O32 -","8","1","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","","0.71073","MoKα","","0.1672","0.0648","","","0.1364","0.1687","","","","","","0.792","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217187","13.4692","0.0015","15.0701","0.0016","15.3241","0.0016","91.994","0.002","115.71","0.002","109.003","0.002","2592.6","0.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H74 N2 O4 -","- C56 H74 N2 O4 -","- C112 H148 N4 O8 -","2","1","","Qureshi, Naseem; Yufit, Dimitri S.; Steed, Kirsty M.; Howard, Judith A. K.; Steed, Jonathan W.","Hydrogen bonding effects in anion binding calixarenes","CrystEngComm","2014","16","36","8413","","10.1039/C4CE01240B","","","0.71073","MoKα","","0.1334","0.0713","","","0.1566","0.1845","","","","","","1.016","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7217188","11.9751","0.0016","13.956","0.002","16.948","0.002","103.541","0.004","106.768","0.004","105.443","0.004","2461.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H22 N5 Ni S4 -","- C21 H22 N5 Ni S4 -","- C84 H88 N20 Ni4 S16 -","4","2","","Chen, Xuan-Rong; Sui, Yun-Xia; Zhai, Lu; Ning, Wei-Hua; Ren, Xiao-Ming","Influence of the molecular structures of dithiolate ligands on crystal packing modes and magnetic properties in salts (Bz-Et3N)[Ni(dmit)x(mnt)2−x] (x = 0‒2)","CrystEngComm","2014","16","37","8717","","10.1039/C4CE01168F","","","0.71073","MoKα","","0.1988","0.0999","","","0.2502","0.3107","","","","","","0.991","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217189","9.6795","0.0009","11.1962","0.0011","12.7101","0.0013","85.342","0.003","74.876","0.003","85.864","0.003","1323.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H22 N Ni S10 -","- C19 H22 N Ni S10 -","- C38 H44 N2 Ni2 S20 -","2","1","","Chen, Xuan-Rong; Sui, Yun-Xia; Zhai, Lu; Ning, Wei-Hua; Ren, Xiao-Ming","Influence of the molecular structures of dithiolate ligands on crystal packing modes and magnetic properties in salts (Bz-Et3N)[Ni(dmit)x(mnt)2−x] (x = 0‒2)","CrystEngComm","2014","16","37","8717","","10.1039/C4CE01168F","","","0.71073","MoKα","","0.0454","0.034","","","0.0786","0.0853","","","","","","1.037","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217190","7.9725","0.001","14.7293","0.0017","44.097","0.005","90","","90","","90","","5178.3","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 N3 Ni S7 -","- C20 H22 N3 Ni S7 -","- C160 H176 N24 Ni8 S56 -","8","2","","Chen, Xuan-Rong; Sui, Yun-Xia; Zhai, Lu; Ning, Wei-Hua; Ren, Xiao-Ming","Influence of the molecular structures of dithiolate ligands on crystal packing modes and magnetic properties in salts (Bz-Et3N)[Ni(dmit)x(mnt)2−x] (x = 0‒2)","CrystEngComm","2014","16","37","8717","","10.1039/C4CE01168F","","","0.71073","MoKα","","0.2155","0.0612","","","0.0697","0.0915","","","","","","0.963","","","","has coordinates","182989","2020-10-21","18:00:00",""
"7217192","12.4555","0.001","14.7313","0.0012","15.9151","0.0012","63.621","0.002","81.425","0.002","83.341","0.002","2582.8","0.4","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H48 Cl F4 Ir N14 O -","- C54 H48 Cl F4 Ir N14 O -","- C108 H96 Cl2 F8 Ir2 N28 O2 -","2","1","","Rawson, Jeremy M.; Donato, Loïc; Zysman-Colman, Eli","Triazole-directed hydrogen-bonded structures of cationic iridium(iii) complexes","CrystEngComm","2014","16","36","8531","","10.1039/C4CE00980K","","","0.71073","MoKα","","0.0497","0.0373","","","0.0831","0.0893","","","","","","1.049","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7217197","19.4966","0.0008","19.4966","0.0008","58.604","0.003","90","","90","","120","","19291.9","1.5","173","2","173","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C72 H51 Cr N12 O105 P2 W24 -","- C72 H51 Cr N12 O105 P2 W24 -","- C216 H153 Cr3 N36 O315 P6 W72 -","3","0.166667","","Liao, Jian-Zhen; Dui, Xue-Jing; Zhang, Hai-Long; Wu, Xiao-Yuan; Lu, Can-Zhong","Polyoxometalate anion‒π interaction-directed assembly of a three-dimensional hydrogen-bonded supramolecular framework with nanoscale porosity","CrystEngComm","2014","16","46","10530","","10.1039/C4CE01283F","","","0.71073","MoKα","","0.122","0.0836","","","0.2451","0.2871","","","","","","1.009","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217199","10.054","0.002","10.073","0.002","12.755","0.003","107.386","0.003","97.437","0.003","96.535","0.002","1206.4","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H36 N4 O2 -","- C26 H36 N4 O2 -","- C52 H72 N8 O4 -","2","1","","Sathish Kumar, B.; Panda, Pradeepta K.","1D water chain stabilized by meso-expanded calix[4]pyrrole","CrystEngComm","2014","16","37","8669","","10.1039/C4CE01502A","","","0.71073","MoKα","","0.058","0.0532","","","0.1479","0.1517","","","","","","1.114","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217200","5.2963","0.001","7.4802","0.0014","11.401","0.002","90","","99.512","0.003","90","","445.47","0.14","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 N2 -","- C10 H12 N2 -","- C20 H24 N4 -","2","0.5","","Sathish Kumar, B.; Panda, Pradeepta K.","1D water chain stabilized by meso-expanded calix[4]pyrrole","CrystEngComm","2014","16","37","8669","","10.1039/C4CE01502A","","","0.71073","MoKα","","0.1278","0.1198","","","0.346","0.3593","","","","","","1.581","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217201","15.7215","0.0016","12.0839","0.0012","16.2077","0.0017","90","","106.856","0.002","90","","2946.8","0.5","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C68 H72 Cl0 Mo2 N2 O8 -","- C68 H72 Mo2 N2 O8 -","- C136 H144 Mo4 N4 O16 -","2","1","","Chen, Yu; Ma, Li; Bian, Zheng; Jin, Rizhe; Kang, Chuanqing; Li, Zongjun; Gao, Xiang; Han, Fushe; Qiu, Xuepeng; Gao, Lianxun","The crystallographic observation of mesitylene‒mesitylene and mesitylene‒CH2Cl2‒mesitylene adducts trapped in an irregular cavity","CrystEngComm","2014","16","37","8652","","10.1039/C4CE01403K","","","0.71073","MoKα","","0.0513","0.0428","","","0.0863","0.091","","","","","","1.014","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217202","14.6862","0.0018","15.6249","0.0018","13.2871","0.0016","90","","90","","90","","3049","0.6","185","2","185","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C69 H74 Cl2 Mo2 N2 O8 -","- C69 H74 Cl2 Mo2 N2 O8 -","- C138 H148 Cl4 Mo4 N4 O16 -","2","0.5","","Chen, Yu; Ma, Li; Bian, Zheng; Jin, Rizhe; Kang, Chuanqing; Li, Zongjun; Gao, Xiang; Han, Fushe; Qiu, Xuepeng; Gao, Lianxun","The crystallographic observation of mesitylene‒mesitylene and mesitylene‒CH2Cl2‒mesitylene adducts trapped in an irregular cavity","CrystEngComm","2014","16","37","8652","","10.1039/C4CE01403K","","","0.71073","MoKα","","0.0989","0.0591","","","0.1202","0.1372","","","","","","1.022","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217203","7.5319","0.0013","20.56","0.003","8.9505","0.0014","90","","114.813","0.008","90","","1258.1","0.4","190","2","190","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,2-Dibromotetrafluorobenzene N-Methylacetamide","","- C9 H7 Br2 F4 N O -","- C9 H7 Br2 F4 N O -","- C36 H28 Br8 F16 N4 O4 -","4","1","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.1071","0.0483","","","0.1094","0.1389","","","","","","0.956","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217204","7.7932","0.0006","19.6616","0.0014","8.8023","0.0006","90","","115.553","0.004","90","","1216.82","0.16","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,3-Dibromotetrafluorobenzene N-Methylacetamide","","- C9 H7 Br2 F4 N O -","- C9 H7 Br2 F4 N O -","- C36 H28 Br8 F16 N4 O4 -","4","1","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.0462","0.0274","","","0.0538","0.0587","","","","","","1.048","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217205","5.8653","0.0003","9.0752","0.0005","22.3773","0.0013","90","","95.126","0.003","90","","1186.35","0.11","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,4-Dibromotetrafluorobenzene N-Methylacetamide","","- C9 H7 Br2 F4 N O -","- C9 H7 Br2 F4 N O -","- C36 H28 Br8 F16 N4 O4 -","4","1","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.0462","0.0364","","","0.0955","0.1103","","","","","","1.173","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217206","7.2201","0.0003","8.6847","0.0003","21.5893","0.0008","85.66","0.002","81.022","0.002","74.403","0.002","1287.11","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","1,2-Diiodotetrafluorobenzene N-Methylacetamide","","- C9 H7 F4 I2 N O -","- C9 H7 F4 I2 N O -","- C36 H28 F16 I8 N4 O4 -","4","2","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.037","0.0278","","","0.0709","0.0809","","","","","","1.234","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217207","8.0655","0.0005","18.2945","0.001","9.1049","0.0005","90","","105.695","0.003","90","","1293.38","0.13","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,3-Diiodotetrafluorobenzene N-Methylacetamide","","- C9 H7 F4 I2 N O -","- C9 H7 F4 I2 N O -","- C36 H28 F16 I8 N4 O4 -","4","1","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.0326","0.021","","","0.0398","0.0431","","","","","","1.021","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217208","21.263","0.009","4.7949","0.0019","12.348","0.006","90","","91.64","0.02","90","","1258.4","1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1,4-Diiodotetrafluorobenzene N-Methylacetamide","","- C9 H7 F4 I2 N O -","- C9 H7 F4 I2 N O -","- C36 H28 F16 I8 N4 O4 -","4","0.5","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.0255","0.0188","","","0.0413","0.0543","","","","","","1.249","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217209","9.6481","0.0012","6.3391","0.0008","7.1825","0.0009","90","","90","","90","","439.28","0.1","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","N-methylacetamide","","- C3 H7 N O -","- C3 H7 N O -","- C12 H28 N4 O4 -","4","0.5","","Vasylyeva, Vera; Nayak, Susanta K.; Terraneo, Giancarlo; Cavallo, Gabriella; Metrangolo, Pierangelo; Resnati, Giuseppe","Orthogonal halogen and hydrogen bonds involving a peptide bond model","CrystEngComm","2014","16","35","8102","","10.1039/C4CE01514B","","","0.71073","MoKα","","0.0546","0.0471","","","0.1305","0.1344","","","","","","1.073","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217210","13.008","0.004","16.887","0.005","18.288","0.007","114.561","0.006","92.22","0.013","95.181","0.009","3626","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C140 H129 Cu13 N50 O6 -","- C140 H120 Cu13 N50 O6 -","- C140 H120 Cu13 N50 O6 -","1","0.5","","Fang, Zhen-Lan; Wu, Xiao-Yuan; Yu, Rong-Min; Lu, Can-Zhong","A microporous cationic metal‒organic framework constructed from metallamacrocycle-based nanocages: structures and luminescence properties","CrystEngComm","2014","16","37","8769","","10.1039/C4CE01185F","","","0.71073","MoKα","","0.1185","0.0808","","","0.1779","0.2098","","","","","","1.079","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217216","17.06","0.0014","29.727","0.003","7.9426","0.0006","90","","90","","90","","4028","0.6","296","2","296","2","","","","","","","","2","I b a 2","I 2 -2c","45","","1-(anthracen-9-yl)pyrene","","- C30 H18 -","- C30 H18 -","- C240 H144 -","8","1","","Nagarajan, Kalaivanan; Rajagopal, Shinaj K.; Hariharan, Mahesh","C‒H⋯H‒C and C‒H⋯π contacts aid transformation of dimeric to monomeric anthracene in the solid state","CrystEngComm","2014","16","38","8946","","10.1039/C4CE01278J","","","0.71073","MoKα","","0.1139","0.0477","","","0.1091","0.169","","","","","","1.022","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217217","7.357","0.005","10.583","0.005","25.606","0.005","90","","96.097","0.005","90","","1982.4","1.7","296","2","296","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","1-(anthracen-9-yl)pyrene","","- C30 H18 -","- C30 H18 -","- C120 H72 -","4","1","","Nagarajan, Kalaivanan; Rajagopal, Shinaj K.; Hariharan, Mahesh","C‒H⋯H‒C and C‒H⋯π contacts aid transformation of dimeric to monomeric anthracene in the solid state","CrystEngComm","2014","16","38","8946","","10.1039/C4CE01278J","","","0.71073","MoKα","","0.0579","0.0412","","","0.1162","0.137","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217218","16.2326","0.0019","14.5987","0.0019","36.175","0.004","90","","94.93","0.009","90","","8540.9","1.8","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H22 N4 O8 Zn2 -","- C30 H22 N4 O8 Zn2 -","- C240 H176 N32 O64 Zn16 -","8","1","","Safarifard, Vahid; Morsali, Ali","Influence of an amine group on the highly efficient reversible adsorption of iodine in two novel isoreticular interpenetrated pillared-layer microporous metal‒organic frameworks","CrystEngComm","2014","16","37","8660","","10.1039/C4CE01331J","","","0.71073","MoKα","","0.1355","0.0973","","","0.2692","0.2957","","","","","","1.126","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217219","17.1558","0.0006","13.4604","0.0004","36.1586","0.0011","90","","97.233","0.002","90","","8283.4","0.5","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39.38 H45.88 N9.13 O11.13 Zn2 -","- C29.921 H19.931 N5.989 O8 Zn2 -","- C239.368 H159.448 N47.912 O64 Zn16 -","8","1","","Safarifard, Vahid; Morsali, Ali","Influence of an amine group on the highly efficient reversible adsorption of iodine in two novel isoreticular interpenetrated pillared-layer microporous metal‒organic frameworks","CrystEngComm","2014","16","37","8660","","10.1039/C4CE01331J","","","0.71073","MoKα","","0.1033","0.0722","","","0.2239","0.24","","","","","","1.15","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217220","5.4732","0.0011","14.309","0.003","11.659","0.002","90","","99.48","0.03","90","","900.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 N2 O4 -","- C18 H24 N2 O4 -","- C36 H48 N4 O8 -","2","0.5","","Batisai, Eustina; Ayamine, Alban; Kilinkissa, Ornella E. Y.; Báthori, Nikoletta B.","Melting point‒solubility‒structure correlations in multicomponent crystals containing fumaric or adipic acid","CrystEngComm","2014","16","43","9992","","10.1039/C4CE01298D","","","0.71073","MoKα","","0.0671","0.0461","","","0.116","0.1292","","","","","","1.051","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217221","8.746","0.0017","7.217","0.0014","12.799","0.003","90","","92.68","0.03","90","","807","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O4 -","- C16 H18 N2 O4 -","- C32 H36 N4 O8 -","2","0.5","","Batisai, Eustina; Ayamine, Alban; Kilinkissa, Ornella E. Y.; Báthori, Nikoletta B.","Melting point‒solubility‒structure correlations in multicomponent crystals containing fumaric or adipic acid","CrystEngComm","2014","16","43","9992","","10.1039/C4CE01298D","","","0.71073","MoKα","","0.0558","0.0409","","","0.1048","0.114","","","","","","1.052","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217222","9.805","0.002","4.8099","0.001","16.66","0.003","90","","98.91","0.03","90","","776.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O4 -","- C16 H18 N2 O4 -","- C32 H36 N4 O8 -","2","0.5","","Batisai, Eustina; Ayamine, Alban; Kilinkissa, Ornella E. Y.; Báthori, Nikoletta B.","Melting point‒solubility‒structure correlations in multicomponent crystals containing fumaric or adipic acid","CrystEngComm","2014","16","43","9992","","10.1039/C4CE01298D","","","0.71073","MoKα","","0.0511","0.0382","","","0.1054","0.1125","","","","","","1.077","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217223","6.9477","0.0014","7.1623","0.0014","10.509","0.002","78.17","0.03","73.89","0.03","62.48","0.03","443.7","0.2","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C18 H24 N2 O4 -","- C18 H24 N2 O4 -","- C18 H24 N2 O4 -","1","1","","Batisai, Eustina; Ayamine, Alban; Kilinkissa, Ornella E. Y.; Báthori, Nikoletta B.","Melting point‒solubility‒structure correlations in multicomponent crystals containing fumaric or adipic acid","CrystEngComm","2014","16","43","9992","","10.1039/C4CE01298D","","","0.71073","MoKα","","0.0429","0.0364","","","0.1037","0.111","","","","","","1.07","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217225","12.4818","0.0014","21.763","0.003","16.509","0.002","90","","103.577","0.005","90","","4359.2","0.9","200","2","200","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H41 Ce2 N3 O16 -","- C45 H40 Ce2 N3 O16 -","- C180 H160 Ce8 N12 O64 -","4","0.5","","Liu, Yen-Hsiang; Chien, Po-Hsiu","A series of lanthanide‒organic frameworks possessing arrays of 2D intersecting channels within a 3D pillar-supported packed double-decker network and Co2±induced luminescence modulation","CrystEngComm","2014","16","37","8852","","10.1039/C4CE00461B","","x-ray","0.71073","MoKα","","0.1265","0.0728","","","0.1404","0.1595","","","","","","1.05","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217226","16.135","0.003","26.792","0.005","18.63","0.004","90","","110.57","0.03","90","","7540","3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C156 H174 Ca5 O44 -","- C156 H174 Ca5 O44 -","- C312 H348 Ca10 O88 -","2","0.5","","Noh, Kyungkyou; Ko, Nakeun; Park, Hye Jeong; Park, SangYoun; Kim, Jaheon","Two porous metal‒organic frameworks containing zinc‒calcium clusters and calcium cluster chains","CrystEngComm","2014","16","37","8664","","10.1039/C4CE01237B","","","0.8","synchrotron","","0.1006","0.0864","","","0.2614","0.2786","","","","","","1.196","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217227","16.55","0.002","16.55","0.002","14.748","0.003","90","","90","","120","","3498.3","0.9","100","2","100","2","","","","","","","chemical reaction","5","P -3 1 c","-P 3 2c","163","ZnCaBTB","ZnCaBTB","","- C69.25 H65.28 Ca O19.14 Zn2 -","- C69.258 H65.316 Ca O19.136 Zn2 -","- C138.516 H130.632 Ca2 O38.272 Zn4 -","2","0.166667","","Noh, Kyungkyou; Ko, Nakeun; Park, Hye Jeong; Park, SangYoun; Kim, Jaheon","Two porous metal‒organic frameworks containing zinc‒calcium clusters and calcium cluster chains","CrystEngComm","2014","16","37","8664","","10.1039/C4CE01237B","","","0.63","synchrotron","","0.0707","0.0701","","","0.2006","0.201","","","","","","1.187","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217228","22.87","0.005","34.647","0.007","9.535","0.002","90","","90","","90","","7555","3","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C8 H9 Ag2 Cr2 N12 O7.5 -","- C8 H9 Ag2 Cr2 N12 O7.5 -","- C128 H144 Ag32 Cr32 N192 O120 -","16","1","","Li, Xinxiong; Gong, Yaqiong; Zhao, Huaixia; Wang, Ruihu","Solvent-mediated crystal-to-crystal transformations from a cationic homometallic metal‒organic framework to heterometallic frameworks","CrystEngComm","2014","16","37","8818","","10.1039/C4CE01035C","","","0.71073","MoKα","","0.0204","0.0199","","","0.0474","0.0477","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217229","12.8374","0.0001","13","","13.2175","0.0005","118.924","0.008","102.91","0.015","99.902","0.012","1777.6","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H36 Ag9 Cr8 F6 N36 O34 P -","- C24 H36 Ag9 Cr8 F6 N36 O34 P -","- C24 H36 Ag9 Cr8 F6 N36 O34 P -","1","0.5","","Li, Xinxiong; Gong, Yaqiong; Zhao, Huaixia; Wang, Ruihu","Solvent-mediated crystal-to-crystal transformations from a cationic homometallic metal‒organic framework to heterometallic frameworks","CrystEngComm","2014","16","37","8818","","10.1039/C4CE01035C","","","0.71073","MoKα","","0.0346","0.0321","","","0.0859","0.0877","","","","","","1.061","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217230","15.049","0.005","15.269","0.005","22.867","0.005","75.758","0.005","72.92","0.005","70.938","0.005","4681","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C59 H70 N19 O54 P W11 Zn2.5 -","- C59 H62 N19 O54 P W11 Zn2.5 -","- C118 H124 N38 O108 P2 W22 Zn5 -","2","1","","Song, Bai-Qiao; Wang, Xin-Long; Liang, Jun; Zhang, Yu-Teng; Shao, Kui-Zhan; Su, Zhong-Min","Two hybrid materials assembled from transition metal mono-substituted Keggin polyoxoanions as photocatalysts under visible light","CrystEngComm","2014","16","39","9163","","10.1039/C4CE01148A","","","0.71069","MoKα","","0.0843","0.0465","","","0.0829","0.0966","","","","","","0.99","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217231","15.078","0.005","15.311","0.005","22.73","0.005","76.136","0.005","72.873","0.005","70.769","0.005","4675","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C59 H70 Co2.5 N19 O54 P W11 -","- C59 H60 Co2.5 N19 O53 P W11 -","- C118 H120 Co5 N38 O106 P2 W22 -","2","1","","Song, Bai-Qiao; Wang, Xin-Long; Liang, Jun; Zhang, Yu-Teng; Shao, Kui-Zhan; Su, Zhong-Min","Two hybrid materials assembled from transition metal mono-substituted Keggin polyoxoanions as photocatalysts under visible light","CrystEngComm","2014","16","39","9163","","10.1039/C4CE01148A","","","0.71069","MoKα","","0.0675","0.0465","","","0.1101","0.1227","","","","","","1.015","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217251","17.297","0.002","30.446","0.004","14.7303","0.0019","90","","90","","90","","7757.3","1.7","150","2","150","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C20 H17 N3 Ni O6 -","- C20 H17 N3 Ni O6 -","- C320 H272 N48 Ni16 O96 -","16","1","","Liu, Shuang-De; Kuo, Bing-Chiuan; Liu, Yen-Wen; Lee, Jing-Yi; Wong, Kwun Yip; Lee, Hon Man","Tuning of net architectures of Ni(ii) and Zn(ii) coordination polymers using isomeric organic linkers","CrystEngComm","2014","16","37","8874","","10.1039/C4CE01072H","","x-ray","0.71073","MoKα","","0.0733","0.0684","","","0.1784","0.1824","","","","","","1.165","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217252","11.723","0.002","22.957","0.006","31.011","0.011","90","","90","","90","","8346","4","150","2","150","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C40 H28 N6 Ni2 O9 -","- C40 H28 N6 Ni2 O9 -","- C320 H224 N48 Ni16 O72 -","8","0.5","","Liu, Shuang-De; Kuo, Bing-Chiuan; Liu, Yen-Wen; Lee, Jing-Yi; Wong, Kwun Yip; Lee, Hon Man","Tuning of net architectures of Ni(ii) and Zn(ii) coordination polymers using isomeric organic linkers","CrystEngComm","2014","16","37","8874","","10.1039/C4CE01072H","","x-ray","0.71073","MoKα","","0.046","0.0432","","","0.1066","0.1076","","","","","","1.142","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217253","10.4229","0.0005","10.5611","0.0006","12.2119","0.0006","114.782","0.003","109.889","0.004","96.087","0.003","1097.92","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H16 N3 O7 Zn2 -","- C24 H16 N3 O7 Zn2 -","- C48 H32 N6 O14 Zn4 -","2","1","","Liu, Shuang-De; Kuo, Bing-Chiuan; Liu, Yen-Wen; Lee, Jing-Yi; Wong, Kwun Yip; Lee, Hon Man","Tuning of net architectures of Ni(ii) and Zn(ii) coordination polymers using isomeric organic linkers","CrystEngComm","2014","16","37","8874","","10.1039/C4CE01072H","","x-ray","0.71073","MoKα","","0.0583","0.0537","","","0.1472","0.1533","","","","","","1.106","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217254","7.5106","0.0002","31.1959","0.0007","10.5537","0.0003","90","","118.658","0.002","90","","2169.82","0.11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H15 N3 O9 Zn2 -","- C22 H15 N3 O9 Zn2 -","- C88 H60 N12 O36 Zn8 -","4","1","","Liu, Shuang-De; Kuo, Bing-Chiuan; Liu, Yen-Wen; Lee, Jing-Yi; Wong, Kwun Yip; Lee, Hon Man","Tuning of net architectures of Ni(ii) and Zn(ii) coordination polymers using isomeric organic linkers","CrystEngComm","2014","16","37","8874","","10.1039/C4CE01072H","","x-ray","0.71073","MoKα","","0.0867","0.0774","","","0.213","0.2229","","","","","","1.198","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217255","7.2889","0.0004","9.7098","0.0005","13.6547","0.0007","95.558","0.001","90.979","0.001","93.688","0.001","959.59","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H17 N3 O8 Zn -","- C21 H15 N3 O8 Zn -","- C42 H30 N6 O16 Zn2 -","2","1","","Liu, Shuang-De; Kuo, Bing-Chiuan; Liu, Yen-Wen; Lee, Jing-Yi; Wong, Kwun Yip; Lee, Hon Man","Tuning of net architectures of Ni(ii) and Zn(ii) coordination polymers using isomeric organic linkers","CrystEngComm","2014","16","37","8874","","10.1039/C4CE01072H","","x-ray","0.71073","MoKα","","0.1166","0.0788","","","0.203","0.2498","","","","","","1.025","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217256","20.233","0.004","10.901","0.002","20.355","0.004","90","","115.467","0.01","90","","4053.3","1.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H28 N6 O15 Zn4 -","- C42 H26 N6 O15 Zn4 -","- C168 H104 N24 O60 Zn16 -","4","0.5","","Liu, Shuang-De; Kuo, Bing-Chiuan; Liu, Yen-Wen; Lee, Jing-Yi; Wong, Kwun Yip; Lee, Hon Man","Tuning of net architectures of Ni(ii) and Zn(ii) coordination polymers using isomeric organic linkers","CrystEngComm","2014","16","37","8874","","10.1039/C4CE01072H","","x-ray","0.71073","MoKα","","0.0906","0.0842","","","0.2378","0.2432","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217257","14.2985","0.0004","12.5882","0.0003","14.4371","0.0004","90","","112.007","0.001","90","","2409.23","0.11","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Co N4 O10 -","- C20 H22 Co N4 O10 -","- C80 H88 Co4 N16 O40 -","4","1","","Maity, Dilip Kumar; Bhattacharya, Biswajit; Mondal, Rajarshi; Ghoshal, Debajyoti","Five diverse bivalent metal coordination polymers based on benzene dicarboxylate and bent dipyridyl ligands: syntheses, structures, and photoluminescent properties","CrystEngComm","2014","16","37","8896","","10.1039/C4CE00966E","","","0.71073","MoKα","","0.0565","0.0424","","","0.124","0.1347","","","","","","1.057","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217258","6.728","0.0002","8.6182","0.0002","10.0558","0.0003","97.302","0.001","97.195","0.001","92.055","0.001","572.99","0.03","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Co N4 O6 -","- C22 H22 Co N4 O6 -","- C22 H22 Co N4 O6 -","1","0.5","","Maity, Dilip Kumar; Bhattacharya, Biswajit; Mondal, Rajarshi; Ghoshal, Debajyoti","Five diverse bivalent metal coordination polymers based on benzene dicarboxylate and bent dipyridyl ligands: syntheses, structures, and photoluminescent properties","CrystEngComm","2014","16","37","8896","","10.1039/C4CE00966E","","","0.71073","MoKα","","0.0305","0.0295","","","0.0852","0.0861","","","","","","1.079","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217259","19.004","0.0004","6.6043","0.0001","15.8025","0.0004","90","","111.595","0.002","90","","1844.13","0.07","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H14 N4 O4 Zn -","- C20 H14 N4 O4 Zn -","- C80 H56 N16 O16 Zn4 -","4","0.5","","Maity, Dilip Kumar; Bhattacharya, Biswajit; Mondal, Rajarshi; Ghoshal, Debajyoti","Five diverse bivalent metal coordination polymers based on benzene dicarboxylate and bent dipyridyl ligands: syntheses, structures, and photoluminescent properties","CrystEngComm","2014","16","37","8896","","10.1039/C4CE00966E","","","0.71073","MoKα","","0.0364","0.0316","","","0.0879","0.0907","","","","","","1.091","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217260","10.088","0.005","12.001","0.005","12.044","0.005","84.583","0.005","67.262","0.005","82.802","0.005","1332.5","1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H25 N6 O4 Zn -","- C29 H25 N6 O4 Zn -","- C58 H50 N12 O8 Zn2 -","2","1","","Maity, Dilip Kumar; Bhattacharya, Biswajit; Mondal, Rajarshi; Ghoshal, Debajyoti","Five diverse bivalent metal coordination polymers based on benzene dicarboxylate and bent dipyridyl ligands: syntheses, structures, and photoluminescent properties","CrystEngComm","2014","16","37","8896","","10.1039/C4CE00966E","","","0.71073","MoKα","","0.0564","0.0396","","","0.0882","0.0947","","","","","","1.046","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217261","15.976","0.005","6.097","0.005","20.824","0.005","90","0.005","100.578","0.005","90","0.005","1993.9","1.8","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Cd N4 O5 -","- C20 H16 Cd N4 O5 -","- C80 H64 Cd4 N16 O20 -","4","0.5","","Maity, Dilip Kumar; Bhattacharya, Biswajit; Mondal, Rajarshi; Ghoshal, Debajyoti","Five diverse bivalent metal coordination polymers based on benzene dicarboxylate and bent dipyridyl ligands: syntheses, structures, and photoluminescent properties","CrystEngComm","2014","16","37","8896","","10.1039/C4CE00966E","","","0.71073","MoKα","","0.0299","0.0258","","","0.0556","0.0574","","","","","","1.043","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217262","13.296","0.001","20.271","0.002","18.723","0.001","90","","114.535","0.003","90","","4590.6","0.6","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H44 Cl4 O5 P2 Zn2 -","- C44 H42 Cl4 O5 P2 Zn2 -","- C176 H168 Cl16 O20 P8 Zn8 -","4","1","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.201","0.0868","","","0.1801","0.2413","","","","","","1.027","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217263","19.851","0.001","19.805","0.001","12.606","0.001","90","","105.37","0.003","90","","4778.8","0.5","296","2","296","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C84 H88 Cd2 Cl8 Cu2 O14 P4 -","- C84 H88 Cd2 Cl8 Cu2 O14 P4 -","- C168 H176 Cd4 Cl16 Cu4 O28 P8 -","2","0.25","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.1684","0.0392","","","0.0699","0.0985","","","","","","0.845","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217264","13.439","0.004","12.495","0.004","21.984","0.005","90","","90.006","0.005","90","","3691.6","1.8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H44 Cl2 Hg O6 P2 -","- C36 H44 Cl2 Hg O6 P2 -","- C144 H176 Cl8 Hg4 O24 P8 -","4","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0495","0.0413","","","0.0798","0.0825","","","","","","1.132","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217265","18.38","0.01","12.946","0.007","18.556","0.01","90","","97.26","0.01","90","","4380","4","198","2","198","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 Cd Cl2 O8 P2 -","- C44 H50 Cd Cl2 O8 P2 -","- C176 H200 Cd4 Cl8 O32 P8 -","4","1","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.1267","0.0702","","","0.1691","0.1924","","","","","","0.943","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217266","19.11","0.002","19.11","0.002","17.309","0.002","90","","90","","90","","6321.1","1.2","150","2","150","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","","- C64 H66 Cd Cl4 O8 P4 -","- C64 H66 Cd Cl4 O8 P4 -","- C256 H264 Cd4 Cl16 O32 P16 -","4","0.25","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0463","0.0332","","","0.0616","0.0648","","","","","","0.931","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217267","9.565","0.001","9.761","0.001","23.907","0.003","90","","91.139","0.002","90","","2231.6","0.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H23 Cl2 O3 P Zn -","- C22 H23 Cl2 O3 P Zn -","- C88 H92 Cl8 O12 P4 Zn4 -","4","1","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0316","0.0268","","","0.0705","0.0729","","","","","","1.047","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217268","9.822","0.001","9.894","0.001","12.303","0.001","76.679","0.001","80.871","0.001","76.246","0.001","1123.22","0.19","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H42 Cl4 Hg2 O4 P2 -","- C44 H42 Cl4 Hg2 O4 P2 -","- C44 H42 Cl4 Hg2 O4 P2 -","1","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0233","0.0204","","","0.0491","0.0506","","","","","","1.007","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217269","18.129","0.003","12.883","0.002","18.871","0.003","90","","98.154","0.002","90","","4362.9","1.2","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C44 H46 Cl2 O6 P2 Zn -","- C44 H46 Cl2 O6 P2 Zn -","- C176 H184 Cl8 O24 P8 Zn4 -","4","2","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.1553","0.0551","","","0.1185","0.1443","","","","","","0.829","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217270","13.1156","0.0004","14.2632","0.0004","14.7819","0.0004","95.833","0.001","101.823","0.001","115.618","0.001","2383.17","0.12","198","2","198","2","","","","","","","","7","P -1","-P 1","2","","","","- C84 H100 Cd2 Cl8 O20 P4 Zn2 -","- C84 H76 Cd2 Cl8 O8 P4 Zn2 -","- C84 H76 Cd2 Cl8 O8 P4 Zn2 -","1","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0623","0.0421","","","0.1187","0.124","","","","","","0.972","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217271","13.1245","0.0005","17.9402","0.0006","18.6539","0.0007","90","","90","","90","","4392.2","0.3","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C42 H52 Cl2 O11 P2 Zn -","- C42 H52 Cl2 O11 P2 Zn -","- C168 H208 Cl8 O44 P8 Zn4 -","4","1","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0322","0.0279","","","0.0694","0.0715","","","","","","1.036","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217272","9.991","0.003","10.612","0.003","24.958","0.006","90","","104.45","0.009","90","","2562.5","1.2","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C54 H50 Cd Cl2 O6 P2 -","- C54 H46 Cd Cl2 O6.01 P2 -","- C108 H92 Cd2 Cl4 O12.02 P4 -","2","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0584","0.0471","","","0.1583","0.1653","","","","","","1.162","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217273","12.296","0.001","15.163","0.002","16.486","0.002","91.587","0.001","95.492","0.001","104.08","0.001","2963.6","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C126 H124 Cl2 Cu2 O21 P4 -","- C126 H120 Cl2 Cu2 O21 P4 -","- C126 H120 Cl2 Cu2 O21 P4 -","1","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0906","0.0554","","","0.1393","0.1525","","","","","","0.985","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217274","13.451","0.002","12.557","0.002","22.015","0.003","90","","90.216","0.002","90","","3718.4","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H44 Cl2 O6 P2 Zn -","- C36 H44 Cl2 O6 P2 Zn -","- C144 H176 Cl8 O24 P8 Zn4 -","4","0.5","","Galkina, Irina; Tufatullin, Artem; Krivolapov, Dmitry; Bakhtiyarova, Yuliya; Chubukaeva, Dinara; Stakheev, Vitaly; Galkin, Vladimir; Cherkasov, Rafael; Büchner, Bernd; Kataeva, Olga","Crystal structure of phosphonium carboxylate complexes. The role of the metal coordination geometry, ligand conformation and hydrogen bonding","CrystEngComm","2014","16","38","9010","","10.1039/C4CE01361A","","","0.71073","MoKα","","0.0472","0.0421","","","0.1226","0.1264","","","","","","1.006","","","","has coordinates,has disorder","180503","2020-10-21","18:00:00",""
"7217298","9.0285","0.0015","12.877","0.002","17.446","0.003","90","","119.823","0.007","90","","1759.7","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 Cl2 N2 Ru -","- C17 H20 Cl2 N2 Ru -","- C68 H80 Cl8 N8 Ru4 -","4","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.0959","0.0912","","","0.1606","0.1622","","","","","","1.41","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217299","10.1443","0.0017","18.539","0.003","11.6609","0.0015","90","","122.58","0.01","90","","1847.9","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Cl2 N2 O0 Ru -","- C18 H22 Cl2 N2 Ru -","- C72 H88 Cl8 N8 Ru4 -","4","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.0588","0.0537","","","0.15","0.1577","","","","","","1.334","","","","has coordinates","180503","2020-10-21","18:00:00",""
"7217300","9.24","0.002","21.764","0.005","9.576","0.002","90","","102.591","0.004","90","","1879.4","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H23 Cl2 N O2 Ru -","- C18 H23 Cl2 N O2 Ru -","- C72 H92 Cl8 N4 O8 Ru4 -","4","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.0856","0.0827","","","0.1395","0.1405","","","","","","1.363","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217301","7.8773","0.0016","9.0893","0.0019","14.82","0.003","87.187","0.004","83.837","0.003","70.569","0.003","994.8","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H23 Cl2 N O2 Ru -","- C18 H23 Cl2 N O2 Ru -","- C36 H46 Cl4 N2 O4 Ru2 -","2","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.0556","0.0544","","","0.1615","0.1662","","","","","","1.427","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217302","9.7344","0.0014","13.158","0.002","16.451","0.002","97.681","0.003","92.007","0.003","106.116","0.003","2000.4","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H25 Cl2 N O2 Ru -","- C19 H25 Cl2 N O2 Ru -","- C76 H100 Cl8 N4 O8 Ru4 -","4","2","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.1103","0.0998","","","0.2314","0.2391","","","","","","1.297","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217303","7.8252","0.0017","9.227","0.002","17.196","0.004","77.288","0.004","80.06","0.004","69.45","0.004","1127.9","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H29 Cl2 N O2 Ru -","- C21 H29 Cl2 N O2 Ru -","- C42 H58 Cl4 N2 O4 Ru2 -","2","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.0703","0.0686","","","0.1596","0.1677","","","","","","1.286","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217304","13.381","0.0014","8.933","0.0009","13.2711","0.0013","90","","95.693","0.002","90","","1578.5","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Cl2 N O2 Ru -","- C15 H17 Cl2 N O2 Ru -","- C60 H68 Cl8 N4 O8 Ru4 -","4","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.1451","0.1411","","","0.2543","0.2562","","","","","","1.441","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217305","6.6232","0.0008","8.5047","0.001","16.752","0.002","101.87","0.002","96.297","0.003","98.447","0.002","903.83","0.19","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H21 Cl2 N O2 Ru -","- C17 H21 Cl2 N O2 Ru -","- C34 H42 Cl4 N2 O4 Ru2 -","2","1","","Cheng, Bao; Tehrani, Alireza Azhdari; Hu, Mao-Lin; Morsali, Ali","Supramolecular assemblies of Ru(ii) organometallic half-sandwich complexes","CrystEngComm","2014","16","38","9125","","10.1039/C4CE01214C","","","0.71073","MoKα","","0.1424","0.1364","","","0.2832","0.2899","","","","","","1.334","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217306","8.351","0.003","44.438","0.017","11.41","0.004","90","","98.532","0.005","90","","4187","3","120.15","","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cabazitaxel","","- C45 H57 N O14 -","- C45 H57 N O14 -","- C180 H228 N4 O56 -","4","2","","Baisch, U.; Vella-Zarb, L.","Towards understanding P-gp resistance: a case study of the antitumour drug cabazitaxel","CrystEngComm","2014","16","44","10161","","10.1039/C4CE01279H","","x-ray","0.6889","","","0.1306","0.0989","","","0.2557","0.276","","","","","","1.051","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217307","8.506","0.005","45.16","0.02","11.675","0.006","90","","98.362","0.004","90","","4437","4","120.15","","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cabazitaxel hemihydrate","","- C45 H57.5 N O14.25 -","- C45 H57.5 N O14.25 -","- C180 H230 N4 O57 -","4","2","","Baisch, U.; Vella-Zarb, L.","Towards understanding P-gp resistance: a case study of the antitumour drug cabazitaxel","CrystEngComm","2014","16","44","10161","","10.1039/C4CE01279H","","x-ray","0.6889","","","0.1349","0.1002","","","0.2622","0.2838","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217308","12.542","0.002","8.6716","0.0016","42.09","0.008","90","","89.987","0.002","90","","4577.7","1.4","120.15","","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cabazitaxel ethanol solvate hemihydrate","","- C47 H63 N O15.5 -","- C47 H63 N O15.5 -","- C188 H252 N4 O62 -","4","2","","Baisch, U.; Vella-Zarb, L.","Towards understanding P-gp resistance: a case study of the antitumour drug cabazitaxel","CrystEngComm","2014","16","44","10161","","10.1039/C4CE01279H","","x-ray","0.6889","","","0.0575","0.0549","","","0.143","0.1456","","","","","","1.101","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7217309","11.778","0.005","17.208","0.007","12.339","0.005","90","","109.747","0.005","90","","2353.8","1.7","120.15","","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cabazitaxel tetrahydrofurane solvate","","- C45 H57 N O14 -","- C48.5 H64.02 N O15 -","- C97 H128.04 N2 O30 -","2","1","","Baisch, U.; Vella-Zarb, L.","Towards understanding P-gp resistance: a case study of the antitumour drug cabazitaxel","CrystEngComm","2014","16","44","10161","","10.1039/C4CE01279H","","x-ray","0.6889","","","0.1093","0.0869","","","0.1698","0.1789","","","","","","1.126","","","","has coordinates,has disorder","180504","2020-10-21","18:00:00",""
"7217310","11.725","0.002","17.328","0.003","12.449","0.002","90","","110.453","0.002","90","","2369.8","0.7","120.15","","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cabazitaxel Acetone Solvate","","- C48 H63 N O15 -","- C48 H63 N O15 -","- C96 H126 N2 O30 -","2","1","","Baisch, U.; Vella-Zarb, L.","Towards understanding P-gp resistance: a case study of the antitumour drug cabazitaxel","CrystEngComm","2014","16","44","10161","","10.1039/C4CE01279H","","x-ray","0.6889","","","0.0334","0.0317","","","0.0805","0.0817","","","","","","1.032","","","","has coordinates,has disorder","180504","2020-10-21","18:00:00",""
"7217320","14.8105","0.0006","10.1034","0.0006","6.8817","0.0003","90","","90","","90","","1029.75","0.09","293","","293","","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C6 H8 Cu2 I2 N2 -","- C6 H8 Cu2 I2 N2 -","- C24 H32 Cu8 I8 N8 -","4","0.5","","Kitada, Nobuo; Ishida, Takayuki","Polymeric one- and two-dimensional copper(i) iodide complexes showing photoluminescence tunable by azaaromatic ligands","CrystEngComm","2014","16","34","8035","","10.1039/C4CE01231C","","","0.71073","MoKα","","","0.0307","","","","0.0549","","","","","","1.052","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217321","4.2971","0.0012","8.22","0.003","8.247","0.003","110.85","0.03","102.04","0.03","94.82","0.03","262.22","0.17","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H8 Cu2 I2 N2 -","- C6 H8 Cu2 I2 N2 -","- C6 H8 Cu2 I2 N2 -","1","0.5","","Kitada, Nobuo; Ishida, Takayuki","Polymeric one- and two-dimensional copper(i) iodide complexes showing photoluminescence tunable by azaaromatic ligands","CrystEngComm","2014","16","34","8035","","10.1039/C4CE01231C","","","0.71073","MoKα","","","0.059","","","","0.0786","","","","","","1.034","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217322","4.1718","0.0002","27.4616","0.0014","7.6232","0.0006","90","","97.299","0.003","90","","866.27","0.09","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 Cu I N2 -","- C6 H8 Cu I N2 -","- C24 H32 Cu4 I4 N8 -","4","1","","Kitada, Nobuo; Ishida, Takayuki","Polymeric one- and two-dimensional copper(i) iodide complexes showing photoluminescence tunable by azaaromatic ligands","CrystEngComm","2014","16","34","8035","","10.1039/C4CE01231C","","","0.71073","MoKα","","","0.0683","","","","0.1122","","","","","","1.473","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217323","14.102","0.005","15.392","0.006","8.233","0.003","90","","97.833","0.018","90","","1770.4","1.1","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H9 Cu I N -","- C7 H9 Cu I N -","- C56 H72 Cu8 I8 N8 -","8","1","","Kitada, Nobuo; Ishida, Takayuki","Polymeric one- and two-dimensional copper(i) iodide complexes showing photoluminescence tunable by azaaromatic ligands","CrystEngComm","2014","16","34","8035","","10.1039/C4CE01231C","","","0.71073","MoKα","","","0.0352","","","","0.0607","","","","","","1.034","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217324","7.54","0.0015","26.67","0.005","8.2","0.002","90","","97.002","0.018","90","","1636.7","0.6","294","2","294","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 Cl4 Hg N6 -","- C10 H10 Cl4 Hg N6 -","- C40 H40 Cl16 Hg4 N24 -","4","1","","Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio","Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions","CrystEngComm","2014","16","38","9043","","10.1039/C4CE01425A","","x-ray","0.71073","MoKα","","0.1012","0.0588","","","0.1529","0.1692","","","","","","1.018","","","","has coordinates,has disorder","180504","2020-10-21","18:00:00",""
"7217325","7.303","0.0018","8.599","0.002","21.577","0.009","90","","94.32","0.03","90","","1351.2","0.7","294","2","294","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Cl2 N6 O -","- C10 H12 Cl2 N6 O -","- C40 H48 Cl8 N24 O4 -","4","1","","Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio","Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions","CrystEngComm","2014","16","38","9043","","10.1039/C4CE01425A","","x-ray","0.71073","MoKα","","0.1098","0.0476","","","0.1032","0.1225","","","","","","1.02","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217326","7.478","0.002","26.697","0.005","8.27","0.003","90","","96.55","0.02","90","","1640.2","0.8","294","2","294","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 Cd Cl4 N6 -","- C10 H10 Cd Cl4 N6 -","- C40 H40 Cd4 Cl16 N24 -","4","1","","Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio","Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions","CrystEngComm","2014","16","38","9043","","10.1039/C4CE01425A","","x-ray","0.71073","MoKα","","0.0771","0.0418","","","0.0949","0.1071","","","","","","1.071","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217327","9.5097","0.0019","11.521","0.003","14.622","0.003","90","","92.794","0.017","90","","1600.1","0.6","294","2","294","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H11 N9 O9 -","- C10 H11 N9 O9 -","- C40 H44 N36 O36 -","4","1","","Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio","Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions","CrystEngComm","2014","16","38","9043","","10.1039/C4CE01425A","","x-ray","0.71073","MoKα","","0.1031","0.0534","","","0.1291","0.1459","","","","","","1.034","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217328","11.395","0.004","14.021","0.006","10.265","0.004","90","","90","","90","","1640","1.1","294","2","294","2","","","","","","","synthesis as described","5","C c m 21","C 2c -2c","36","","","","- C10 H10 Cl4 N6 Zn -","- C10 H10 Cl4 N6 Zn -","- C40 H40 Cl16 N24 Zn4 -","4","0.5","","Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio","Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions","CrystEngComm","2014","16","38","9043","","10.1039/C4CE01425A","","x-ray","0.71073","MoKα","","0.0582","0.042","","","0.087","0.0923","","","","","","0.996","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217376","17.145","0.003","14.709","0.0018","7.0193","0.0011","90","","93.319","0.015","90","","1767.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H21 N4 O2 P S2 -","- C12 H21 N4 O2 P S2 -","- C48 H84 N16 O8 P4 S8 -","4","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.1369","0.1307","","","0.3356","0.3384","","","","","","1.179","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217380","9.0052","0.0008","11.7572","0.001","12.3225","0.0011","98.558","0.007","106.445","0.007","97.06","0.007","1218.5","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H23 Cl2 N4 O3 P S2 -","- C19 H23 Cl2 N4 O3 P S2 -","- C38 H46 Cl4 N8 O6 P2 S4 -","2","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Bolte, Michael; Garcia, Yann","N-Salicylidene aniline derivatives based on the N′-thiophosphorylated thiourea scaffold","CrystEngComm","2014","16","30","7053","","10.1039/C4CE00598H","","","0.71073","MoKα","","0.0598","0.0468","","","0.1065","0.1118","","","","","","1.078","","","","has coordinates,has disorder","180504","2020-10-21","18:00:00",""
"7217396","17.435","0.0004","13.8312","0.0003","9.7128","0.0002","90","","96.559","0.001","90","","2326.88","0.09","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H33 N3 O6 -","- C21 H33 N3 O6 -","- C84 H132 N12 O24 -","4","1","","Wang, Zijun; Lee, Joseph; Oian, Casey; Hou, Xiaodong; Wang, Zhihan; Ugrinov, Angel; Singh, Rajiv K.; Wysocki, Erin; Chu, Qianli R.","An unsaturated hydrogen bonded network generated from three-fold symmetric carbamates","CrystEngComm","2014","16","31","7176","","10.1039/C4CE00363B","","","1.54178","CuKα","","0.0338","0.0298","","","0.0768","0.0799","","","","","","1.059","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217397","21.294","0.0014","13.8436","0.001","9.823","0.0007","90","","91.467","0.004","90","","2894.7","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H45 N3 O6 -","- C27 H45 N3 O6 -","- C108 H180 N12 O24 -","4","1","","Wang, Zijun; Lee, Joseph; Oian, Casey; Hou, Xiaodong; Wang, Zhihan; Ugrinov, Angel; Singh, Rajiv K.; Wysocki, Erin; Chu, Qianli R.","An unsaturated hydrogen bonded network generated from three-fold symmetric carbamates","CrystEngComm","2014","16","31","7176","","10.1039/C4CE00363B","","","1.54178","CuKα","","0.0579","0.0487","","","0.1285","0.1336","","","","","","1.121","","","","has coordinates","180504","2020-10-21","18:00:00",""
"7217416","9.9574","0.0004","6.9766","0.0003","14.392","0.0006","90","","105.769","0.001","90","","962.17","0.07","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl2 K4 O16 U5 -","- Cl2 K4 O16 U5 -","- Cl4 K8 O32 U10 -","2","0.5","","Read, Cory Michael; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal growth, structural characterization, cation‒cation interaction classification, and optical properties of uranium(vi) containing oxychlorides, A4U5O16Cl2(A = K, Rb), Cs5U7O22Cl3, and AUO3Cl (A = Rb, Cs)","CrystEngComm","2014","16","31","7259","","10.1039/C4CE00281D","","","0.71073","MoKα","","0.0383","0.0292","","","0.0586","0.0613","","","","","","1.06","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217417","10.2164","0.0004","7.016","0.0003","14.493","0.0005","90","","103.829","0.001","90","","1008.72","0.07","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl2 O16 Rb4 U5 -","- Cl2 O16 Rb4 U5 -","- Cl4 O32 Rb8 U10 -","2","0.5","","Read, Cory Michael; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal growth, structural characterization, cation‒cation interaction classification, and optical properties of uranium(vi) containing oxychlorides, A4U5O16Cl2(A = K, Rb), Cs5U7O22Cl3, and AUO3Cl (A = Rb, Cs)","CrystEngComm","2014","16","31","7259","","10.1039/C4CE00281D","","","0.71073","MoKα","","0.0492","0.0348","","","0.0667","0.0709","","","","","","1.048","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217418","10.6214","0.0005","18.1071","0.0008","16.0857","0.0007","90","","102.985","0.001","90","","3014.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl3 Cs5 O22 U7 -","- Cl3 Cs5 O22 U7 -","- Cl12 Cs20 O88 U28 -","4","1","","Read, Cory Michael; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal growth, structural characterization, cation‒cation interaction classification, and optical properties of uranium(vi) containing oxychlorides, A4U5O16Cl2(A = K, Rb), Cs5U7O22Cl3, and AUO3Cl (A = Rb, Cs)","CrystEngComm","2014","16","31","7259","","10.1039/C4CE00281D","","","0.71073","MoKα","","0.0628","0.0409","","","0.0734","0.0808","","","","","","1.032","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217419","7.3602","0.0006","4.1127","0.0003","8.5556","0.0007","90","","104.602","0.002","90","","250.62","0.03","296","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cl O3 Rb U -","- Cl O3 Rb U -","- Cl2 O6 Rb2 U2 -","2","0.5","","Read, Cory Michael; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal growth, structural characterization, cation‒cation interaction classification, and optical properties of uranium(vi) containing oxychlorides, A4U5O16Cl2(A = K, Rb), Cs5U7O22Cl3, and AUO3Cl (A = Rb, Cs)","CrystEngComm","2014","16","31","7259","","10.1039/C4CE00281D","","","0.71073","MoKα","","0.0357","0.0316","","","0.0685","0.0699","","","","","","1.181","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217420","7.7768","0.0004","4.1245","0.0002","8.7701","0.0005","90","","105.468","0.001","90","","271.12","0.02","296","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cl Cs O3 U -","- Cl Cs O3 U -","- Cl2 Cs2 O6 U2 -","2","0.5","","Read, Cory Michael; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal growth, structural characterization, cation‒cation interaction classification, and optical properties of uranium(vi) containing oxychlorides, A4U5O16Cl2(A = K, Rb), Cs5U7O22Cl3, and AUO3Cl (A = Rb, Cs)","CrystEngComm","2014","16","31","7259","","10.1039/C4CE00281D","","","0.71073","MoKα","","0.0289","0.0256","","","0.0563","0.0575","","","","","","1.079","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217443","7.3579","0.0015","13.615","0.003","17.984","0.004","90","","101.78","0.03","90","","1763.7","0.7","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H3 Cl2 N2 S2 -","- C7 H3 Cl2 N2 S2 -","- C56 H24 Cl16 N16 S16 -","8","2","","Constantinides, Christos P.; Eisler, Dana J.; Alberola, A.; Carter, Emma; Murphy, Damien M.; Rawson, Jeremy M.","Weakening of the π*‒π* dimerisation in 1,2,3,5-dithiadiazolyl radicals: structural, EPR, magnetic and computational studies of dichlorophenyl dithiadiazolyls, Cl2C6H3CNSSN","CrystEngComm","2014","16","31","7298","","10.1039/C4CE00308J","","","0.71073","MoKα","","0.065","0.0432","","","0.079","0.0865","","","","","","1.061","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217444","15.057","0.003","7.2462","0.0014","15.986","0.003","90","","91.32","0.03","90","","1743.7","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H3 Cl2 N2 S2 -","- C7 H3 Cl2 N2 S2 -","- C56 H24 Cl16 N16 S16 -","8","4","","Constantinides, Christos P.; Eisler, Dana J.; Alberola, A.; Carter, Emma; Murphy, Damien M.; Rawson, Jeremy M.","Weakening of the π*‒π* dimerisation in 1,2,3,5-dithiadiazolyl radicals: structural, EPR, magnetic and computational studies of dichlorophenyl dithiadiazolyls, Cl2C6H3CNSSN","CrystEngComm","2014","16","31","7298","","10.1039/C4CE00308J","","","0.71073","MoKα","","0.0874","0.0556","","","0.1157","0.131","","","","","","1.115","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217445","7.3271","0.0002","10.3563","0.0003","24.6666","0.0007","88.096","0.002","81.458","0.002","77.009","0.001","1803.6","0.09","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H3 Cl2 N2 S2 -","- C7 H3 Cl2 N2 S2 -","- C56 H24 Cl16 N16 S16 -","8","4","","Constantinides, Christos P.; Eisler, Dana J.; Alberola, A.; Carter, Emma; Murphy, Damien M.; Rawson, Jeremy M.","Weakening of the π*‒π* dimerisation in 1,2,3,5-dithiadiazolyl radicals: structural, EPR, magnetic and computational studies of dichlorophenyl dithiadiazolyls, Cl2C6H3CNSSN","CrystEngComm","2014","16","31","7298","","10.1039/C4CE00308J","","","0.71073","MoKα","","0.071","0.0491","","","0.1003","0.1119","","","","","","1.05","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217446","7.2196","0.0004","11.8203","0.0006","20.893","0.001","90","","97.366","0.002","90","","1768.25","0.16","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H3 Cl2 N2 S2 -","- C7 H3 Cl2 N2 S2 -","- C56 H24 Cl16 N16 S16 -","8","2","","Constantinides, Christos P.; Eisler, Dana J.; Alberola, A.; Carter, Emma; Murphy, Damien M.; Rawson, Jeremy M.","Weakening of the π*‒π* dimerisation in 1,2,3,5-dithiadiazolyl radicals: structural, EPR, magnetic and computational studies of dichlorophenyl dithiadiazolyls, Cl2C6H3CNSSN","CrystEngComm","2014","16","31","7298","","10.1039/C4CE00308J","","","0.71073","MoKα","","0.0624","0.0476","","","0.121","0.1289","","","","","","1.057","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217447","7.2604","0.0015","20.872","0.004","36.565","0.007","98.49","0.03","95.63","0.03","95.1","0.03","5424","2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H3 Cl2 N2 S2 -","- C7 H3 Cl2 N2 S2 -","- C168 H72 Cl48 N48 S48 -","24","12","","Constantinides, Christos P.; Eisler, Dana J.; Alberola, A.; Carter, Emma; Murphy, Damien M.; Rawson, Jeremy M.","Weakening of the π*‒π* dimerisation in 1,2,3,5-dithiadiazolyl radicals: structural, EPR, magnetic and computational studies of dichlorophenyl dithiadiazolyls, Cl2C6H3CNSSN","CrystEngComm","2014","16","31","7298","","10.1039/C4CE00308J","","","0.71073","MoKα","","0.1763","0.1437","","","0.2447","0.2565","","","","","","1.324","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217450","24.1816","0.0006","10.4269","0.0003","11.7456","0.0003","90","","90","","90","","2961.53","0.14","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C35 H36 Cl2 N4 O -","- C35 H36 Cl2 N4 O -","- C140 H144 Cl8 N16 O4 -","4","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","1.54178","CuKα","","0.0553","0.0399","","","0.0911","0.0999","","","","","","0.94","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217451","6.3103","0.0002","10.254","0.0003","10.7089","0.0003","83.053","0.001","77.266","0.002","80.846","0.001","664.62","0.03","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C30 H24 Br2 Cl2 N4 -","- C30 H24 Br2 Cl2 N4 -","- C30 H24 Br2 Cl2 N4 -","1","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","1.54178","CuKα","","0.0319","0.0316","","","0.093","0.0934","","","","","","1.11","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7217452","6.0409","0.0002","8.0224","0.0003","27.0534","0.001","90","","90","","90","","1311.08","0.08","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16.36 H16.07 Cl0.64 N2 -","- C16.356 H16.068 Cl0.644 N2 -","- C65.424 H64.272 Cl2.576 N8 -","4","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","1.54178","CuKα","","0.0418","0.0376","","","0.0898","0.0914","","","","","","1.191","","","","has coordinates,has disorder","180505","2020-10-21","18:00:00",""
"7217453","6.3568","0.0004","10.4138","0.0007","10.7105","0.0007","82.302","0.004","75.969","0.003","82.058","0.003","677.53","0.08","120","2","120","2","","","","","","","","4","P 1","P 1","1","","","","- C31.23 H27.68 Br2.74 N4 -","- C31.226 H27.678 Br2.736 N4 -","- C31.226 H27.678 Br2.736 N4 -","1","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","0.71073","MoKα","","0.0434","0.0376","","","0.0934","0.096","","","","","","1.027","","","","has coordinates,has disorder","180505","2020-10-21","18:00:00",""
"7217454","7.8192","0.0002","9.8988","0.0003","18.2061","0.0005","78.154","0.002","79.977","0.002","72.633","0.001","1306.65","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H12 Cl2 N2 -","- C15 H12 Cl2 N2 -","- C60 H48 Cl8 N8 -","4","2","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","0.71073","MoKα","","0.0296","0.0243","","","0.0591","0.0623","","","","","","1.046","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217455","6.0853","0.0005","13.6203","0.0014","16.017","0.002","90","","92.009","0.009","90","","1326.7","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 Cl2 N2 -","- C15 H12 Cl2 N2 -","- C60 H48 Cl8 N8 -","4","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","0.71073","MoKα","","0.0641","0.0406","","","0.0918","0.1026","","","","","","1.051","","","","has coordinates,has disorder","180505","2020-10-21","18:00:00",""
"7217456","8.4113","0.0001","9.0495","0.0001","25.1456","0.0003","90","","90","","90","","1914.03","0.04","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 Br2 Cl4 N2 -","- C16 H14 Br2 Cl4 N2 -","- C64 H56 Br8 Cl16 N8 -","4","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","1.54178","CuKα","","0.028","0.0278","","","0.094","0.094","","","","","","1.222","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217457","5.7702","0.0001","15.3388","0.0002","13.9156","0.0002","90","","94.316","0.001","90","","1228.15","0.03","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Cl2 N2 -","- C14 H10 Cl2 N2 -","- C56 H40 Cl8 N8 -","4","1","","Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.","Tröger's base quasiracemates and crystal packing tendencies","CrystEngComm","2014","16","31","7251","","10.1039/C4CE00323C","","","1.54178","CuKα","","0.0518","0.0382","","","0.0958","0.1035","","","","","","1.052","","","","has coordinates","180505","2020-10-21","18:00:00",""
"7217600","11.7903","0.0015","9.314","0.0013","14.652","0.002","90","","94.385","0.002","90","","1604.3","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16.6 Co N2 O7.3 P2 -","- C12 H16 Co N2 O7.3 P2 -","- C48 H64 Co4 N8 O29.2 P8 -","4","1","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0508","0.039","","","0.0941","0.1018","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217601","17.119","0.002","8.9053","0.0012","12.389","0.0017","90","","124.674","0.002","90","","1553.3","0.4","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 N2 Ni O8 P2 -","- C12 H18 N2 Ni O8 P2 -","- C48 H72 N8 Ni4 O32 P8 -","4","0.5","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0353","0.0319","","","0.0831","0.0851","","","","","","1.064","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217602","23.7747","0.0014","23.7747","0.0014","28.216","0.004","90","","90","","120","","13812","2","296","2","296","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C28 H30 N4 Ni O8 P2 -","- C28 H30 N4 Ni O8 P2 -","- C504 H540 N72 Ni18 O144 P36 -","18","1","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.1272","0.0666","","","0.1512","0.1891","","","","","","1.013","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217603","10.3111","0.0016","10.7447","0.0017","11.805","0.002","71.192","0.004","65.659","0.004","83.226","0.004","1127.8","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H24 N2 Ni O9 P2 -","- C18 H24 N2 Ni O9 P2 -","- C36 H48 N4 Ni2 O18 P4 -","2","1","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.1078","0.0586","","","0.115","0.1341","","","","","","0.973","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217604","10.3161","0.0014","11.508","0.003","12.0717","0.0016","105.48","0.003","109.935","0.002","101.391","0.004","1230.8","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H28 N2 Ni O10 P2 -","- C20 H28 N2 Ni O10 P2 -","- C40 H56 N4 Ni2 O20 P4 -","2","1","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0879","0.0492","","","0.1002","0.1115","","","","","","0.979","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217605","16.906","0.011","8.996","0.006","12.435","0.008","90","","125.406","0.012","90","","1541.5","1.8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Cu N2 O8 P2 -","- C12 H18 Cu N2 O8 P2 -","- C48 H72 Cu4 N8 O32 P8 -","4","0.5","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0628","0.0442","","","0.1019","0.1104","","","","","","1.056","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217606","7.309","0.003","8.365","0.004","9.315","0.004","97.459","0.006","112.125","0.006","90.768","0.007","521.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H22 Cu N2 O8 P2 -","- C18 H22 Cu N2 O8 P2 -","- C18 H22 Cu N2 O8 P2 -","1","0.5","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0745","0.0519","","","0.1276","0.1352","","","","","","1.064","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217607","9.1979","0.0007","10.0023","0.0009","12.2994","0.0009","85.738","0.003","77.906","0.002","65.089","0.003","1003.37","0.14","275","2","275","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H18 N2 O6 P2 Zn -","- C18 H18 N2 O6 P2 Zn -","- C36 H36 N4 O12 P4 Zn2 -","2","1","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0752","0.0416","","","0.0817","0.0891","","","","","","1.02","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217608","17.447","0.002","8.7795","0.0011","12.845","0.003","90","","123.703","0.001","90","","1636.8","0.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Cd N2 O8 P2 -","- C12 H18 Cd N2 O8 P2 -","- C48 H72 Cd4 N8 O32 P8 -","4","0.5","","Tang, Si-Fu; Li, Liang-Jun; Wang, Chao; Zhao, Xue-Bo","Investigation of the structure variation of metal diphosphonates with the changing of N-donor auxiliary ligands and their properties","CrystEngComm","2014","16","38","9104","","10.1039/C4CE01266F","","","0.71073","MoKα","","0.0368","0.0296","","","0.0724","0.0761","","","","","","1.039","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217627","29.627","0.003","29.627","0.003","29.627","","90","","90","","90","","26005","4","293","2","293","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- C75 H38 Cu6 N6 O36 -","- C75 H39 Cu6 N6 O36 -","- C600 H312 Cu48 N48 O288 -","8","0.25","","Zheng, Baishu; Lin, Xiu; Wang, Zhaoxu; Yun, Ruirui; Fan, Yanpeng; Ding, Mingsheng; Hu, Xiaolian; Yi, Pinggui","Enhanced water stability of a microporous acylamide-functionalized metal‒organic framework via interpenetration and methyl decoration","CrystEngComm","2014","16","41","9586","","10.1039/C4CE01165A","","","0.71073","MoKα","","0.1257","0.0958","","","0.3059","0.3233","","","","","","1.199","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217628","10.4839","0.0018","11.84","0.003","14.034","0.002","105.645","0.011","101.222","0.009","112.358","0.005","1462.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H19 Fe2 N5 O9 -","- C26 H19 Fe2 N5 O9 -","- C52 H38 Fe4 N10 O18 -","2","1","","Li, Qipeng; Tian, Chongbin; Zhang, Huabin; Qian, Jinjie; Du, Shaowu","An alternative strategy to construct Fe(ii)-based MOFs with multifarious structures and magnetic behaviors","CrystEngComm","2014","16","39","9208","","10.1039/C4CE01414F","","","0.71073","MoKα","","0.043","0.0352","","","0.1121","0.1268","","","","","","1.043","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217629","10.996","0.004","10.359","0.004","7.723","0.003","90","","102.018","0.006","90","","860.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Fe N O6 -","- C7 H7 Fe N O6 -","- C28 H28 Fe4 N4 O24 -","4","1","","Li, Qipeng; Tian, Chongbin; Zhang, Huabin; Qian, Jinjie; Du, Shaowu","An alternative strategy to construct Fe(ii)-based MOFs with multifarious structures and magnetic behaviors","CrystEngComm","2014","16","39","9208","","10.1039/C4CE01414F","","","0.71073","MoKα","","0.0459","0.0381","","","0.0949","0.0975","","","","","","1.138","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217630","7.137","0.003","7.968","0.003","9.108","0.004","75.892","0.017","68.644","0.015","76.345","0.016","461.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H7 Fe N O7 -","- C7 H7 Fe N O7 -","- C14 H14 Fe2 N2 O14 -","2","1","","Li, Qipeng; Tian, Chongbin; Zhang, Huabin; Qian, Jinjie; Du, Shaowu","An alternative strategy to construct Fe(ii)-based MOFs with multifarious structures and magnetic behaviors","CrystEngComm","2014","16","39","9208","","10.1039/C4CE01414F","","","0.71073","MoKα","","0.0323","0.03","","","0.1144","0.1191","","","","","","1.065","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217631","10.1761","0.0009","5.9639","0.0005","13.3111","0.0014","90","","96.591","0.006","90","","802.5","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H4 Fe N2 O4 -","- C9 H4 Fe N2 O4 -","- C36 H16 Fe4 N8 O16 -","4","1","","Li, Qipeng; Tian, Chongbin; Zhang, Huabin; Qian, Jinjie; Du, Shaowu","An alternative strategy to construct Fe(ii)-based MOFs with multifarious structures and magnetic behaviors","CrystEngComm","2014","16","39","9208","","10.1039/C4CE01414F","","","0.71073","MoKα","","0.0442","0.0364","","","0.1064","0.1207","","","","","","0.963","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217632","9.345","0.009","6.916","0.004","14.615","0.009","90","","104.44","0.05","90","","914.7","1.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H6 Fe N2 O5 -","- C9 H6 Fe N2 O5 -","- C36 H24 Fe4 N8 O20 -","4","1","","Li, Qipeng; Tian, Chongbin; Zhang, Huabin; Qian, Jinjie; Du, Shaowu","An alternative strategy to construct Fe(ii)-based MOFs with multifarious structures and magnetic behaviors","CrystEngComm","2014","16","39","9208","","10.1039/C4CE01414F","","","0.71073","MoKα","","0.0387","0.0331","","","0.1135","0.1237","","","","","","1.05","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217633","7.292","0.003","10.07","0.004","10.272","0.004","113.983","0.003","99.683","0.001","103.652","0.005","639.4","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 Fe N O6 -","- C13 H11 Fe N O6 -","- C26 H22 Fe2 N2 O12 -","2","1","","Li, Qipeng; Tian, Chongbin; Zhang, Huabin; Qian, Jinjie; Du, Shaowu","An alternative strategy to construct Fe(ii)-based MOFs with multifarious structures and magnetic behaviors","CrystEngComm","2014","16","39","9208","","10.1039/C4CE01414F","","","0.71073","MoKα","","0.0407","0.0365","","","0.1217","0.1276","","","","","","1.04","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217645","7.702","0.0019","11.163","0.003","11.884","0.003","106.861","0.002","92.79","0.002","94.258","0.002","972.5","0.4","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H18 Cu F20 O6 -","- C44 H18 Cu F20 O6 -","- C44 H18 Cu F20 O6 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.03","0.0271","","","0.071","0.0729","","","","","","1.056","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217646","14.845","0.003","31.844","0.007","10.082","0.002","90","","111.011","0.002","90","","4449.1","1.6","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H26 Cu F20 O4 -","- C48 H26 Cu F20 O4 -","- C192 H104 Cu4 F80 O16 -","4","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.036","0.0299","","","0.0785","0.0822","","","","","","1.045","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217647","7.319","0.003","9.625","0.003","12.998","0.005","82.099","0.004","76.943","0.004","88.95","0.004","883.4","0.6","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H16 Cu F20 O4 -","- C40 H16 Cu F20 O4 -","- C40 H16 Cu F20 O4 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0368","0.0322","","","0.0816","0.0847","","","","","","1.059","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217648","9.8602","0.0012","16.961","0.002","24.948","0.003","90","","90","","90","","4172.3","0.9","100","","100","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C46 H22 Cu F20 O4 -","- C46 H22 Cu F20 O4 -","- C184 H88 Cu4 F80 O16 -","4","1","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0284","0.025","","","0.0623","0.0642","","","","","","1.019","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217649","7.7727","0.0017","12.309","0.003","12.672","0.003","65.03","0.002","85.208","0.002","79.032","0.002","1079","0.4","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C46 H22 Cu F20 O8 -","- C46 H22 Cu F20 O8 -","- C46 H22 Cu F20 O8 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0367","0.0299","","","0.0743","0.0785","","","","","","1.041","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217650","12.3918","0.0008","10.5445","0.0006","10.1291","0.0006","90","","91.106","0.001","90","","1323.28","0.14","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H6 Cu F16 O4 -","- C30 H6 Cu F16 O4 -","- C60 H12 Cu2 F32 O8 -","2","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0318","0.0272","","","0.0676","0.0699","","","","","","1.091","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217651","8.8327","0.0004","20.6413","0.001","10.515","0.0005","90","","106.655","0.001","90","","1836.65","0.15","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H18 Cu F16 O4 -","- C42 H18 Cu F16 O4 -","- C84 H36 Cu2 F32 O8 -","2","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0299","0.027","","","0.0716","0.0731","","","","","","1.047","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217652","7.728","0.002","11.089","0.003","12.681","0.004","106.688","0.003","104.543","0.003","92.432","0.003","999.9","0.5","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H22 Cu F16 O6 -","- C44 H22 Cu F16 O6 -","- C44 H22 Cu F16 O6 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0292","0.0269","","","0.0721","0.0739","","","","","","1.067","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217653","29.351","0.003","10.5754","0.0012","21.985","0.003","90","","96.857","0.001","90","","6775.3","1.4","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H16 Cu F16 O4 -","- C38 H16 Cu F16 O4 -","- C304 H128 Cu8 F128 O32 -","8","1","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0721","0.0374","","","0.0765","0.0901","","","","","","1.003","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217654","8.0572","0.0014","23.306","0.004","10.5652","0.0018","90","","105.83","0.002","90","","1908.7","0.6","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H22 Cu F16 O4 -","- C44 H22 Cu F16 O4 -","- C88 H44 Cu2 F32 O8 -","2","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.038","0.0314","","","0.0767","0.0801","","","","","","1.04","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217655","7.225","0.002","10.922","0.004","16.756","0.005","88.023","0.004","86.76","0.003","86.128","0.004","1316.5","0.7","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H10 Cu F12 O4 -","- C30 H10 Cu F12 O4 -","- C60 H20 Cu2 F24 O8 -","2","1","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0388","0.0291","","","0.0707","0.0752","","","","","","1.019","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217656","8.706","0.0014","17.782","0.003","23.038","0.004","90","","99.888","0.002","90","","3513.5","1","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H22 Cu F12 O4 -","- C42 H22 Cu F12 O4 -","- C168 H88 Cu4 F48 O16 -","4","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.056","0.0422","","","0.0999","0.1069","","","","","","1.025","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217657","7.126","0.0015","11.308","0.002","13.124","0.003","111.308","0.002","95.096","0.002","100.13","0.002","956.3","0.3","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H26 Cu F12 O6 -","- C44 H26 Cu F12 O6 -","- C44 H26 Cu F12 O6 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.033","0.0299","","","0.0802","0.0823","","","","","","1.033","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217658","7.4012","0.0005","25.6642","0.0016","17.3466","0.0011","90","","93.996","0.001","90","","3286.9","0.4","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H20 Cu F12 O4 -","- C38 H20 Cu F12 O4 -","- C152 H80 Cu4 F48 O16 -","4","1","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0595","0.0368","","","0.0902","0.1057","","","","","","1.055","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217659","7.0546","0.0011","9.8563","0.0015","16.396","0.003","73.042","0.002","88.21","0.002","71.792","0.002","1033.6","0.3","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H34 Cu F12 O4 -","- C48 H34 Cu F12 O4 -","- C48 H34 Cu F12 O4 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0333","0.0286","","","0.0734","0.0763","","","","","","1.037","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217660","7.1345","0.0005","7.3565","0.0005","12.0946","0.0008","97.506","0.001","100.942","0.001","94.594","0.001","614.31","0.07","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H14 Cu F8 O4 -","- C30 H14 Cu F8 O4 -","- C30 H14 Cu F8 O4 -","1","0.5","","Hori, Akiko; Nakajima, Kyosuke; Akimoto, Yuuki; Naganuma, Kohei; Yuge, Hidetaka","Guest-adjusted encapsulation and thermal studies of non-porous mononuclear Cu(ii) coordination complexes through electrostatic interactions induced by fluorine substitution","CrystEngComm","2014","16","37","8805","","10.1039/C4CE01243G","","","0.71073","MoKα","","0.0257","0.0244","","","0.063","0.0637","","","","","","1.049","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217661","8.8091","0.0004","9.6702","0.0004","12.4941","0.0005","93.7","0.002","97.546","0.002","101.939","0.002","1027.65","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Iressa","Gefitinib","","- C22 H24 Cl F N4 O3 -","- C22 H24 Cl F N4 O3 -","- C44 H48 Cl2 F2 N8 O6 -","2","1","","Thorat, Shridhar H.; Patwadkar, Manjusha V.; Gonnade, Rajesh G.; Vaidhyanathan, R.","Capturing a novel metastable polymorph of the anticancer drug gefitinib","CrystEngComm","2014","16","37","8638","","10.1039/C4CE01446D","","","0.71073","MoKα","","0.0297","0.0277","","","0.0718","0.0738","","","","","","1.019","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217662","7.1645","0.0002","10.8025","0.0003","14.3429","0.0004","80.302","0.001","75.662","0.001","89.267","0.001","1059.63","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Iressa","Gefitinib","","- C22 H24 Cl F N4 O3 -","- C22 H24 Cl F N4 O3 -","- C44 H48 Cl2 F2 N8 O6 -","2","1","","Thorat, Shridhar H.; Patwadkar, Manjusha V.; Gonnade, Rajesh G.; Vaidhyanathan, R.","Capturing a novel metastable polymorph of the anticancer drug gefitinib","CrystEngComm","2014","16","37","8638","","10.1039/C4CE01446D","","","1.54178","CuKα","","0.0373","0.0328","","","0.0859","0.0885","","","","","","1.109","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217665","11.734","0.005","11.967","0.005","12.461","0.005","90","","114.528","0.007","90","","1591.9","1.1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H28 Fe N13 O -","- C34 H18 Fe N13 O -","- C68 H36 Fe2 N26 O2 -","2","0.5","","Xu, Lei; Wang, Jintao; Xu, Yan; Zhang, Zaiyong; Lu, Ping; Fang, Min; Li, Shunli; Sun, Peipei; Liu, Hong-Ke","A new strategy to construct metal‒organic frameworks with ultrahigh chemical stability","CrystEngComm","2014","16","37","8656","","10.1039/C4CE01218F","","","0.71073","MoKα","","0.1353","0.0887","","","0.2326","0.2637","","","","","","1.052","","","","has coordinates,has disorder","180507","2020-10-21","18:00:00",""
"7217666","3.8884","0.0006","14.2024","0.0015","28.643","0.003","90","","90","","90","","1581.8","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H14 Cl N O -","- C23 H14 Cl N O -","- C92 H56 Cl4 N4 O4 -","4","1","","Safin, Damir A.; Bolte, Michael; Garcia, Yann","Solid-state photochromism and thermochromism of N-salicylidene pyrene derivatives","CrystEngComm","2014","16","37","8786","","10.1039/C4CE01325E","","","0.71073","MoKα","","0.0641","0.0488","","","0.1147","0.1211","","","","","","1.007","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217667","3.9311","0.0003","14.2544","0.0009","28.777","0.003","90","","90","","90","","1612.5","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H14 Br N O -","- C23 H14 Br N O -","- C92 H56 Br4 N4 O4 -","4","1","","Safin, Damir A.; Bolte, Michael; Garcia, Yann","Solid-state photochromism and thermochromism of N-salicylidene pyrene derivatives","CrystEngComm","2014","16","37","8786","","10.1039/C4CE01325E","","","0.71073","MoKα","","0.0801","0.0722","","","0.1333","0.1375","","","","","","1.117","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217668","7.874","0.0013","8.367","0.0014","13.195","0.002","91.615","0.014","103.438","0.013","90.08","0.014","845.1","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H13 Cl2 N O -","- C23 H13 Cl2 N O -","- C46 H26 Cl4 N2 O2 -","2","1","","Safin, Damir A.; Bolte, Michael; Garcia, Yann","Solid-state photochromism and thermochromism of N-salicylidene pyrene derivatives","CrystEngComm","2014","16","37","8786","","10.1039/C4CE01325E","","","0.71073","MoKα","","0.0613","0.0476","","","0.1187","0.1249","","","","","","1.048","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217669","24.1672","0.0015","4.0091","0.0002","17.5905","0.0012","90","","90","","90","","1704.32","0.18","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C23 H13 Br2 N O -","- C23 H13 Br2 N O -","- C92 H52 Br8 N4 O4 -","4","1","","Safin, Damir A.; Bolte, Michael; Garcia, Yann","Solid-state photochromism and thermochromism of N-salicylidene pyrene derivatives","CrystEngComm","2014","16","37","8786","","10.1039/C4CE01325E","","","0.71073","MoKα","","0.039","0.0348","","","0.0737","0.0752","","","","","","1.039","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217670","25.4","0.002","14.8069","0.0011","9.0424","0.0006","90","","100.146","0.006","90","","3347.6","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H17 N O2 -","- C24 H17 N O2 -","- C192 H136 N8 O16 -","8","2","","Safin, Damir A.; Bolte, Michael; Garcia, Yann","Solid-state photochromism and thermochromism of N-salicylidene pyrene derivatives","CrystEngComm","2014","16","37","8786","","10.1039/C4CE01325E","","","0.71073","MoKα","","0.1044","0.0736","","","0.1328","0.1438","","","","","","1.094","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217680","4.7556","0.0002","5.803","0.0004","39.1558","0.0019","90","","90.537","0.004","90","","1080.53","0.1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Ni O4 S4 -","- C20 H22 Ni O4 S4 -","- C40 H44 Ni2 O8 S8 -","2","0.5","","Gupta, Ajit N.; Kumar, Vinod; Singh, Vikram; Manar, Krishna K.; Drew, Michael G. B.; Singh, Nanhai","Intermolecular anagostic interactions in group 10 metal dithiocarbamates","CrystEngComm","2014","16","39","9299","","10.1039/C4CE01263A","","","0.71073","MoKα","","0.0791","0.0583","","","0.1021","0.1096","","","","","","1.092","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217681","6.264","0.0013","6.4556","0.0014","14.969","0.003","78.985","0.017","86.378","0.016","86.602","0.017","592.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H28 N2 Ni O4 S4 -","- C18 H28 N2 Ni O4 S4 -","- C18 H28 N2 Ni O4 S4 -","1","0.5","","Gupta, Ajit N.; Kumar, Vinod; Singh, Vikram; Manar, Krishna K.; Drew, Michael G. B.; Singh, Nanhai","Intermolecular anagostic interactions in group 10 metal dithiocarbamates","CrystEngComm","2014","16","39","9299","","10.1039/C4CE01263A","","","0.71073","MoKα","","0.1038","0.0564","","","0.1313","0.1591","","","","","","0.963","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217682","5.6942","0.0009","18.8463","0.0014","10.81","0.0007","90","","90.696","0.009","90","","1160","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 Ni O4 S4 -","- C22 H20 N2 Ni O4 S4 -","- C44 H40 N4 Ni2 O8 S8 -","2","0.5","","Gupta, Ajit N.; Kumar, Vinod; Singh, Vikram; Manar, Krishna K.; Drew, Michael G. B.; Singh, Nanhai","Intermolecular anagostic interactions in group 10 metal dithiocarbamates","CrystEngComm","2014","16","39","9299","","10.1039/C4CE01263A","","","0.71073","MoKα","","0.1001","0.0588","","","0.0977","0.1114","","","","","","0.982","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217683","6.503","0.006","10.171","0.009","11.709","0.01","75.41","0.08","80.37","0.08","72.19","0.08","710.1","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H26 N4 Pd S4 -","- C28 H26 N4 Pd S4 -","- C28 H26 N4 Pd S4 -","1","0.5","","Gupta, Ajit N.; Kumar, Vinod; Singh, Vikram; Manar, Krishna K.; Drew, Michael G. B.; Singh, Nanhai","Intermolecular anagostic interactions in group 10 metal dithiocarbamates","CrystEngComm","2014","16","39","9299","","10.1039/C4CE01263A","","","0.71073","MoKα","","0.1376","0.0775","","","0.1631","0.2144","","","","","","0.93","","","","has coordinates,has disorder","180507","2020-10-21","18:00:00",""
"7217684","5.7453","0.0003","19.0518","0.001","11.076","0.0007","90","","91.441","0.004","90","","1211.98","0.12","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 O4 Pt S4 -","- C22 H20 N2 O4 Pt S4 -","- C44 H40 N4 O8 Pt2 S8 -","2","0.5","","Gupta, Ajit N.; Kumar, Vinod; Singh, Vikram; Manar, Krishna K.; Drew, Michael G. B.; Singh, Nanhai","Intermolecular anagostic interactions in group 10 metal dithiocarbamates","CrystEngComm","2014","16","39","9299","","10.1039/C4CE01263A","","","0.71073","MoKα","","0.066","0.0378","","","0.059","0.0671","","","","","","0.927","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217685","18.8991","0.0014","15.5229","0.0011","9.0702","0.0007","90","","90","","90","","2660.9","0.3","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H22 Er2 N2 O16 -","- C24 H22 Er2 N2 O16 -","- C96 H88 Er8 N8 O64 -","4","1","","Fan, Liming; Fan, Weiliu; Song, Weikuo; Liu, Guangzeng; Zhang, Xiutang; Zhao, Xian","Syntheses, topologies, and luminescence of four Ln‒organic polymers constructed from aromatic tetracarboxylic acids","CrystEngComm","2014","16","39","9191","","10.1039/C4CE01139B","","","0.71073","MoKα","","0.0233","0.0228","","","0.0543","0.0546","","","","","","1.001","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217686","18.825","0.014","15.373","0.011","9.047","0.007","90","","90","","90","","2618","3","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H22 N2 O16 Yb2 -","- C24 H22 N2 O16 Yb2 -","- C96 H88 N8 O64 Yb8 -","4","1","","Fan, Liming; Fan, Weiliu; Song, Weikuo; Liu, Guangzeng; Zhang, Xiutang; Zhao, Xian","Syntheses, topologies, and luminescence of four Ln‒organic polymers constructed from aromatic tetracarboxylic acids","CrystEngComm","2014","16","39","9191","","10.1039/C4CE01139B","","","0.71073","MoKα","","0.0403","0.0376","","","0.0614","0.0621","","","","","","0.997","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217687","19.116","0.007","15.714","0.006","9.069","0.004","90","","90","","90","","2724.2","1.9","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H22 N2 O16 Sm2 -","- C24 H22 N2 O16 Sm2 -","- C96 H88 N8 O64 Sm8 -","4","1","","Fan, Liming; Fan, Weiliu; Song, Weikuo; Liu, Guangzeng; Zhang, Xiutang; Zhao, Xian","Syntheses, topologies, and luminescence of four Ln‒organic polymers constructed from aromatic tetracarboxylic acids","CrystEngComm","2014","16","39","9191","","10.1039/C4CE01139B","","","0.71073","MoKα","","0.0297","0.0282","","","0.067","0.0676","","","","","","0.998","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217688","6.4355","0.0012","13.462","0.002","13.753","0.002","61.532","0.002","82.433","0.003","81.244","0.002","1032.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H15 Gd O10 -","- C22 H15 Gd O10 -","- C44 H30 Gd2 O20 -","2","1","","Fan, Liming; Fan, Weiliu; Song, Weikuo; Liu, Guangzeng; Zhang, Xiutang; Zhao, Xian","Syntheses, topologies, and luminescence of four Ln‒organic polymers constructed from aromatic tetracarboxylic acids","CrystEngComm","2014","16","39","9191","","10.1039/C4CE01139B","","","0.71073","MoKα","","0.0217","0.0212","","","0.0608","0.0611","","","","","","1","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217689","11.8863","0.0044","15.3948","0.0059","10.5539","0.004","90","","95.0116","0.0023","90","","1923.8","1.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H24 F3 N3 O3 -","- C18 H24 F3 N3 O3 -","- C72 H96 F12 N12 O12 -","4","2","","Zehe, Christoph; Schmidt, Marko; Siegel, Renée; Kreger, Klaus; Daebel, Venita; Ganzleben, Sandra; Schmidt, Hans-Werner; Senker, Jürgen","Influence of fluorine side-group substitution on the crystal structure formation of benzene-1,3,5-trisamides","CrystEngComm","2014","16","39","9273","","10.1039/C4CE01077A","","","1.54056","CuKα1","","","","","","","","","","","","","","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217690","7.8644","0.0002","23.7196","0.0005","10.4242","0.0002","90","","96.213","0.003","90","","1933.11","0.07","176","2","176.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N3 O5 -","- C20 H23 N3 O5 -","- C80 H92 N12 O20 -","4","1","","Salorinne, Kirsi; Lahtinen, Tanja; Marjomäki, Varpu; Häkkinen, Hannu","Polymorphic and solvate structures of ethyl ester and carboxylic acid derivatives of WIN 61893 analogue and their stability in solution","CrystEngComm","2014","16","38","9001","","10.1039/C4CE01152J","","","0.7107","MoKα","","0.0825","0.053","","","0.1184","0.1328","","","","","","1.053","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217691","18.6194","0.0005","8.3392","0.0002","12.7669","0.0003","90","","100.331","0.003","90","","1950.19","0.09","170","2","170.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 N3 O5 -","- C20 H23 N3 O5 -","- C80 H92 N12 O20 -","4","1","","Salorinne, Kirsi; Lahtinen, Tanja; Marjomäki, Varpu; Häkkinen, Hannu","Polymorphic and solvate structures of ethyl ester and carboxylic acid derivatives of WIN 61893 analogue and their stability in solution","CrystEngComm","2014","16","38","9001","","10.1039/C4CE01152J","","","0.7107","MoKα","","0.084","0.0596","","","0.1498","0.1674","","","","","","1.052","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217692","8.3029","0.0003","45.5165","0.0017","11.0152","0.0004","90","","103.692","0.004","90","","4044.6","0.3","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 N3 O6 -","- C20 H25 N3 O6 -","- C160 H200 N24 O48 -","8","2","","Salorinne, Kirsi; Lahtinen, Tanja; Marjomäki, Varpu; Häkkinen, Hannu","Polymorphic and solvate structures of ethyl ester and carboxylic acid derivatives of WIN 61893 analogue and their stability in solution","CrystEngComm","2014","16","38","9001","","10.1039/C4CE01152J","","","0.7107","MoKα","","0.0931","0.0593","","","0.1239","0.1401","","","","","","1.059","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7217693","13.7775","0.0003","7.21311","0.00013","21.4071","0.0003","90","","90.4904","0.0016","90","","2127.33","0.07","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 N3 O6 S -","- C20 H25 N3 O6 S -","- C80 H100 N12 O24 S4 -","4","1","","Salorinne, Kirsi; Lahtinen, Tanja; Marjomäki, Varpu; Häkkinen, Hannu","Polymorphic and solvate structures of ethyl ester and carboxylic acid derivatives of WIN 61893 analogue and their stability in solution","CrystEngComm","2014","16","38","9001","","10.1039/C4CE01152J","","","0.7107","MoKα","","0.0607","0.0446","","","0.1137","0.1245","","","","","","1.048","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217694","5.4543","0.0011","13.088","0.003","19.406","0.004","90","","93.39","0.03","90","","1382.9","0.5","303","2","303","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N6 O6 -","- C30 H26 N6 O6 -","- C60 H52 N12 O12 -","2","0.5","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.1097","0.0869","","","0.2811","0.3107","","","","","","1.066","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217695","19.586","0.003","19.586","0.003","24.077","0.005","90","","90","","90","","9236","3","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C34 H30 N8 O12 Zn -","- C34 H30 N8 O12 Zn -","- C272 H240 N64 O96 Zn8 -","8","0.5","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.1172","0.0787","","","0.2072","0.2292","","","","","","1.03","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217696","12.47","0.003","12.614","0.003","14.991","0.003","91.74","0.03","102.37","0.03","116.9","0.03","2032","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H41 N9 O14 Zn -","- C36 H41 N9 O14 Zn -","- C72 H82 N18 O28 Zn2 -","2","1","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.0942","0.0582","","","0.1462","0.1699","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217697","12.355","0.003","12.541","0.003","14.681","0.003","91.05","0.03","102.88","0.03","117.34","0.03","1950.6","1","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H41 Cu N9 O14 -","- C36 H41 Cu N9 O14 -","- C72 H82 Cu2 N18 O28 -","2","1","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.0754","0.0704","","","0.1711","0.1755","","","","","","1.085","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217698","12.28","0.003","12.491","0.003","14.649","0.003","91.44","0.03","102.46","0.03","115.88","0.03","1955.7","1","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H32 Co N8 O13 -","- C32 H32 Co N8 O13 -","- C64 H64 Co2 N16 O26 -","2","1","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.0784","0.0661","","","0.1577","0.1664","","","","","","1.1","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217699","19.379","0.003","19.379","0.003","23.744","0.005","90","","90","","90","","8917","3","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C34 H30 Cu N8 O12 -","- C34 H30 Cu N8 O12 -","- C272 H240 Cu8 N64 O96 -","8","0.5","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.163","0.0913","","","0.2315","0.2719","","","","","","1.021","","","","has coordinates","180507","2020-10-21","18:00:00",""
"7217700","19.642","0.003","19.642","0.003","23.896","0.005","90","","90","","90","","9219","3","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C34 H30 Co N8 O12 -","- C34 H30 Co N8 O12 -","- C272 H240 Co8 N64 O96 -","8","0.5","","Fang, Xin; Yuan, Xiong; Song, Yan-Bo; Wang, Jun-Dong; Lin, Mei-Jin","Cooperative lone pair‒π and coordination interactions in naphthalene diimide coordination networks","CrystEngComm","2014","16","38","9090","","10.1039/C4CE01233J","","","0.71073","MoKα","","0.0733","0.0636","","","0.1776","0.1843","","","","","","1.017","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217722","12.7953","0.001","12.7953","0.001","12.7953","0.001","90","","90","","90","","2094.8","0.3","290.81","0.1","290.81","0.1","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- C24 O13 Zn4 -","- C24 O13 Zn4 -","- C24 O13 Zn4 -","1","0.0208333","","Tshering, Lodey; Hunter, Sally O.; Nikolich, Alexandra; Minato, Erica; Fitchett, Christopher M.; D'Alessandro, Deanna M.; Richardson, Christopher","Post-synthetic pore-space expansion in a di-tagged metal‒organic framework","CrystEngComm","2014","16","39","9158","","10.1039/C4CE01377H","","","1.54184","CuKα","","0.2189","0.1982","","","0.5018","0.5309","","","","","","2.242","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217723","25.7643","0.0003","25.7643","0.0003","25.7643","0.0003","90","","90","","90","","17102.3","0.3","290.81","0.1","290.81","0.1","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- C24 O13 Zn4 -","- C24 O13 Zn4 -","- C192 O104 Zn32 -","8","0.0416667","","Tshering, Lodey; Hunter, Sally O.; Nikolich, Alexandra; Minato, Erica; Fitchett, Christopher M.; D'Alessandro, Deanna M.; Richardson, Christopher","Post-synthetic pore-space expansion in a di-tagged metal‒organic framework","CrystEngComm","2014","16","39","9158","","10.1039/C4CE01377H","","","0.71073","MoKα","","0.0938","0.0616","","","0.1817","0.2249","","","","","","1.067","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217724","35.744","0.002","35.744","0.002","23.9081","0.0016","90","","90","","120","","26453","3","123","2","123","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C210 H162 Cl18 N18 O6 Zn6 -","- C186 H126 Cl12 N18 Zn6 -","- C558 H378 Cl36 N54 Zn18 -","3","0.166667","","Constable, Edwin C.; Housecroft, Catherine E.; Prescimone, Alessandro; Vujovic, Srboljub; Zampese, Jennifer A.","Environmental control in the assembly of metallomacrocycles and one-dimensional polymers with 4,2′:6′:4′′-terpyridine linkers and zinc(ii) nodes","CrystEngComm","2014","16","37","8691","","10.1039/C4CE00783B","","","1.54178","CuKα","","0.0526","0.0311","","","0.0626","0.0661","","","","","","0.799","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217725","23.6145","0.0015","23.6145","0.0015","16.4568","0.001","90","","90","","90","","9177","1","123","2","123","2","","","","","","","","7","P -4 21 c","P -4 2n","114","","","","- C125 H84 Cl12 F20 N12 O5 Zn4 -","- C108 H56 Cl8 F20 N12 Zn4 -","- C216 H112 Cl16 F40 N24 Zn8 -","2","0.25","","Constable, Edwin C.; Housecroft, Catherine E.; Prescimone, Alessandro; Vujovic, Srboljub; Zampese, Jennifer A.","Environmental control in the assembly of metallomacrocycles and one-dimensional polymers with 4,2′:6′:4′′-terpyridine linkers and zinc(ii) nodes","CrystEngComm","2014","16","37","8691","","10.1039/C4CE00783B","","","1.54178","CuKα","","0.1907","0.0769","","","0.159","0.1884","","","","","","0.853","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217726","14.9652","0.001","16.3097","0.0012","24.4444","0.0018","90","","91.698","0.002","90","","5963.7","0.7","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C63 H43 Cl3 I4 N6 Zn2 -","- C63 H43 Cl3 I4 N6 Zn2 -","- C252 H172 Cl12 I16 N24 Zn8 -","4","1","","Constable, Edwin C.; Housecroft, Catherine E.; Prescimone, Alessandro; Vujovic, Srboljub; Zampese, Jennifer A.","Environmental control in the assembly of metallomacrocycles and one-dimensional polymers with 4,2′:6′:4′′-terpyridine linkers and zinc(ii) nodes","CrystEngComm","2014","16","37","8691","","10.1039/C4CE00783B","","","0.71073","MoKα","","0.0728","0.0493","","","0.1034","0.1195","","","","","","1.138","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7217727","70.6015","0.0018","70.6015","0.0018","23.992","0.0006","90","","90","","120","","103568","5","123","2","123","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C206 H146 Cl18 N18 O2 Zn6 -","- C186 H126 Cl12 N18 Zn6 -","- C2232 H1512 Cl144 N216 Zn72 -","12","0.666667","","Constable, Edwin C.; Housecroft, Catherine E.; Prescimone, Alessandro; Vujovic, Srboljub; Zampese, Jennifer A.","Environmental control in the assembly of metallomacrocycles and one-dimensional polymers with 4,2′:6′:4′′-terpyridine linkers and zinc(ii) nodes","CrystEngComm","2014","16","37","8691","","10.1039/C4CE00783B","","","1.54178","CuKα","","0.179","0.1199","","","0.2869","0.3228","","","","","","0.971","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217728","14.3701","0.0012","22.089","0.002","26.512","0.003","95.414","0.006","95.48","0.006","92.935","0.005","8324.2","1.4","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C170 H125 Cl20 N12 O4 Zn4 -","- C124 H84 Cl8 N12 Zn4 -","- C248 H168 Cl16 N24 Zn8 -","2","1","","Constable, Edwin C.; Housecroft, Catherine E.; Prescimone, Alessandro; Vujovic, Srboljub; Zampese, Jennifer A.","Environmental control in the assembly of metallomacrocycles and one-dimensional polymers with 4,2′:6′:4′′-terpyridine linkers and zinc(ii) nodes","CrystEngComm","2014","16","37","8691","","10.1039/C4CE00783B","","","1.54178","CuKα","","0.0941","0.0714","","","0.1933","0.2079","","","","","","1.034","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217729","14.3665","0.0006","20.7814","0.0008","26.2162","0.0013","99.654","0.003","97.51","0.003","103.905","0.003","7369.5","0.6","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C158 H93 Cl22 F20 N12 O2 Zn4 -","- C108 H56 Cl8 F20 N12 Zn4 -","- C216 H112 Cl16 F40 N24 Zn8 -","2","1","","Constable, Edwin C.; Housecroft, Catherine E.; Prescimone, Alessandro; Vujovic, Srboljub; Zampese, Jennifer A.","Environmental control in the assembly of metallomacrocycles and one-dimensional polymers with 4,2′:6′:4′′-terpyridine linkers and zinc(ii) nodes","CrystEngComm","2014","16","37","8691","","10.1039/C4CE00783B","","","1.54178","CuKα","","0.1002","0.0695","","","0.1763","0.1906","","","","","","0.932","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217763","26.846","0.005","27.178","0.005","9.766","0.002","90","","90","","90","","7125","2","100","2","100","2","","","","","","","","5","P m m n","-P 2ab 2a","59","","","","- C63 H67 N6 O20 Zn3 -","- C54 H42 N3 O17 Zn3 -","- C216 H168 N12 O68 Zn12 -","4","","","Konstas, Kristina; Taupitz, Kim F.; Turner, David R.; Kennedy, Danielle F.; Hill, Matthew R.","A new family of zinc metal‒organic framework polymorphs containing anthracene tetracarboxylates","CrystEngComm","2014","16","38","8937","","10.1039/C4CE00385C","","","0.71073","Synchrotron","","0.2225","0.1213","","","0.3507","0.3981","","","","","","1.204","","","","has coordinates,has disorder","180508","2020-10-21","18:00:00",""
"7217764","18.5127","0.0003","18.5127","0.0003","78.4908","0.0018","90","","90","","120","","23296.4","0.8","123","2","123","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C52 H68 N7.33 O16.67 Zn2 -","- C34.0004 H14 N1.33327 O10.6666 Zn2 -","- C612.007 H252 N23.9988 O191.999 Zn36 -","18","0.5","","Konstas, Kristina; Taupitz, Kim F.; Turner, David R.; Kennedy, Danielle F.; Hill, Matthew R.","A new family of zinc metal‒organic framework polymorphs containing anthracene tetracarboxylates","CrystEngComm","2014","16","38","8937","","10.1039/C4CE00385C","","","1.5418","CuKα","","0.1045","0.0922","","","0.216","0.2281","","","","","","1.028","","","","has coordinates,has disorder","180508","2020-10-21","18:00:00",""
"7217765","27.063","0.009","27.063","0.009","16.107","0.003","90","","90","","120","","10216","5","100","2","100","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C34.5 H28.5 N1.5 O11.5 Zn2 -","- C30 H14 O10 Zn2 -","- C270 H126 O90 Zn18 -","9","0.25","","Konstas, Kristina; Taupitz, Kim F.; Turner, David R.; Kennedy, Danielle F.; Hill, Matthew R.","A new family of zinc metal‒organic framework polymorphs containing anthracene tetracarboxylates","CrystEngComm","2014","16","38","8937","","10.1039/C4CE00385C","","","0.71073","Synchrotron","","0.0746","0.069","","","0.192","0.1954","","","","","","1.177","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217770","13.852","0.004","13.852","0.004","6.4216","0.0017","90","","90","","90","","1232.2","0.6","173","2","173","2","","","","","","","","4","P 4/m c c","-P 4 2c","124","lithium phthalocyanine","lithium phthalocyanine","","- C32 H16 Li N8 -","- C32 H16 Li N8 -","- C64 H32 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0483","0.0426","","","0.1054","0.1089","","","","","","1.094","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217771","13.843","0.0009","13.843","0.0009","6.4156","0.0006","90","","90","","90","","1229.41","0.16","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.11 Li N8 -","- C32 H16 Cl0.11 Li N8 -","- C64 H32 Cl0.22 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.07","0.0552","","","0.1138","0.1206","","","","","","1.12","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217772","13.829","0.005","13.829","0.005","6.406","0.002","90","","90","","90","","1225.1","0.7","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.2 Li N8 -","- C32 H16 Cl0.2 Li N8 -","- C64 H32 Cl0.4 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0624","0.0502","","","0.1129","0.1195","","","","","","1.082","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217773","13.864","0.006","13.864","0.006","6.414","0.003","90","","90","","90","","1232.8","0.9","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.21 Li N8 -","- C32 H16 Cl0.21 Li N8 -","- C64 H32 Cl0.42 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0866","0.074","","","0.1988","0.2126","","","","","","1.138","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217774","13.841","0.004","13.841","0.004","6.4027","0.0018","90","","90","","90","","1226.6","0.6","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.24 Li N8 -","- C32 H16 Cl0.24 Li N8 -","- C64 H32 Cl0.48 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0567","0.0471","","","0.1081","0.114","","","","","","1.106","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217775","13.843","0.004","13.843","0.004","6.394","0.002","90","","90","","90","","1225.3","0.6","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.38 Li N8 -","- C32 H16 Cl0.38 Li N8 -","- C64 H32 Cl0.76 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0638","0.0553","","","0.1542","0.1611","","","","","","1.138","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217776","13.8605","0.0007","13.8605","0.0007","6.3917","0.0005","90","","90","","90","","1227.93","0.13","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.46 Li N8 -","- C32 H16 Cl0.46 Li N8 -","- C64 H32 Cl0.92 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0588","0.0505","","","0.1419","0.1477","","","","","","1.124","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217777","5.6421","0.0002","28.9519","0.0013","7.8627","0.0003","90","","95.521","0.002","90","","1278.41","0.09","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","calciumMOF","","","- C14 H10 Ca O6 -","- C14 H10 Ca O6 -","- C56 H40 Ca4 O24 -","4","1","","Rao, Purna Chandra; K. S, Asha; Mandal, Sukhendu","Synthesis, structure and band gap energy of a series of thermostable alkaline earth metal based metal‒organic frameworks","CrystEngComm","2014","16","39","9320","","10.1039/C4CE01505C","","","0.71073","MoKα","","0.0384","0.0313","","","0.089","0.1035","","","","","","1.138","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217778","29.3416","0.0018","6.3038","0.0004","7.0814","0.0004","90","","90","","90","","1309.8","0.14","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","StrontiumMOF","","","- C14 H10 O6 Sr -","- C14 H10 O6 Sr -","- C56 H40 O24 Sr4 -","4","1","","Rao, Purna Chandra; K. S, Asha; Mandal, Sukhendu","Synthesis, structure and band gap energy of a series of thermostable alkaline earth metal based metal‒organic frameworks","CrystEngComm","2014","16","39","9320","","10.1039/C4CE01505C","","","0.71073","MoKα","","0.0422","0.0297","","","0.0809","0.111","","","","","","1.146","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217779","11.2447","0.0002","8.0932","0.0001","30.0999","0.0005","90","","90","","90","","2739.26","0.07","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","BariumMOF","","","- C28 H16 Ba2 O13 -","- C28 H16 Ba2 O13 -","- C112 H64 Ba8 O52 -","4","1","","Rao, Purna Chandra; K. S, Asha; Mandal, Sukhendu","Synthesis, structure and band gap energy of a series of thermostable alkaline earth metal based metal‒organic frameworks","CrystEngComm","2014","16","39","9320","","10.1039/C4CE01505C","","","0.71073","MoKα","","0.0219","0.0174","","","0.0555","0.0811","","","","","","1.37","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217780","14.0847","0.0004","5.9953","0.0002","19.3347","0.0006","90","","93.729","0.002","90","","1629.2","0.09","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 O7.5 S Zn1.5 -","- C15 H12 O7.5 S Zn1.5 -","- C60 H48 O30 S4 Zn6 -","4","1","","Wu, Cheng-You; Raja, Duraisamy Senthil; Yang, Chun-Chuen; Yeh, Chun-Ting; Chen, Yu-Ru; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her","Evaluation of structural transformation in 2D metal‒organic frameworks based on a 4,4′-sulfonyldibenzoate linker: microwave-assisted solvothermal synthesis, characterization and applications","CrystEngComm","2014","16","39","9308","","10.1039/C4CE01201A","","","0.71073","MoKα","","0.0508","0.0459","","","0.1146","0.1167","","","","","","1.147","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217781","14.1168","0.0002","6.0531","0.0001","19.3678","0.0003","90","","93.627","0.001","90","","1651.67","0.04","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H18 O14 S2 Zn3 -","- C28 H18 O14 S2 Zn3 -","- C56 H36 O28 S4 Zn6 -","2","0.5","","Wu, Cheng-You; Raja, Duraisamy Senthil; Yang, Chun-Chuen; Yeh, Chun-Ting; Chen, Yu-Ru; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her","Evaluation of structural transformation in 2D metal‒organic frameworks based on a 4,4′-sulfonyldibenzoate linker: microwave-assisted solvothermal synthesis, characterization and applications","CrystEngComm","2014","16","39","9308","","10.1039/C4CE01201A","","","0.71073","MoKα","","0.047","0.0301","","","0.0669","0.0731","","","","","","1.054","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217782","28.1637","0.0009","6.4411","0.0002","24.8679","0.0008","90","","115.445","0.002","90","","4073.6","0.2","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C60 H74 Mg6 O43 S4 -","- C60 H74 Mg6 O43 S4 -","- C120 H148 Mg12 O86 S8 -","2","0.5","","Wu, Cheng-You; Raja, Duraisamy Senthil; Yang, Chun-Chuen; Yeh, Chun-Ting; Chen, Yu-Ru; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her","Evaluation of structural transformation in 2D metal‒organic frameworks based on a 4,4′-sulfonyldibenzoate linker: microwave-assisted solvothermal synthesis, characterization and applications","CrystEngComm","2014","16","39","9308","","10.1039/C4CE01201A","","","0.71073","MoKα","","0.1118","0.0541","","","0.1468","0.1672","","","","","","1.037","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217783","10.161","0.0005","7.3197","0.0003","22.3295","0.001","90","","93.699","0.001","90","","1657.31","0.13","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 Mn O7 S -","- C16 H13 Mn O7 S -","- C64 H52 Mn4 O28 S4 -","4","1","","Wu, Cheng-You; Raja, Duraisamy Senthil; Yang, Chun-Chuen; Yeh, Chun-Ting; Chen, Yu-Ru; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her","Evaluation of structural transformation in 2D metal‒organic frameworks based on a 4,4′-sulfonyldibenzoate linker: microwave-assisted solvothermal synthesis, characterization and applications","CrystEngComm","2014","16","39","9308","","10.1039/C4CE01201A","","","0.71073","MoKα","","0.063","0.0572","","","0.1548","0.1573","","","","","","1.165","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217784","5.998","0.0002","11.8959","0.0004","13.0287","0.0007","112.118","0.003","102.502","0.003","99.816","0.002","807.5","0.06","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Mn O7 S -","- C14 H10 Mn O7 S -","- C28 H20 Mn2 O14 S2 -","2","1","","Wu, Cheng-You; Raja, Duraisamy Senthil; Yang, Chun-Chuen; Yeh, Chun-Ting; Chen, Yu-Ru; Li, Chen-Yu; Ko, Bao-Tsan; Lin, Chia-Her","Evaluation of structural transformation in 2D metal‒organic frameworks based on a 4,4′-sulfonyldibenzoate linker: microwave-assisted solvothermal synthesis, characterization and applications","CrystEngComm","2014","16","39","9308","","10.1039/C4CE01201A","","","0.71073","MoKα","","0.0601","0.0492","","","0.1241","0.1282","","","","","","1.082","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217785","5.951","0.0019","15.899","0.005","21.4","0.016","90","","90","","90","","2024.8","1.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ezetimibe","Ezetimibe","","- C24 H21 F2 N O3 -","- C24 H21 F2 N O3 -","- C96 H84 F8 N4 O12 -","4","1","","Shimpi, Manishkumar R.; Childs, Scott L.; Boström, Dan; Velaga, Sitaram P.","New cocrystals of ezetimibe withl-proline and imidazole","CrystEngComm","2014","16","38","8984","","10.1039/C4CE01127A","","","0.71073","MoKα","","0.1171","0.0561","","","0.1549","0.2013","","","","","","1.061","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217786","5.832","0.0002","15.752","0.0005","25.673","0.0013","90","","90","","90","","2358.47","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ezetimibe-Imidazole","","","- C27 H25 F2 N3 O3 -","- C27 H25 F2 N3 O3 -","- C108 H100 F8 N12 O12 -","4","1","","Shimpi, Manishkumar R.; Childs, Scott L.; Boström, Dan; Velaga, Sitaram P.","New cocrystals of ezetimibe withl-proline and imidazole","CrystEngComm","2014","16","38","8984","","10.1039/C4CE01127A","","","0.71073","MoKα","","0.095","0.06","","","0.1678","0.1994","","","","","","1.046","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217787","6.14","0.0002","17.077","0.0007","21.35","0.0012","90","","90","","90","","2238.61","0.17","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ezetimibe-Formamide","Ezetimibe-Formamide","","- C25 H24 F2 N2 O4 -","- C25 H24 F2 N2 O4 -","- C100 H96 F8 N8 O16 -","4","1","","Shimpi, Manishkumar R.; Childs, Scott L.; Boström, Dan; Velaga, Sitaram P.","New cocrystals of ezetimibe withl-proline and imidazole","CrystEngComm","2014","16","38","8984","","10.1039/C4CE01127A","","","0.71073","MoKα","","0.0986","0.0551","","","0.1341","0.1599","","","","","","1.148","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217797","8.8785","0.0007","17.4501","0.0014","13.1922","0.0011","90","","101.292","0.002","90","","2004.3","0.3","293","2","293","2","","","","","","","","8","P 1 2/n 1","-P 2yac","13","","","","- C16 H54 Cl F3 Ge7 N12 Ni2 O15 -","- C16 H54 Cl F3 Ge7 N12 Ni2 O15 -","- C32 H108 Cl2 F6 Ge14 N24 Ni4 O30 -","2","0.5","","Ren, Xiaoyan; Pan, Qinhe; Liu, Jiancong; Li, Yi; Wang, Fuxiang; Li, Jiyang; Xu, Yan; Li, Li","A family of germanates constructed from Ge7clusters co-templated by metal complexes and organic/inorganic species","CrystEngComm","2014","16","40","9545","","10.1039/C4CE00671B","","","0.71073","MoKα","","0.0806","0.041","","","0.0687","0.0894","","","","","","1.032","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217798","8.829","0.003","16.632","0.005","20.933","0.006","90","","96.992","0.006","90","","3051","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H38 F2 Ge7 N7 Ni O15.5 -","- C11 H33 F2 Ge7 N7 Ni O15.5 -","- C44 H132 F8 Ge28 N28 Ni4 O62 -","4","1","","Ren, Xiaoyan; Pan, Qinhe; Liu, Jiancong; Li, Yi; Wang, Fuxiang; Li, Jiyang; Xu, Yan; Li, Li","A family of germanates constructed from Ge7clusters co-templated by metal complexes and organic/inorganic species","CrystEngComm","2014","16","40","9545","","10.1039/C4CE00671B","","","0.71073","MoKα","","0.0947","0.0474","","","0.1007","0.1142","","","","","","0.9","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7217799","8.8029","0.0018","16.671","0.003","21.293","0.004","90","","101.21","0.03","90","","3065.2","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C11 H36 F2 Ge7 N7 Ni O16 -","- C11 H32 F2 Ge7 N7 Ni O16 -","- C44 H128 F8 Ge28 N28 Ni4 O64 -","4","1","","Ren, Xiaoyan; Pan, Qinhe; Liu, Jiancong; Li, Yi; Wang, Fuxiang; Li, Jiyang; Xu, Yan; Li, Li","A family of germanates constructed from Ge7clusters co-templated by metal complexes and organic/inorganic species","CrystEngComm","2014","16","40","9545","","10.1039/C4CE00671B","","","0.71073","MoKα","","0.0955","0.0688","","","0.1765","0.1974","","","","","","1.173","","","","has coordinates,has disorder","180508","2020-10-21","18:00:00",""
"7217800","8.8089","0.0018","22.436","0.005","31.193","0.006","90","","90","","90","","6165","2","293","2","293","2","","","","","","","","7","P b c m","-P 2c 2b","57","","","","- C22 H72 F6 Ge14 N14 Ni2 O31 -","- C18 H56 F6 Ge14 N12 Ni2 O29 -","- C72 H224 F24 Ge56 N48 Ni8 O116 -","4","0.5","","Ren, Xiaoyan; Pan, Qinhe; Liu, Jiancong; Li, Yi; Wang, Fuxiang; Li, Jiyang; Xu, Yan; Li, Li","A family of germanates constructed from Ge7clusters co-templated by metal complexes and organic/inorganic species","CrystEngComm","2014","16","40","9545","","10.1039/C4CE00671B","","","0.71073","MoKα","","0.0355","0.0296","","","0.0774","0.0796","","","","","","1.064","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217803","8.9979","0.0009","14.5904","0.0014","13.4092","0.0013","90","","113.863","0.006","90","","1609.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 Cd N4 O4 -","- C13 H18 Cd N4 O4 -","- C52 H72 Cd4 N16 O16 -","4","1","","Xue, Chen; Xu, Heng; Huang, Rong-Yi; Ren, Xiao-Ming","Mutual transformation between crystalline phases and dielectric properties of coordination polymers with the formula [Cd(N-methylimidazole)2(H2O)x(glutarate)]·nH2O (x = 0 or 1; n = or 4)","CrystEngComm","2014","16","42","9857","","10.1039/C4CE00997E","","","0.71073","MoKα","","0.0539","0.0466","","","0.1319","0.1379","","","","","","1.049","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217804","16.9674","0.0017","14.2074","0.0014","8.7538","0.0008","90","","90","","90","","2110.2","0.4","296","2","296","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C13 H28 Cd N4 O9 -","- C13 H28 Cd N4 O9 -","- C52 H112 Cd4 N16 O36 -","4","0.5","","Xue, Chen; Xu, Heng; Huang, Rong-Yi; Ren, Xiao-Ming","Mutual transformation between crystalline phases and dielectric properties of coordination polymers with the formula [Cd(N-methylimidazole)2(H2O)x(glutarate)]·nH2O (x = 0 or 1; n = or 4)","CrystEngComm","2014","16","42","9857","","10.1039/C4CE00997E","","","0.71073","MoKα","","0.0428","0.0268","","","0.0617","0.068","","","","","","1.041","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217809","21.2969","0.0015","26.3582","0.0019","8.7744","0.0006","90","","90","","90","","4925.5","0.6","296","2","296","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C20 H21 Br Cd N4 O4 -","- C20 H21 Br Cd N4 O4 -","- C160 H168 Br8 Cd8 N32 O32 -","8","1","","Hou, Yuan-Feng; Liu, Bo; Yue, Ke-Fen; Zhou, Chun-Sheng; Wang, Yi-Meng; Yan, Ni; Wang, Yao-Yu","Five solvent-induced cadmium coordination polymers (CPs) based on the same mixed ligands","CrystEngComm","2014","16","40","9560","","10.1039/C4CE01359J","","","0.71073","MoKα","","0.0708","0.0438","","","0.1058","0.1146","","","","","","1.009","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217810","9.449","0.003","10.386","0.004","17.553","0.006","76.519","0.008","89.167","0.007","79.774","0.008","1647.9","1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H27 Br2 Cd2 N4 O9 -","- C29 H27 Br2 Cd2 N4 O9 -","- C58 H54 Br4 Cd4 N8 O18 -","2","1","","Hou, Yuan-Feng; Liu, Bo; Yue, Ke-Fen; Zhou, Chun-Sheng; Wang, Yi-Meng; Yan, Ni; Wang, Yao-Yu","Five solvent-induced cadmium coordination polymers (CPs) based on the same mixed ligands","CrystEngComm","2014","16","40","9560","","10.1039/C4CE01359J","","","0.71073","MoKα","","0.1435","0.0728","","","0.1011","0.1255","","","","","","1","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217811","8.7933","0.0007","17.7457","0.0016","14.8568","0.0012","90","","90","","90","","2318.3","0.3","296","2","296","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C20 H21 Br Cd N4 O4 -","- C20 H21 Br Cd N4 O4 -","- C80 H84 Br4 Cd4 N16 O16 -","4","0.5","","Hou, Yuan-Feng; Liu, Bo; Yue, Ke-Fen; Zhou, Chun-Sheng; Wang, Yi-Meng; Yan, Ni; Wang, Yao-Yu","Five solvent-induced cadmium coordination polymers (CPs) based on the same mixed ligands","CrystEngComm","2014","16","40","9560","","10.1039/C4CE01359J","","","0.71073","MoKα","","0.0498","0.029","","","0.063","0.0706","","","","","","1.005","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217812","17.051","0.002","11.4036","0.0014","19.722","0.002","90","","109.91","0.002","90","","3605.6","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Br Cd N2 O7 -","- C14 H18 Br Cd N2 O7 -","- C112 H144 Br8 Cd8 N16 O56 -","8","1","","Hou, Yuan-Feng; Liu, Bo; Yue, Ke-Fen; Zhou, Chun-Sheng; Wang, Yi-Meng; Yan, Ni; Wang, Yao-Yu","Five solvent-induced cadmium coordination polymers (CPs) based on the same mixed ligands","CrystEngComm","2014","16","40","9560","","10.1039/C4CE01359J","","","0.71073","MoKα","","0.0964","0.0613","","","0.1102","0.1259","","","","","","1.02","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217813","8.3536","0.0009","10.0782","0.001","11.2967","0.0012","74.969","0.002","74.612","0.002","68.425","0.001","838.73","0.15","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H14 Br Cd N2 O5 -","- C14 H14 Br Cd N2 O5 -","- C28 H28 Br2 Cd2 N4 O10 -","2","1","","Hou, Yuan-Feng; Liu, Bo; Yue, Ke-Fen; Zhou, Chun-Sheng; Wang, Yi-Meng; Yan, Ni; Wang, Yao-Yu","Five solvent-induced cadmium coordination polymers (CPs) based on the same mixed ligands","CrystEngComm","2014","16","40","9560","","10.1039/C4CE01359J","","","0.71073","MoKα","","0.0325","0.0293","","","0.1029","0.1104","","","","","","0.878","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217816","25.6565","0.0006","12.4636","0.0003","21.2198","0.0006","90","","105.91","0.002","90","","6525.6","0.3","277","2","277","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C78 H54 Cd2 N8 O15 -","- C78 H48 Cd2 N8 O12 -","- C312 H192 Cd8 N32 O48 -","4","0.5","","Zhao, Jie; Xie, Li-Qiong; Ma, Ying-Ming; Zhou, Ai-Ju; Dong, Wen; Wang, Jing; Chen, Yan-Cong; Tong, Ming-Liang","Structures and properties of coordination polymers involving asymmetric biphenyl-3,2′,5′-tricarboxylate","CrystEngComm","2014","16","43","10006","","10.1039/C4CE01225A","","","0.71073","MoKα","","0.0785","0.044","","","0.0867","0.0964","","","","","","0.985","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217817","7.4683","0.0001","9.9602","0.0002","15.8627","0.0003","81.11","0.001","88.078","0.001","69.099","0.001","1088.78","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H40 Cu2 N4 O16 -","- C50 H40 Cu2 N4 O16 -","- C50 H40 Cu2 N4 O16 -","1","0.5","","Zhao, Jie; Xie, Li-Qiong; Ma, Ying-Ming; Zhou, Ai-Ju; Dong, Wen; Wang, Jing; Chen, Yan-Cong; Tong, Ming-Liang","Structures and properties of coordination polymers involving asymmetric biphenyl-3,2′,5′-tricarboxylate","CrystEngComm","2014","16","43","10006","","10.1039/C4CE01225A","","","0.71073","MoKα","","0.0395","0.0319","","","0.0835","0.0876","","","","","","1.034","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217818","9.5251","0.0006","9.8837","0.0006","16.3942","0.0011","72.834","0.004","87.431","0.004","71.093","0.004","1392.88","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H26 N3 Ni O9 -","- C30 H26 N3 Ni O9 -","- C60 H52 N6 Ni2 O18 -","2","1","","Zhao, Jie; Xie, Li-Qiong; Ma, Ying-Ming; Zhou, Ai-Ju; Dong, Wen; Wang, Jing; Chen, Yan-Cong; Tong, Ming-Liang","Structures and properties of coordination polymers involving asymmetric biphenyl-3,2′,5′-tricarboxylate","CrystEngComm","2014","16","43","10006","","10.1039/C4CE01225A","","","0.71073","MoKα","","0.0566","0.0388","","","0.0936","0.1062","","","","","","1.062","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217819","9.3553","0.0002","24.7637","0.0004","11.6174","0.0002","90","","113.411","0.001","90","","2469.86","0.08","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H42 Mn3 N6 O14 -","- C60 H42 Mn3 N6 O14 -","- C120 H84 Mn6 N12 O28 -","2","0.5","","Zhao, Jie; Xie, Li-Qiong; Ma, Ying-Ming; Zhou, Ai-Ju; Dong, Wen; Wang, Jing; Chen, Yan-Cong; Tong, Ming-Liang","Structures and properties of coordination polymers involving asymmetric biphenyl-3,2′,5′-tricarboxylate","CrystEngComm","2014","16","43","10006","","10.1039/C4CE01225A","","","0.71073","MoKα","","0.0513","0.0344","","","0.0814","0.0881","","","","","","1.047","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217820","7.038","0.004","15.257","0.008","17.946","0.01","90","","90","","90","","1927","1.8","140","2","140","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C5 H6 Br3 Cd N -","- C5 H6 Br3 Cd N -","- C40 H48 Br24 Cd8 N8 -","8","1","","Jin, Jing; Jin, Lei; Su, En-Ben","Temperature-induced isosymmetric reversible structural phase transition in catena-[pyridinium tris(μ2-bromo)-cadmium(ii)]","CrystEngComm","2014","16","39","9284","","10.1039/C4CE00799A","","","0.71073","MoKα","","0.0932","0.0762","","","0.1745","0.1847","","","","","","0.976","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217821","7.6903","0.0015","18.058","0.004","7.1118","0.0014","90","","90","","90","","987.6","0.4","293","2","293","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C5 H6 Br3 Cd N -","- C5 H6 Br3 Cd N -","- C20 H24 Br12 Cd4 N4 -","4","0.25","","Jin, Jing; Jin, Lei; Su, En-Ben","Temperature-induced isosymmetric reversible structural phase transition in catena-[pyridinium tris(μ2-bromo)-cadmium(ii)]","CrystEngComm","2014","16","39","9284","","10.1039/C4CE00799A","","","0.71073","MoKα","","0.0358","0.0283","","","0.061","0.063","","","","","","1.164","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217852","7.1364","0.0004","14.89","0.0009","14.839","0.0007","90","","91.636","0.005","90","","1576.16","0.15","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 Cl N4 O5 -","- C14 H17 Cl N4 O5 -","- C56 H68 Cl4 N16 O20 -","4","1","","Prasad, Karothu Durga; Cherukuvada, Suryanarayan; Devaraj Stephen, L.; Guru Row, Tayur N.","Effect of inductive effect on the formation of cocrystals and eutectics","CrystEngComm","2014","16","42","9930","","10.1039/C4CE01489H","","","0.71073","MoKα","","0.069","0.0484","","","0.097","0.109","","","","","","1.038","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217853","6.9766","0.0003","15.2461","0.0008","14.61","0.0007","90","","91.602","0.004","90","","1553.4","0.13","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Cl N3 O6 -","- C14 H16 Cl N3 O6 -","- C56 H64 Cl4 N12 O24 -","4","1","","Prasad, Karothu Durga; Cherukuvada, Suryanarayan; Devaraj Stephen, L.; Guru Row, Tayur N.","Effect of inductive effect on the formation of cocrystals and eutectics","CrystEngComm","2014","16","42","9930","","10.1039/C4CE01489H","","","0.71073","MoKα","","0.0966","0.0619","","","0.1481","0.1765","","","","","","1.041","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217854","7.0625","0.0009","15.0679","0.0019","14.7835","0.0014","90","","90.563","0.009","90","","1573.1","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16.25 Cl N3.25 O5.75 -","- C14 H16.63 Cl N3.63 O5.37 -","- C56 H66.52 Cl4 N14.52 O21.48 -","4","1","","Prasad, Karothu Durga; Cherukuvada, Suryanarayan; Devaraj Stephen, L.; Guru Row, Tayur N.","Effect of inductive effect on the formation of cocrystals and eutectics","CrystEngComm","2014","16","42","9930","","10.1039/C4CE01489H","","","0.71073","MoKα","","0.0741","0.0554","","","0.1351","0.1457","","","","","","1.034","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217855","7.0287","0.0005","15.0835","0.0011","14.7528","0.0011","90","","90.09","0.006","90","","1564.1","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16.5 Cl N3.5 O5.5 -","- C14 H16.47 Cl N3.47 O5.53 -","- C56 H65.88 Cl4 N13.88 O22.12 -","4","1","","Prasad, Karothu Durga; Cherukuvada, Suryanarayan; Devaraj Stephen, L.; Guru Row, Tayur N.","Effect of inductive effect on the formation of cocrystals and eutectics","CrystEngComm","2014","16","42","9930","","10.1039/C4CE01489H","","","0.71073","MoKα","","0.082","0.0617","","","0.1524","0.1651","","","","","","1.053","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7217856","5.378","0.002","9.788","0.004","8.399","0.003","90","","101.676","0.004","90","","433","0.3","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-isopropyl-L-valine","","- C8 H17 N O2 -","- C8 H17 N O2 -","- C16 H34 N2 O4 -","2","1","","Görbitz, C. H.; Leirvåg, A. B.; Jacobsen, Ø.","Hydrogen bond architecture in crystal structures of N-alkylated hydrophobic amino acids","CrystEngComm","2014","16","41","9631","","10.1039/C4CE01412J","","","0.71073","MoKα","","0.0522","0.0455","","","0.1245","0.1304","","","","","","1.09","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217857","17.382","0.004","10.705","0.002","9.608","0.002","90","","90","","90","","1787.8","0.6","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","N-Isopropyl-DL-valine","","- C8 H17 N O2 -","- C8 H17 N O2 -","- C64 H136 N8 O16 -","8","1","","Görbitz, C. H.; Leirvåg, A. B.; Jacobsen, Ø.","Hydrogen bond architecture in crystal structures of N-alkylated hydrophobic amino acids","CrystEngComm","2014","16","41","9631","","10.1039/C4CE01412J","","","0.71073","MoKα","","0.1073","0.0408","","","0.0981","0.1292","","","","","","1.012","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217858","9.2948","0.0018","10.79","0.002","19.871","0.004","90","","90","","90","","1992.9","0.7","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-isopropyl-L-leucine","","- C9 H19 N O2 -","- C9 H19 N O2 -","- C72 H152 N8 O16 -","8","2","","Görbitz, C. H.; Leirvåg, A. B.; Jacobsen, Ø.","Hydrogen bond architecture in crystal structures of N-alkylated hydrophobic amino acids","CrystEngComm","2014","16","41","9631","","10.1039/C4CE01412J","","","0.71073","MoKα","","0.0488","0.039","","","0.0868","0.0907","","","","","","1.077","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217859","10.75","0.002","9.407","0.002","11.079","0.003","90","","95.013","0.003","90","","1116.1","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-isopropyl-L-phenylalanine","","- C12 H17 N O2 -","- C12 H17 N O2 -","- C48 H68 N4 O8 -","4","2","","Görbitz, C. H.; Leirvåg, A. B.; Jacobsen, Ø.","Hydrogen bond architecture in crystal structures of N-alkylated hydrophobic amino acids","CrystEngComm","2014","16","41","9631","","10.1039/C4CE01412J","","","0.71073","MoKα","","0.0555","0.038","","","0.086","0.0952","","","","","","1.028","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217860","5.766","0.003","12.082","0.005","16.559","0.007","90","","90","","90","","1153.6","0.9","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-benzyl-L-valine","N-benzyl-S-2-amino-4-methylpropanoic acid","","- C12 H17 N O2 -","- C12 H17 N O2 -","- C48 H68 N4 O8 -","4","1","","Görbitz, C. H.; Leirvåg, A. B.; Jacobsen, Ø.","Hydrogen bond architecture in crystal structures of N-alkylated hydrophobic amino acids","CrystEngComm","2014","16","41","9631","","10.1039/C4CE01412J","","","1.54178","CuKα","","0.1087","0.0663","","","0.1081","0.1229","","","","","","1.081","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217861","27.4601","0.0015","14.8337","0.0007","15.0974","0.0007","90","","112.024","0.007","90","","5700.9","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H32 N6 Ni2 O9 -","- C52 H32 N6 Ni2 O9 -","- C208 H128 N24 Ni8 O36 -","4","0.5","","Gong, Yun; Zhang, Miao Miao; Zhang, Pan; Shi, Hui Fang; Jiang, Peng Gang; Lin, Jian Hua","Metal‒organic frameworks based on 4-(4-carboxyphenyl)-2,2,4,4-terpyridine: structures, topologies and electrocatalytic behaviors in sodium laurylsulfonate aqueous solution","CrystEngComm","2014","16","42","9882","","10.1039/C4CE01506A","","","0.71073","MoKα","","0.0882","0.0756","","","0.2419","0.2579","","","","","","1.1","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217862","27.7567","0.0016","15.074","0.0005","15.1426","0.0007","90","","111.883","0.007","90","","5879.2","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H32 Co2 N6 O9 -","- C52 H32 Co2 N6 O9 -","- C208 H128 Co8 N24 O36 -","4","0.5","","Gong, Yun; Zhang, Miao Miao; Zhang, Pan; Shi, Hui Fang; Jiang, Peng Gang; Lin, Jian Hua","Metal‒organic frameworks based on 4-(4-carboxyphenyl)-2,2,4,4-terpyridine: structures, topologies and electrocatalytic behaviors in sodium laurylsulfonate aqueous solution","CrystEngComm","2014","16","42","9882","","10.1039/C4CE01506A","","","0.71073","MoKα","","0.0722","0.0596","","","0.2083","0.2201","","","","","","1.105","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217863","18.7063","0.0018","22.983","0.002","17.7139","0.0015","90","","105.866","0.002","90","","7325.6","1.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H58 Cu N8 O8 -","- C26 H19 Cu N3 O5.5 -","- C208 H152 Cu8 N24 O44 -","8","1","","Gong, Yun; Zhang, Miao Miao; Zhang, Pan; Shi, Hui Fang; Jiang, Peng Gang; Lin, Jian Hua","Metal‒organic frameworks based on 4-(4-carboxyphenyl)-2,2,4,4-terpyridine: structures, topologies and electrocatalytic behaviors in sodium laurylsulfonate aqueous solution","CrystEngComm","2014","16","42","9882","","10.1039/C4CE01506A","","","0.71073","MoKα","","0.1377","0.0811","","","0.227","0.247","","","","","","0.899","","","","has coordinates,has disorder","180509","2020-10-21","18:00:00",""
"7217864","31.4162","0.0016","31.4162","0.0016","14.1226","0.0014","90","","90","","120","","12071.3","1.5","296","2","296","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C18 H28.5 In N4.5 O13 -","- C14 H10.5 In N3.5 O8 -","- C252 H189 In18 N63 O144 -","18","1","","Wang, Jing; Luo, Jiahuan; Zhi, Bo; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Anion-templated assembly of three indium‒organic frameworks with diverse topologies","CrystEngComm","2014","16","42","9810","","10.1039/C4CE01326C","","","0.71073","MoKα","","0.05","0.0461","","","0.1256","0.1307","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217865","24.681","0.004","24.681","0.004","10.819","0.002","90","","90","","90","","6590.4","1.9","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C19 H29 In N4 O12 -","- C13 H7 In N2 O8 -","- C104 H56 In8 N16 O64 -","8","1","","Wang, Jing; Luo, Jiahuan; Zhi, Bo; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Anion-templated assembly of three indium‒organic frameworks with diverse topologies","CrystEngComm","2014","16","42","9810","","10.1039/C4CE01326C","","","0.71073","MoKα","","0.0753","0.0702","","","0.1936","0.197","","","","","","1.083","","","","has coordinates,has disorder","180509","2020-10-21","18:00:00",""
"7217866","27.59","0.003","27.59","0.003","27.59","0.003","90","","90","","90","","21002","4","293","2","293","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C18 H26 Cl In N4 O9 -","- C12 H6 Cl In N2 O4 -","- C288 H144 Cl24 In24 N48 O96 -","24","1","","Wang, Jing; Luo, Jiahuan; Zhi, Bo; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Anion-templated assembly of three indium‒organic frameworks with diverse topologies","CrystEngComm","2014","16","42","9810","","10.1039/C4CE01326C","","","0.71073","MoKα","","0.0677","0.051","","","0.1656","0.1717","","","","","","1.169","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217867","9.139","0.0011","9.306","0.001","9.7714","0.0012","85.131","0.01","65.297","0.013","71.185","0.011","713.44","0.17","150","2","150","2","","","","","","","","4","P 1","P 1","1","","","","- C12 H16 N4 O7 -","- C12 H16 N4 O7 -","- C24 H32 N8 O14 -","2","2","","Leyssens, T.; Tumanova, N.; Robeyns, K.; Candoni, N.; Veesler, S.","Solution cocrystallization, an effective tool to explore the variety of cocrystal systems: caffeine/dicarboxylic acid cocrystals","CrystEngComm","2014","16","41","9603","","10.1039/C4CE01495B","","","0.71073","MoKα","","0.0609","0.058","","","0.1558","0.1595","","","","","","1.059","","","","has coordinates,has disorder","180509","2020-10-21","18:00:00",""
"7217868","21.3368","0.0009","17.052","0.0005","6.7877","0.0003","90","","93.674","0.004","90","","2464.53","0.17","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 N8 O8 -","- C22 H30 N8 O8 -","- C88 H120 N32 O32 -","4","1","","Leyssens, T.; Tumanova, N.; Robeyns, K.; Candoni, N.; Veesler, S.","Solution cocrystallization, an effective tool to explore the variety of cocrystal systems: caffeine/dicarboxylic acid cocrystals","CrystEngComm","2014","16","41","9603","","10.1039/C4CE01495B","","","0.82103","synchrotron","","0.0906","0.0721","","","0.1444","0.1504","","","","","","1.019","","","","has coordinates,has disorder","180509","2020-10-21","18:00:00",""
"7217869","7.6414","0.0006","15.7487","0.0009","39.13","0.003","90","","90","","90","","4709","0.6","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C21 H26 N8 O8 -","- C21 H26 N8 O8 -","- C168 H208 N64 O64 -","8","1","","Leyssens, T.; Tumanova, N.; Robeyns, K.; Candoni, N.; Veesler, S.","Solution cocrystallization, an effective tool to explore the variety of cocrystal systems: caffeine/dicarboxylic acid cocrystals","CrystEngComm","2014","16","41","9603","","10.1039/C4CE01495B","","","0.71073","MoKα","","0.0857","0.0503","","","0.1264","0.1469","","","","","","1.034","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217870","8.5926","0.0003","18.4382","0.0007","14.9164","0.0005","90","","92.437","0.003","90","","2361.1","0.15","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 N8 O8 -","- C21 H26 N8 O8 -","- C84 H104 N32 O32 -","4","1","","Leyssens, T.; Tumanova, N.; Robeyns, K.; Candoni, N.; Veesler, S.","Solution cocrystallization, an effective tool to explore the variety of cocrystal systems: caffeine/dicarboxylic acid cocrystals","CrystEngComm","2014","16","41","9603","","10.1039/C4CE01495B","","","0.71073","MoKα","","0.0812","0.0646","","","0.1674","0.1798","","","","","","1.05","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217871","7.9317","0.0006","8.2797","0.0002","20.4795","0.0015","89.975","0.006","83.335","0.006","61.808","0.006","1175.1","0.15","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H26 N8 O8 -","- C21 H26 N8 O8 -","- C42 H52 N16 O16 -","2","1","","Leyssens, T.; Tumanova, N.; Robeyns, K.; Candoni, N.; Veesler, S.","Solution cocrystallization, an effective tool to explore the variety of cocrystal systems: caffeine/dicarboxylic acid cocrystals","CrystEngComm","2014","16","41","9603","","10.1039/C4CE01495B","","","0.71073","MoKα","","0.0704","0.0651","","","0.1626","0.1662","","","","","","1.126","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217872","44.164","0.003","3.94516","0.00019","27.676","0.003","90","","96.236","0.008","90","","4793.6","0.7","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C44 H55 N17 O16 -","- C44 H55 N17 O16 -","- C176 H220 N68 O64 -","4","1","","Leyssens, T.; Tumanova, N.; Robeyns, K.; Candoni, N.; Veesler, S.","Solution cocrystallization, an effective tool to explore the variety of cocrystal systems: caffeine/dicarboxylic acid cocrystals","CrystEngComm","2014","16","41","9603","","10.1039/C4CE01495B","","","0.82103","synchrotron","","0.1003","0.0951","","","0.2474","0.2544","","","","","","1.037","","","","has coordinates","180509","2020-10-21","18:00:00",""
"7217975","26.73","0.04","6.863","0.008","13.068","0.018","90","","110.22","0.07","90","","2250","5","293","2","293","2","4800000","","4800000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido(1,2-bis(dimethylphosphino)benzene)germanium(II)","","- C10 H16 Cl2 Ge P2 -","- C10 H16 Cl2 Ge P2 -","- C80 H128 Cl16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.4859","Synchrotron","","0.1416","0.0938","","","0.1526","0.1784","","","","","","1.126","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217976","27.82","0.08","7.38","0.02","13.96","0.04","90","","109.73","0.16","90","","2698","13","293","2","293","2","100000","","100000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido(1,2-bis(dimethylphosphino)benzene)germanium(II)","","- C10 H16 Cl2 Ge P2 -","- C10 H16 Cl2 Ge P2 -","- C80 H128 Cl16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.4859","synchrotron","","0.1696","0.098","","","0.2153","0.2795","","","","","","1.096","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217977","27.99","0.04","7.325","0.01","13.88","0.02","90","","110.29","0.08","90","","2669","7","293","2","293","2","1100000","","1100000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido(1,2-bis(dimethylphosphino)benzene)germanium(II)","","- C10 H16 Cl2 Ge P2 -","- C10 H16 Cl2 Ge P2 -","- C80 H128 Cl16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.4859","Synchrotron","","0.1813","0.1238","","","0.2272","0.2733","","","","","","1.092","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217978","27.691","0.016","7.225","0.003","13.704","0.004","90","","110","0.03","90","","2576","2","293","2","293","","1400000","","1400000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido(1,2-bis(dimethylphosphino)benzene)germanium(II)","","- C10 H16 Cl2 Ge P2 -","- C10 H16 Cl2 Ge P2 -","- C80 H128 Cl16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.4859","synchrotron","","0.1954","0.1138","","","0.2252","0.2981","","","","","","1.123","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217979","27.38","0.008","7.0724","0.0014","13.445","0.002","90","","110.187","0.015","90","","2443.6","1","293","2","293.15","","3000000","","3000000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido(1,2-bis(dimethylphosphino)benzene)germanium(II)","","- C10 H16 Cl2 Ge P2 -","- C10 H16 Cl2 Ge P2 -","- C80 H128 Cl16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.4859","synchrotron","","0.1795","0.1115","","","0.2177","0.2822","","","","","","1.114","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217980","26.91","0.04","6.962","0.008","13.249","0.018","90","","110.3","0.07","90","","2328","5","293","2","293","2","3800000","","3800000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido(1,2-bis(dimethylphosphino)benzene)germanium(II)","","- C10 H16 Cl2 Ge P2 -","- C10 H16 Cl2 Ge P2 -","- C80 H128 Cl16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.4859","Synchrotron","","0.1471","0.0969","","","0.1691","0.203","","","","","","1.004","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217981","24.3","0.13","6.83","0.03","13.37","0.07","90","","92.3","0.3","90","","2217","19","293","2","293","","9400000","","9400000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.1391","0.1005","","","0.2415","0.2729","","","","","","1.121","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217982","29.46","0.04","7.628","0.009","14.51","0.017","90","","111.334","0.018","90","","3037","7","293","","293","","100","","100","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.1311","0.0792","","","0.1522","0.1904","","","","","","1.156","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217983","29.22","0.04","7.578","0.008","14.434","0.018","90","","111.13","0.02","90","","2981","6","293","2","293","","200000","","200000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.183","0.0909","","","0.2416","0.349","","","","","","1.029","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217984","28.41","0.03","7.339","0.005","14.008","0.013","90","","111.53","0.02","90","","2717","4","293","2","293","","1100000","","1100000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.1468","0.0838","","","0.2366","0.3289","","","","","","1.179","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217985","27.88","0.03","7.166","0.006","13.692","0.013","90","","111.678","0.015","90","","2542","4","293","2","293","","2700000","","2700000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.1132","0.083","","","0.2495","0.3198","","","","","","1.286","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217986","25.79","0.1","7.17","0.03","14.06","0.05","90","","92.24","0.08","90","","2598","17","293","2","293","","4100000","","4100000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.178","0.1146","","","0.2847","0.3481","","","","","","1.106","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217987","24.773","0.01","6.98","0.03","13.67","0.05","90","","92.25","0.11","90","","2362","13","293","2","293","","5400000","","5400000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","synchrotron","","0.1576","0.1077","","","0.2252","0.2628","","","","","","1.046","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217988","24.73","0.06","6.956","0.013","13.63","0.03","90","","92.59","0.06","90","","2342","9","293","2","293","","6300000","","6300000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","","","0.1659","0.1072","","","0.234","0.2808","","","","","","1.118","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7217989","24.56","0.16","6.89","0.04","13.52","0.08","90","","92.65","0.18","90","","2285","2","293","2","293","","8000000","","100000","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromo(1,2-bis(dimethylphosphino)benzene-P,P')germanium(II)","","- C10 H16 Br2 Ge P2 -","- C10 H16 Br2 Ge P2 -","- C80 H128 Br16 Ge8 P16 -","8","1","","Allan, David R.; Coles, Simon J.; George, Kathryn; Jura, Marek; Levason, William; Reid, Gillian; Wilson, Claire; Zhang, Wenjian","Exploring secondary bonding in p-block chemistry ‒ an experimental study of [GeX2{o-C6H4(PMe2)2}] using variable pressure single crystal X-ray diffraction","CrystEngComm","2014","16","35","8169","","10.1039/C4CE00329B","","","0.6889","","","0.1591","0.103","","","0.2284","0.2652","","","","","","1.065","","","","has coordinates","180510","2020-10-21","18:00:00",""
"7218021","20.184","0.004","20.184","0.004","13.719","0.003","90","","90","","90","","5589","2","150","2","150","2","","","","","","","","5","I 41","I 4bw","80","","","","- C32 H32 Co N2 O5 -","- C32 H32 Co N2 O5 -","- C256 H256 Co8 N16 O40 -","8","1","","Banerjee, Subarna; Rajakannu, Palanisamy; Butcher, Raymond J.; Murugavel, Ramaswamy","Auxiliary ligand-aided tuning of aggregation of transition metal benzoates: isolation of four different types of coordination polymers","CrystEngComm","2014","16","36","8429","","10.1039/C4CE01043D","","","0.71075","MoKα","","0.0339","0.0334","","","0.0886","0.0891","","","","","","0.852","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218037","22.9973","0.0004","22.9973","0.0004","22.5955","0.0007","90","","90","","90","","11950.2","0.5","293","2","293","2","","","","","","","","5","P 4 21 2","P 4ab 2ab","90","","","","- C102 H131 Cd3 N2 O47.5 -","- C102 H104 Cd3 N2 O47.5 -","- C408 H416 Cd12 N8 O190 -","4","0.5","","Jiang, Wei; Zhang, Hang; Yang, Jin; Liu, Ying-Ying; Liu, Hai-Yan; Ma, Jian-Fang","Three resorcin[4]arene-based complexes with Cu(ii)-exchange characteristics and fluorescence sensing of polyoxometalates in aqueous solutions","CrystEngComm","2014","16","41","9638","","10.1039/C4CE01376J","","","0.71073","MoKα","","0.2048","0.1146","","","0.2694","0.3376","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218038","17.6923","0.0007","15.6746","0.0007","42.594","0.0011","90","","90","","90","","11812.2","0.8","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C96 H96 O36 Zn4 -","- C96 H88 O36 Zn4 -","- C384 H352 O144 Zn16 -","4","1","","Jiang, Wei; Zhang, Hang; Yang, Jin; Liu, Ying-Ying; Liu, Hai-Yan; Ma, Jian-Fang","Three resorcin[4]arene-based complexes with Cu(ii)-exchange characteristics and fluorescence sensing of polyoxometalates in aqueous solutions","CrystEngComm","2014","16","41","9638","","10.1039/C4CE01376J","","","1.54184","CuKα","","0.1247","0.0998","","","0.2696","0.2953","","","","","","1.011","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218039","11.8811","0.0006","20.9902","0.0014","21.3711","0.0011","79.558","0.005","81.534","0.004","86.36","0.005","5180.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C206 H250 Mn9 N4 O94 -","- C206 H206 Mn9 N4 O94 -","- C206 H206 Mn9 N4 O94 -","1","0.5","","Jiang, Wei; Zhang, Hang; Yang, Jin; Liu, Ying-Ying; Liu, Hai-Yan; Ma, Jian-Fang","Three resorcin[4]arene-based complexes with Cu(ii)-exchange characteristics and fluorescence sensing of polyoxometalates in aqueous solutions","CrystEngComm","2014","16","41","9638","","10.1039/C4CE01376J","","","0.71073","MoKα","","0.2061","0.0962","","","0.2144","0.2808","","","","","","1.025","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218040","12.2409","0.0006","13.5072","0.0007","20.2897","0.0014","103.942","0.01","100.864","0.008","93.222","0.005","3179.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H87 N O18 Zn2 -","- C62 H65 N O18 Zn2 -","- C124 H130 N2 O36 Zn4 -","2","1","","Li, Xiao-Tong; Li, Jing; Li, Meng; Liu, Ying-Ying; Song, Shu-Yan; Ma, Jian-Fang","An unusual lamellar framework constructed from a tetracarboxylatocalix[4]arene with highly efficient metal-ion exchange","CrystEngComm","2014","16","40","9520","","10.1039/C4CE01463D","","","0.71073","MoKα","","0.0643","0.0467","","","0.1191","0.132","","","","","","1.029","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218041","11.969","0.001","14.298","0.002","19.673","0.0013","88.059","0.004","89.676","0.006","83.535","0.005","3343.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C120 H194 N4 O45 Zn2 -","- C120 H126 N4 O45 Zn2 -","- C120 H126 N4 O45 Zn2 -","1","0.5","","Li, Xiao-Tong; Li, Jing; Li, Meng; Liu, Ying-Ying; Song, Shu-Yan; Ma, Jian-Fang","An unusual lamellar framework constructed from a tetracarboxylatocalix[4]arene with highly efficient metal-ion exchange","CrystEngComm","2014","16","40","9520","","10.1039/C4CE01463D","","","0.71069","MoKα","","0.1189","0.0737","","","0.1698","0.1934","","","","","","1.12","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218042","11.9388","0.0014","15.036","0.002","20.9814","0.0012","84.88","0.006","80.637","0.004","71.171","0.003","3514.6","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H94 Cd2 N2 O20 -","- C66 H72 Cd2 N2 O20 -","- C132 H144 Cd4 N4 O40 -","2","1","","Li, Xiao-Tong; Li, Jing; Li, Meng; Liu, Ying-Ying; Song, Shu-Yan; Ma, Jian-Fang","An unusual lamellar framework constructed from a tetracarboxylatocalix[4]arene with highly efficient metal-ion exchange","CrystEngComm","2014","16","40","9520","","10.1039/C4CE01463D","","","0.71073","MoKα","","0.1333","0.0871","","","0.1744","0.1965","","","","","","1.114","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218049","33.174","0.007","5.5878","0.0011","20.516","0.004","90","","127.93","0.03","90","","2999.7","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 N2 O4 P Zn -","- C14 H16 N2 O4 P Zn -","- C112 H128 N16 O32 P8 Zn8 -","8","1","","Zhou, Ming-Jie; Li, Bing; Liu, Li; Feng, Yan-Long; Guo, Jian-Zhong","Two polymorphs of zinc(ii) coordination polymers constructed from 2-carboxyethyl(phenyl)phosphinate and 1,4-bis(1H-imidazol-1-yl)butane ligands","CrystEngComm","2014","16","43","10034","","10.1039/C4CE01102C","","","0.71073","MoKα","","0.0896","0.0502","","","0.1083","0.1562","","","","","","1.144","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218050","11.496","0.002","13.665","0.003","11.051","0.002","90","","116.53","0.03","90","","1553.2","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N2 O4 P Zn -","- C14 H16 N2 O4 P Zn -","- C56 H64 N8 O16 P4 Zn4 -","4","1","","Zhou, Ming-Jie; Li, Bing; Liu, Li; Feng, Yan-Long; Guo, Jian-Zhong","Two polymorphs of zinc(ii) coordination polymers constructed from 2-carboxyethyl(phenyl)phosphinate and 1,4-bis(1H-imidazol-1-yl)butane ligands","CrystEngComm","2014","16","43","10034","","10.1039/C4CE01102C","","","0.71073","MoKα","","0.062","0.0544","","","0.164","0.1681","","","","","","1.139","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218051","4.0513","0.0009","11.154","0.002","12.902","0.003","104.617","0.011","94.207","0.011","94.195","0.012","560.1","0.2","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","1,5-dimethyl-3-(p-ethynylphenyl)-6-oxoverdazyl","","- C12 H11 N4 O -","- C12 H11 N4 O -","- C24 H22 N8 O2 -","2","1","","Merhi, Areej; Roisnel, Thierry; Rigaut, Stéphane; Train, Cyrille; Norel, Lucie","Ferromagnetic intermolecular exchange interaction in ethynyl-verdazyl radical crystals","CrystEngComm","2014","16","42","9783","","10.1039/C4CE01437E","","x-ray","0.71073","MoKα","","0.0959","0.0537","","","0.1406","0.1663","","","","","","0.993","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218052","3.994","0.0004","11.1412","0.0009","12.8857","0.0011","104.875","0.004","94.557","0.004","93.967","0.004","550.03","0.09","200","2","200","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C12 H11 N4 O -","- C12 H11 N4 O -","- C24 H22 N8 O2 -","2","1","","Merhi, Areej; Roisnel, Thierry; Rigaut, Stéphane; Train, Cyrille; Norel, Lucie","Ferromagnetic intermolecular exchange interaction in ethynyl-verdazyl radical crystals","CrystEngComm","2014","16","42","9783","","10.1039/C4CE01437E","","x-ray","0.71073","MoKα","","0.0763","0.0502","","","0.1192","0.134","","","","","","0.957","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218053","3.9458","0.0002","11.1337","0.0004","12.8406","0.0005","105.091","0.002","95.1","0.002","93.601","0.002","540.32","0.04","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C12 H11 N4 O -","- C12 H11 N4 O -","- C24 H22 N8 O2 -","2","1","","Merhi, Areej; Roisnel, Thierry; Rigaut, Stéphane; Train, Cyrille; Norel, Lucie","Ferromagnetic intermolecular exchange interaction in ethynyl-verdazyl radical crystals","CrystEngComm","2014","16","42","9783","","10.1039/C4CE01437E","","x-ray","0.71073","MoKα","","0.0609","0.047","","","0.1207","0.1299","","","","","","1.014","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218054","9.536","0.0003","12.7918","0.0005","13.7773","0.0005","73.402","0.003","80.926","0.003","68.325","0.003","1494.11","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H30 Cd Cl2 N10 -","- C26 H30 Cd Cl2 N10 -","- C52 H60 Cd2 Cl4 N20 -","2","1","","Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui","Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties","CrystEngComm","2014","16","42","9896","","10.1039/C4CE01456A","","","1.54184","CuKα","","0.0334","0.0295","","","0.0765","0.0793","","","","","","1.017","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218055","9.4788","0.0004","10.2419","0.0005","10.5173","0.0002","95.716","0.003","99.798","0.003","109.484","0.004","934.99","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H15 Cd N7 S2 -","- C15 H15 Cd N7 S2 -","- C30 H30 Cd2 N14 S4 -","2","1","","Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui","Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties","CrystEngComm","2014","16","42","9896","","10.1039/C4CE01456A","","","1.54184","CuKα","","0.0364","0.0351","","","0.0959","0.0977","","","","","","1.039","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218056","12.46876","0.00011","15.99954","0.00013","19.46996","0.00019","90","","103.059","0.0009","90","","3783.7","0.06","293","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H38 Cd2 Cl2 N16 O2 -","- C28 H38 Cd2 Cl2 N16 O2 -","- C112 H152 Cd8 Cl8 N64 O8 -","4","1","","Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui","Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties","CrystEngComm","2014","16","42","9896","","10.1039/C4CE01456A","","","1.5418","CuKα","","0.0305","0.028","","","0.076","0.0783","","","","","","1.045","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218057","9.3734","0.0005","18.5736","0.0005","9.2232","0.0003","90","","107.887","0.005","90","","1528.12","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 Cd Cl2 N5 -","- C13 H15 Cd Cl2 N5 -","- C52 H60 Cd4 Cl8 N20 -","4","1","","Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui","Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties","CrystEngComm","2014","16","42","9896","","10.1039/C4CE01456A","","","1.54184","CuKα","","0.0321","0.0279","","","0.0725","0.0761","","","","","","1.042","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218058","9.555","0.001","9.8491","0.0012","9.885","0.0009","72.948","0.01","68.962","0.009","86.711","0.01","828.88","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H15 Cd N11 -","- C13 H15 Cd N11 -","- C26 H30 Cd2 N22 -","2","1","","Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui","Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties","CrystEngComm","2014","16","42","9896","","10.1039/C4CE01456A","","","1.54184","CuKα","","0.0249","0.0232","","","0.0584","0.0594","","","","","","1.053","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218059","26.5918","0.0009","13.5595","0.0005","18.1128","0.0006","90","","94.582","0.003","90","","6510.1","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H34 Cd N12 O7 -","- C27 H34 Cd N12 O7 -","- C216 H272 Cd8 N96 O56 -","8","1","","Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui","Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties","CrystEngComm","2014","16","42","9896","","10.1039/C4CE01456A","","","0.71073","MoKα","","0.0688","0.0483","","","0.1063","0.1193","","","","","","1.05","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218060","14.4906","0.0004","13.7504","0.0005","18.9091","0.0007","90","","95.28","0.003","90","","3751.7","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H62 Cu2 Mo8 N16 O26 -","- C60 H62 Cu2 Mo8 N16 O26 -","- C120 H124 Cu4 Mo16 N32 O52 -","2","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.08","0.0422","","","0.0757","0.0887","","","","","","0.959","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218061","17.359","0.0006","12.5591","0.0004","25.123","0.0007","90","","90","","90","","5477.2","0.3","150","2","150","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C48 H40 Cu2 Mo6 N12 O19 -","- C48 H40 Cu2 Mo6 N12 O19 -","- C192 H160 Cu8 Mo24 N48 O76 -","4","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.082","0.0438","","","0.0716","0.0861","","","","","","0.987","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218062","10.4332","0.0002","15.1148","0.0003","20.2219","0.0005","90","","109.501","0.002","90","","3005.98","0.12","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H44 Cu2 Mo8 N12 O28 -","- C48 H40 Cu2 Mo8 N12 O26 -","- C96 H80 Cu4 Mo16 N24 O52 -","2","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.0354","0.0259","","","0.0604","0.0658","","","","","","1.022","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218063","15.307","0.003","21.194","0.004","15.805","0.003","90","","110.53","0.03","90","","4801.8","1.9","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C80 H70 Cu4 Mo8 N24 O29 -","- C80 H64 Cu4 Mo8 N24 O29 -","- C160 H128 Cu8 Mo16 N48 O58 -","2","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.063","0.0417","","","0.0835","0.091","","","","","","1.02","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218064","14.8527","0.0006","15.7723","0.0005","17.4004","0.0006","72.343","0.003","66.337","0.004","63.668","0.003","3306.9","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H96 Cu4 Mo16 N24 O60 -","- C96 H80 Cu4 Mo16 N24 O60 -","- C96 H80 Cu4 Mo16 N24 O60 -","1","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.1508","0.0721","","","0.1292","0.1706","","","","","","1.008","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218065","22.82","0.005","14.239","0.003","25.933","0.005","90","","91.55","0.03","90","","8423","3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C72 H62 Cu4 Mo8 N18 O27 -","- C72 H60 Cu4 Mo8 N18 O27 -","- C288 H240 Cu16 Mo32 N72 O108 -","4","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.131","0.0608","","","0.1101","0.1326","","","","","","1.02","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218066","13.7656","0.0006","14.8306","0.0006","16.0531","0.0005","117.47","0.003","109.431","0.003","91.167","0.003","2682.3","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H80 Cu4 Mo8 N24 O26 -","- C96 H80 Cu4 Mo8 N24 O26 -","- C96 H80 Cu4 Mo8 N24 O26 -","1","0.5","","Hao, Xiu-Li; Ma, Yuan-Yuan; Wang, Yong-Hui; Zang, Hong-Ying; Li, Yang-Guang","Isopolymolybdate-induced organic‒inorganic hybrid assemblies with copper ions and bichelate-bridging ligands","CrystEngComm","2014","16","43","10017","","10.1039/C4CE01591F","","","0.71073","MoKα","","0.1123","0.0586","","","0.1202","0.1471","","","","","","0.957","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218079","16.417","0.002","16.417","0.002","6.598","0.002","90","","90","","90","","1778.3","0.6","298","2","298","2","","","","","","","","5","P 4/n :2","-P 4a","85","","","","- C28 H40 Cu N5 O7 -","- C28 H32 Cu N5 O7 -","- C56 H64 Cu2 N10 O14 -","2","0.25","","Wu, Jian; Liu, Jian-Qiang; Jia, Zhen-Bin; Li, Qing-Lin; Li, Kai-Bang; Li, Hao; Daiguebonne, Carole; Calvez, Guillaume; Guillou, Olivier","A new 3D four-fold interpenetrateddia-like polymer: gas sorption and computational analyses","CrystEngComm","2014","16","45","10410","","10.1039/C4CE01404A","","","0.71073","MoKα","","0.1116","0.0482","","","0.0823","0.0987","","","","","","1.008","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218088","9.0885","0.0019","10.008","0.002","10.316","0.002","84.68","0.003","83.399","0.003","66.85","0.003","855.9","0.3","123","2","123","2","","","","","","","","5","P 1","P 1","1","","","","- C33 H38 Ag N5 O7 -","- C33 H38 Ag N5 O7 -","- C33 H38 Ag N5 O7 -","1","1","","Cheng, Lin; Wang, Jun; Qi, Qi; Zhang, Xiuying; Yu, Haiyan; Gou, Shaohua; Fang, Lei","Temperature-induced one-dimensional chiral Ag(i) linear chains and left-handed 21helices: DFT studies, luminescence and SHG response","CrystEngComm","2014","16","43","10056","","10.1039/C4CE01601G","","","0.71073","MoKα","","0.0923","0.0841","","","0.1743","0.1811","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218089","10.9284","0.0012","13.1429","0.0014","23.209","0.002","90","","90","","90","","3333.5","0.6","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H38 Ag N5 O8 -","- C32 H38 Ag N5 O8 -","- C128 H152 Ag4 N20 O32 -","4","1","","Cheng, Lin; Wang, Jun; Qi, Qi; Zhang, Xiuying; Yu, Haiyan; Gou, Shaohua; Fang, Lei","Temperature-induced one-dimensional chiral Ag(i) linear chains and left-handed 21helices: DFT studies, luminescence and SHG response","CrystEngComm","2014","16","43","10056","","10.1039/C4CE01601G","","","0.71073","MoKα","","0.096","0.0594","","","0.1467","0.1686","","","","","","1.073","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218090","9.1852","0.0015","10.2742","0.0017","10.3527","0.0017","84.69","0.002","83.518","0.002","65.526","0.002","882.4","0.3","123","2","123","2","","","","","","","","6","P 1","P 1","1","","","","- C33 H38 Ag Cl N4 O8 -","- C33 H38 Ag Cl N4 O8 -","- C33 H38 Ag Cl N4 O8 -","1","1","","Cheng, Lin; Wang, Jun; Qi, Qi; Zhang, Xiuying; Yu, Haiyan; Gou, Shaohua; Fang, Lei","Temperature-induced one-dimensional chiral Ag(i) linear chains and left-handed 21helices: DFT studies, luminescence and SHG response","CrystEngComm","2014","16","43","10056","","10.1039/C4CE01601G","","","0.71073","MoKα","","0.0864","0.0748","","","0.1597","0.1666","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218091","10.9131","0.0016","13.0435","0.0019","22.908","0.004","90","","90","","90","","3260.8","0.9","123","2","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H38 Ag Cl N4 O9 -","- C32 H38 Ag Cl N4 O9 -","- C128 H152 Ag4 Cl4 N16 O36 -","4","1","","Cheng, Lin; Wang, Jun; Qi, Qi; Zhang, Xiuying; Yu, Haiyan; Gou, Shaohua; Fang, Lei","Temperature-induced one-dimensional chiral Ag(i) linear chains and left-handed 21helices: DFT studies, luminescence and SHG response","CrystEngComm","2014","16","43","10056","","10.1039/C4CE01601G","","","0.71073","MoKα","","0.0984","0.0748","","","0.156","0.1693","","","","","","1.025","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218092","13.6251","0.0014","14.7386","0.0015","16.4916","0.0017","90","","95.699","0.002","90","","3295.4","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H52 Cu2 Mo8 N12 O32 -","- C48 H46 Cu2 Mo8 N12 O32 -","- C96 H92 Cu4 Mo16 N24 O64 -","2","0.5","","Tripuramallu, Bharat Kumar; Manna, Paulami; Das, Samar K.","Supramolecular interactions mediated conformational modulation of flexible linker leading to the isolation of a metallo-macrocycle in a polyoxometalate matrix: Hirshfeld surfaces and 2D fingerprint plots","CrystEngComm","2014","16","44","10300","","10.1039/C4CE01714E","","","0.71073","MoKα","","0.0914","0.0663","","","0.1372","0.1472","","","","","","1.099","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218093","21.8268","0.0005","3.9863","0.0001","7.1628","0.0002","90","","90","","90","","623.22","0.03","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C2 H Ag N2 O Pb S -","- C2 H Ag N2 O Pb S -","- C8 H4 Ag4 N8 O4 Pb4 S4 -","4","0.5","","Diana, Eliano; Gervasio, Giuliana; Priola, Emanuele; Bonometti, Elisabetta","A new heterometallic multiligand 3D coordination polymer: synthesis and structure of [Pb(OH)]n[Ag(SCN)(CN)]n","CrystEngComm","2014","16","43","10040","","10.1039/C4CE01424C","","","0.71073","MoKα","","0.0302","0.0245","","","0.0578","0.0608","","","","","","1.092","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218094","8.23","0.0002","11.8142","0.0003","17.1253","0.0003","90","","90","","90","","1665.11","0.07","233","2","233","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H12 Br2 O2 -","- C20 H12 Br2 O2 -","- C80 H48 Br8 O8 -","4","1","","Agnes, Marco; Sorrenti, Alessandro; Pasini, Dario; Wurst, Klaus; Amabilino, David B.","Crystal structure analyses facilitate understanding of synthesis protocols in the preparation of 6,6′-dibromo-substituted BINOL compounds","CrystEngComm","2014","16","43","10131","","10.1039/C4CE01160K","","","0.71073","MoKα","","0.0342","0.0288","","","0.0676","0.0699","","","","","","1.047","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218095","9.0274","0.0002","20.4427","0.0004","14.5383","0.0003","90","","99.274","0.001","90","","2647.89","0.1","233","2","233","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H28 Br2 O6 -","- C28 H28 Br2 O6 -","- C112 H112 Br8 O24 -","4","2","","Agnes, Marco; Sorrenti, Alessandro; Pasini, Dario; Wurst, Klaus; Amabilino, David B.","Crystal structure analyses facilitate understanding of synthesis protocols in the preparation of 6,6′-dibromo-substituted BINOL compounds","CrystEngComm","2014","16","43","10131","","10.1039/C4CE01160K","","","0.71073","MoKα","","0.056","0.042","","","0.0962","0.1021","","","","","","1.028","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218096","9.9622","0.0003","8.3317","0.0002","19.9628","0.0005","90","","98.208","0.001","90","","1639.98","0.08","233","2","233","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H12 Br2 O2 -","- C20 H12 Br2 O2 -","- C80 H48 Br8 O8 -","4","1","","Agnes, Marco; Sorrenti, Alessandro; Pasini, Dario; Wurst, Klaus; Amabilino, David B.","Crystal structure analyses facilitate understanding of synthesis protocols in the preparation of 6,6′-dibromo-substituted BINOL compounds","CrystEngComm","2014","16","43","10131","","10.1039/C4CE01160K","","","0.71073","MoKα","","0.0389","0.0304","","","0.0724","0.0758","","","","","","1.042","","","","has coordinates","180511","2020-10-21","18:00:00",""
"7218097","9.8523","0.0003","10.1793","0.0003","13.922","0.0003","70.723","0.002","89.926","0.002","82.549","0.002","1305.53","0.06","233","2","233","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H28 Br2 O6 -","- C28 H28 Br2 O6 -","- C56 H56 Br4 O12 -","2","1","","Agnes, Marco; Sorrenti, Alessandro; Pasini, Dario; Wurst, Klaus; Amabilino, David B.","Crystal structure analyses facilitate understanding of synthesis protocols in the preparation of 6,6′-dibromo-substituted BINOL compounds","CrystEngComm","2014","16","43","10131","","10.1039/C4CE01160K","","","0.71073","MoKα","","0.0499","0.0357","","","0.0804","0.0851","","","","","","1.062","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218098","8.8364","0.0002","10.5814","0.0003","14.7993","0.0003","108.781","0.001","94.787","0.001","97.419","0.001","1287.54","0.05","233","2","233","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H24 Br2 O6 -","- C28 H24 Br2 O6 -","- C56 H48 Br4 O12 -","2","1","","Agnes, Marco; Sorrenti, Alessandro; Pasini, Dario; Wurst, Klaus; Amabilino, David B.","Crystal structure analyses facilitate understanding of synthesis protocols in the preparation of 6,6′-dibromo-substituted BINOL compounds","CrystEngComm","2014","16","43","10131","","10.1039/C4CE01160K","","","0.71073","MoKα","","0.0514","0.0359","","","0.0815","0.0872","","","","","","1.039","","","","has coordinates,has disorder","180511","2020-10-21","18:00:00",""
"7218117","9.3677","0.0015","11.2409","0.0017","14.585","0.002","72.567","0.002","73.543","0.002","78.799","0.002","1395.2","0.4","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H36 N2 O2 S2 -","- C32 H36 N2 O2 S2 -","- C64 H72 N4 O4 S4 -","2","1","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.0873","0.0495","","","0.1026","0.1186","","","","","","0.803","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218118","9.366","0.003","14.783","0.005","15.276","0.005","113.609","0.005","100.615","0.006","92.18","0.005","1890.1","1.1","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H56 N2 O2 S2 -","- C42 H56 N2 O2 S2 -","- C84 H112 N4 O4 S4 -","2","1","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.1171","0.0583","","","0.0987","0.1192","","","","","","0.867","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218119","10.636","0.003","9.486","0.003","15.273","0.004","90","","104.878","0.005","90","","1489.3","0.7","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H40 N2 O2 S2 -","- C34 H40 N2 O2 S2 -","- C68 H80 N4 O4 S4 -","2","0.5","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.1477","0.051","","","0.0614","0.0805","","","","","","0.705","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218120","11.1","0.0014","9.2665","0.0011","16.096","0.002","90","","108.132","0.002","90","","1573.4","0.3","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H44 N2 O2 S2 -","- C36 H44 N2 O2 S2 -","- C72 H88 N4 O4 S4 -","2","0.5","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.0563","0.0404","","","0.0832","0.0892","","","","","","0.956","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218121","9.3276","0.0014","13.142","0.0019","15.226","0.002","108.135","0.003","100.865","0.003","98.281","0.002","1700.4","0.4","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 N2 O2 S2 -","- C38 H48 N2 O2 S2 -","- C76 H96 N4 O4 S4 -","2","1","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.1371","0.0515","","","0.0827","0.1129","","","","","","0.69","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218122","9.3051","0.0006","14.0599","0.0009","14.9553","0.0009","80.646","0.001","75.132","0.001","72.905","0.001","1799.5","0.2","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H52 N2 O2 S2 -","- C40 H52 N2 O2 S2 -","- C80 H104 N4 O4 S4 -","2","1","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.0779","0.0534","","","0.1254","0.1424","","","","","","0.982","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218123","7.8143","0.0005","9.4382","0.0006","15.2024","0.001","77.742","0.001","76.215","0.001","66.063","0.001","986.79","0.11","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H60 N2 O2 S2 -","- C44 H60 N2 O2 S2 -","- C44 H60 N2 O2 S2 -","1","0.5","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.0711","0.0448","","","0.0899","0.1209","","","","","","0.916","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218124","7.7725","0.0007","9.4508","0.0009","16.2932","0.0016","90.218","0.002","97.616","0.002","113.987","0.002","1081.63","0.18","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H68 N2 O2 S2 -","- C48 H68 N2 O2 S2 -","- C48 H68 N2 O2 S2 -","1","0.5","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.068","0.0476","","","0.1011","0.1255","","","","","","1.021","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218125","7.772","0.002","9.476","0.003","17.514","0.005","89.954","0.005","89.316","0.006","66.055","0.006","1178.8","0.6","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H76 N2 O2 S2 -","- C52 H76 N2 O2 S2 -","- C52 H76 N2 O2 S2 -","1","0.5","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.2059","0.0801","","","0.1493","0.2262","","","","","","0.861","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218126","7.7947","0.001","9.4518","0.0012","18.843","0.003","90.701","0.002","94.869","0.003","113.934","0.002","1262.6","0.3","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C56 H84 N2 O2 S2 -","- C56 H84 N2 O2 S2 -","- C56 H84 N2 O2 S2 -","1","0.5","","Ueji, Kan; Ichimura, Shuhei; Tamaki, Yoshinori; Miyamura, Kazuo","Effects of alkyl chain substitution on the crystal structure of benzothiazole-derived squarylium dyes","CrystEngComm","2014","16","43","10139","","10.1039/C4CE01571A","","","0.71073","MoKα","","0.126","0.0491","","","0.0907","0.1467","","","","","","0.749","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218127","11.4551","0.0001","4.95346","0.00005","18.1676","0.0002","90","","90","","90","","1030.87","0.018","303","","303","","","","","","","","","4","P b c a","-P 2ac 2ab","61","BiGeO2(OH)2(NO3)","bisnuth germanium oxyhydroxy nitrate","","- Bi Ge N O7 -","- Bi Ge H N O7 -","- Bi8 Ge8 H8 N8 O56 -","8","1","","Kobayashi, Kiyoshi; Ikeda, Takuji; Hiyoshi, Norihito; Sakka, Yoshio","Discovery of a new crystalline phase: BiGeO2(OH)2(NO3)","CrystEngComm","2014","16","43","10080","","10.1039/C4CE01355G","powder diffraction","","1.54059","CuKα~1~","","0.00813","","","","","","0.00768","0.01331","1.9828","","","","","","","has coordinates","190823","2020-10-21","18:00:00",""
"7218128","9.4633","0.0004","12.6496","0.0004","10.8834","0.0004","90","","104.267","0.004","90","","1262.64","0.08","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","p-xylylenebis(thioacetic) acid","","- C12 H14 O4 S2 -","- C12 H14 O4 S2 -","- C48 H56 O16 S8 -","4","0.5","","Ostasz, A.; Łyszczek, R.; Mazur, L.; Tarasiuk, B.","Co-crystal formation between 2-amino-4,6-dimethylpyrimidine and new p-xylylene-bis(thioacetic) acid","CrystEngComm","2014","16","44","10262","","10.1039/C4CE01567C","","","0.71073","MoKα","","0.0341","0.032","","","0.0817","0.0841","","","","","","1.153","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218129","17.6366","0.0018","4.8355","0.0005","15.593","0.0017","90","","96.069","0.01","90","","1322.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 N6 O4 S2 -","- C24 H32 N6 O4 S2 -","- C48 H64 N12 O8 S4 -","2","0.5","","Ostasz, A.; Łyszczek, R.; Mazur, L.; Tarasiuk, B.","Co-crystal formation between 2-amino-4,6-dimethylpyrimidine and new p-xylylene-bis(thioacetic) acid","CrystEngComm","2014","16","44","10262","","10.1039/C4CE01567C","","","0.71073","MoKα","","0.0721","0.0579","","","0.1489","0.1565","","","","","","1.041","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218130","20.968","0.003","4.7107","0.0005","14.4013","0.0016","90","","95.307","0.01","90","","1416.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 N6 O6 S2 -","- C24 H36 N6 O6 S2 -","- C48 H72 N12 O12 S4 -","2","0.5","","Ostasz, A.; Łyszczek, R.; Mazur, L.; Tarasiuk, B.","Co-crystal formation between 2-amino-4,6-dimethylpyrimidine and new p-xylylene-bis(thioacetic) acid","CrystEngComm","2014","16","44","10262","","10.1039/C4CE01567C","","","0.71073","MoKα","","0.0989","0.0651","","","0.1371","0.1534","","","","","","1.105","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218131","32.932","0.007","7.9668","0.0016","15.275","0.003","90","","90","","90","","4007.6","1.4","100","2","100","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C18 H23 N3 O4 S2 -","- C18 H23 N3 O4 S2 -","- C144 H184 N24 O32 S16 -","8","","","Ostasz, A.; Łyszczek, R.; Mazur, L.; Tarasiuk, B.","Co-crystal formation between 2-amino-4,6-dimethylpyrimidine and new p-xylylene-bis(thioacetic) acid","CrystEngComm","2014","16","44","10262","","10.1039/C4CE01567C","","","0.71073","MoKα","","0.0576","0.0351","","","0.0758","0.0806","","","","","","0.903","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218133","5.5044","0.0007","10.0817","0.0008","10.2203","0.0013","90","","93.142","0.01","90","","566.31","0.11","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N,N,N-hydroxydimethylglycine","2-(hydroxydimethylammonio)acetate","","- C4 H9 N O3 -","- C4 H9 N O3 -","- C16 H36 N4 O12 -","4","1","","Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V.","Oxidative stress of H2O2on N,N-dimethylglycine: formation of perhydrate crystals and more","CrystEngComm","2014","16","44","10165","","10.1039/C4CE01835D","","","0.71073","MoKα","","0.0549","0.0376","","","0.0971","0.1025","","","","","","1.032","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218134","10.3838","0.0005","5.7184","0.0003","11.4118","0.0007","90","","90","","90","","677.62","0.06","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","N,N-dimethylglycine","2-(Dimethylamino)acetate perhydrate","","- C4 H11 N O4 -","- C4 H11 N O4 -","- C16 H44 N4 O16 -","4","1","","Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V.","Oxidative stress of H2O2on N,N-dimethylglycine: formation of perhydrate crystals and more","CrystEngComm","2014","16","44","10165","","10.1039/C4CE01835D","","","0.71073","MoKα","","0.0671","0.0415","","","0.0806","0.0915","","","","","","1.058","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218135","12.332","0.0004","9.9903","0.0003","5.80218","0.00016","90","","90","","90","","714.83","0.04","298","2","298","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","N,N,N-hydroxydimethylglycine","2-(hydroxydimethylammonio)acetate perhydrate","","- C4 H11 N O5 -","- C4 H11 N O5 -","- C16 H44 N4 O20 -","4","1","","Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V.","Oxidative stress of H2O2on N,N-dimethylglycine: formation of perhydrate crystals and more","CrystEngComm","2014","16","44","10165","","10.1039/C4CE01835D","","","0.71073","MoKα","","0.0343","0.0308","","","0.0777","0.08","","","","","","1.043","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218148","7.7677","0.0011","13.5311","0.0018","7.9843","0.0011","90","","106.432","0.006","90","","804.92","0.19","150.15","","150.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","hexafluoronaphthalene","","- C10 H2 F6 -","- C10 H2 F6 -","- C40 H8 F24 -","4","1","","Loader, Jason R.; Libri, Stefano; Meijer, Anthony J. H. M.; Perutz, Robin N.; Brammer, Lee","Highly fluorinated naphthalenes and bifurcated C‒H⋯F‒C hydrogen bonding","CrystEngComm","2014","16","41","9711","","10.1039/C4CE01322K","","","0.71073","MoKα","","0.0686","0.0403","","","0.107","0.1294","","","","","","1.042","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218149","8.5748","0.0017","3.6622","0.0007","12.423","0.003","90","","93.08","0.03","90","","389.55","0.14","100.15","","100.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","pentafluoronaphthalene","","- C10 H3 F5 -","- C10 H3 F5 -","- C20 H6 F10 -","2","0.5","","Loader, Jason R.; Libri, Stefano; Meijer, Anthony J. H. M.; Perutz, Robin N.; Brammer, Lee","Highly fluorinated naphthalenes and bifurcated C‒H⋯F‒C hydrogen bonding","CrystEngComm","2014","16","41","9711","","10.1039/C4CE01322K","","","0.71073","MoKα","","0.0967","0.082","","","0.2151","0.2234","","","","","","1.102","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218156","11.4883","0.0006","9.6632","0.0005","16.1106","0.0008","90","","101.252","0.002","90","","1754.12","0.16","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Cl2 N6 O10 S2 -","- C34 H30 Cl2 N6 O10 S2 -","- C68 H60 Cl4 N12 O20 S4 -","2","0.5","","Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V.","A robust two-dimensional hydrogen-bonded network for the predictable assembly of ternary co-crystals of furosemide","CrystEngComm","2014","16","43","9979","","10.1039/C4CE01692K","","","0.71073","MoKα","","0.0818","0.0427","","0.1082","0.0465","0.0465","","","","","","1.0761","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218157","9.7483","0.0004","10.4805","0.0004","14.1432","0.0005","96.253","0.002","93.883","0.002","114.448","0.002","1297.39","0.09","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H25 Cl N4 O6 S2 -","- C24 H25 Cl N4 O6 S2 -","- C48 H50 Cl2 N8 O12 S4 -","2","1","","Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V.","A robust two-dimensional hydrogen-bonded network for the predictable assembly of ternary co-crystals of furosemide","CrystEngComm","2014","16","43","9979","","10.1039/C4CE01692K","","","0.71073","MoKα","","0.0651","0.0446","","0.0753","0.0452","0.0452","","","","","","1.1186","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218158","7.3552","0.0009","9.3457","0.0011","18.124","0.002","80.525","0.006","82.376","0.006","75.758","0.006","1185.5","0.2","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C23 H23 Cl N4 O6 S -","- C23 H23 Cl N4 O6 S -","- C46 H46 Cl2 N8 O12 S2 -","2","1","","Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V.","A robust two-dimensional hydrogen-bonded network for the predictable assembly of ternary co-crystals of furosemide","CrystEngComm","2014","16","43","9979","","10.1039/C4CE01692K","","","0.71073","MoKα","","0.0604","0.0417","","0.0601","0.0447","0.0447","","","","","","1.0771","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218159","6.751","0.0005","9.5719","0.0006","18.6178","0.0013","84.977","0.004","89.783","0.004","73.488","0.004","1148.76","0.14","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C23 H22 Cl N4 O6 S -","- C23 H22 Cl N4 O6 S -","- C46 H44 Cl2 N8 O12 S2 -","2","1","","Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V.","A robust two-dimensional hydrogen-bonded network for the predictable assembly of ternary co-crystals of furosemide","CrystEngComm","2014","16","43","9979","","10.1039/C4CE01692K","","","0.71073","MoKα","","0.0882","0.0673","","0.0913","0.064","0.064","","","","","","0.9645","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218160","7.3972","0.0007","9.3373","0.0008","18.1141","0.0016","80.504","0.004","82.039","0.004","75.173","0.004","1186.81","0.19","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H24 Cl N4 O6 S -","- C24 H24 Cl N4 O6 S -","- C48 H48 Cl2 N8 O12 S2 -","2","1","","Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V.","A robust two-dimensional hydrogen-bonded network for the predictable assembly of ternary co-crystals of furosemide","CrystEngComm","2014","16","43","9979","","10.1039/C4CE01692K","","","0.71073","MoKα","","0.06","0.0454","","0.0684","0.0482","0.0423","","","","","","1.0302","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218161","6.9302","0.0004","9.9356","0.0006","18.6298","0.0011","83.633","0.003","89.624","0.003","72.794","0.003","1217.34","0.13","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H22 Cl N4 O6 S -","- C25 H22 Cl N4 O6 S -","- C50 H44 Cl2 N8 O12 S2 -","2","1","","Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V.","A robust two-dimensional hydrogen-bonded network for the predictable assembly of ternary co-crystals of furosemide","CrystEngComm","2014","16","43","9979","","10.1039/C4CE01692K","","","0.71073","MoKα","","0.0543","0.0436","","0.0477","0.0366","0.0366","","","","","","1.0981","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218162","6.3978","0.0004","21.3089","0.0014","13.6408","0.001","90","","98.903","0.002","90","","1837.2","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H33 Cd N5 O10 S -","- C36 H31 Cd N5 O10 S -","- C72 H62 Cd2 N10 O20 S2 -","2","1","","Guo, Huadong; Yan, Yongnian; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Liu, Chunming","Syntheses, characterization and luminescence properties of five entangled coordination polymers based on bis(4-imidazolphenoxy)methane and various dicarboxylic acids","CrystEngComm","2014","16","44","10245","","10.1039/C4CE01390E","","","0.71073","MoKα","","0.0579","0.0436","","","0.1035","0.119","","","","","","1.033","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218163","12.9722","0.0007","17.3507","0.001","14.0501","0.0008","90","","110.423","0.001","90","","2963.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H54 Cd2 N10 O14 -","- C60 H54 Cd2 N10 O14 -","- C120 H108 Cd4 N20 O28 -","2","0.5","","Guo, Huadong; Yan, Yongnian; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Liu, Chunming","Syntheses, characterization and luminescence properties of five entangled coordination polymers based on bis(4-imidazolphenoxy)methane and various dicarboxylic acids","CrystEngComm","2014","16","44","10245","","10.1039/C4CE01390E","","","0.71073","MoKα","","0.0476","0.0329","","","0.09","0.1086","","","","","","1.065","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218164","10.1545","0.0006","11.6885","0.0007","12.5788","0.0007","83.2","0.001","88.499","0.001","69.273","0.001","1386.34","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H48 Cd2 N8 O14 -","- C62 H44 Cd2 N8 O14 -","- C62 H44 Cd2 N8 O14 -","1","0.5","","Guo, Huadong; Yan, Yongnian; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Liu, Chunming","Syntheses, characterization and luminescence properties of five entangled coordination polymers based on bis(4-imidazolphenoxy)methane and various dicarboxylic acids","CrystEngComm","2014","16","44","10245","","10.1039/C4CE01390E","","","0.71073","MoKα","","0.0412","0.0346","","","0.0957","0.1078","","","","","","1.112","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218165","14.6526","0.0012","10.0981","0.0009","16.1913","0.0013","90","","90","","90","","2395.7","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C27 H20 Cd N4 O6 -","- C27 H20 Cd N4 O6 -","- C108 H80 Cd4 N16 O24 -","4","1","","Guo, Huadong; Yan, Yongnian; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Liu, Chunming","Syntheses, characterization and luminescence properties of five entangled coordination polymers based on bis(4-imidazolphenoxy)methane and various dicarboxylic acids","CrystEngComm","2014","16","44","10245","","10.1039/C4CE01390E","","","0.71073","MoKα","","0.0611","0.0365","","","0.0618","0.0691","","","","","","1.01","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218166","11.6078","0.0014","12.295","0.0014","20.705","0.002","90","","101.496","0.002","90","","2895.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H48 Cd2 N8 O12 -","- C66 H48 Cd2 N8 O12 -","- C132 H96 Cd4 N16 O24 -","2","0.5","","Guo, Huadong; Yan, Yongnian; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Liu, Chunming","Syntheses, characterization and luminescence properties of five entangled coordination polymers based on bis(4-imidazolphenoxy)methane and various dicarboxylic acids","CrystEngComm","2014","16","44","10245","","10.1039/C4CE01390E","","","0.71073","MoKα","","0.0631","0.0367","","","0.0896","0.1147","","","","","","1.104","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218167","12.0856","0.0013","13.6274","0.0015","11.4059","0.0013","90","","91.489","0.002","90","","1877.9","0.4","296","2","296.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 N4 O6 P2 Pt -","- C40 H38 N4 O6 P2 Pt -","- C80 H76 N8 O12 P4 Pt2 -","2","0.5","","Zubatyuk, Roman I.; Sinelshchikova, Anna A.; Enakieva, Yulia Y.; Gorbunova, Yulia G.; Tsivadze, Aslan Y.; Nefedov, Sergey E.; Bessmertnykh-Lemeune, Alla; Guilard, Roger; Shishkin, Oleg V.","Insights into the crystal packing of phosphorylporphyrins based on the topology of their intermolecular interaction energies","CrystEngComm","2014","16","45","10428","","10.1039/C4CE01623H","","","0.71073","MoKα","","0.0366","0.0225","","","0.0576","0.0645","","","","","","1.026","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218168","13.151","0.005","13.187","0.005","13.28","0.005","91.426","0.006","110.824","0.005","107.172","0.005","2034.8","1.3","150","2","150.15","","","","","","","","","6","P -1","-P 1","2","","","","- C86 H90 N8 Ni2 O12 P4 -","- C86 H90 N8 Ni2 O12 P4 -","- C86 H90 N8 Ni2 O12 P4 -","1","0.5","","Zubatyuk, Roman I.; Sinelshchikova, Anna A.; Enakieva, Yulia Y.; Gorbunova, Yulia G.; Tsivadze, Aslan Y.; Nefedov, Sergey E.; Bessmertnykh-Lemeune, Alla; Guilard, Roger; Shishkin, Oleg V.","Insights into the crystal packing of phosphorylporphyrins based on the topology of their intermolecular interaction energies","CrystEngComm","2014","16","45","10428","","10.1039/C4CE01623H","","","0.71073","MoKα","","0.1268","0.0806","","","0.227","0.246","","","","","","1.075","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218169","16.128","0.004","18.158","0.005","13.503","0.003","90","","113.57","0.003","90","","3624.5","1.6","296","2","296.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H38 N4 O6 P2 Pd -","- C40 H38 N4 O6 P2 Pd -","- C160 H152 N16 O24 P8 Pd4 -","4","0.5","","Zubatyuk, Roman I.; Sinelshchikova, Anna A.; Enakieva, Yulia Y.; Gorbunova, Yulia G.; Tsivadze, Aslan Y.; Nefedov, Sergey E.; Bessmertnykh-Lemeune, Alla; Guilard, Roger; Shishkin, Oleg V.","Insights into the crystal packing of phosphorylporphyrins based on the topology of their intermolecular interaction energies","CrystEngComm","2014","16","45","10428","","10.1039/C4CE01623H","","","0.71073","MoKα","","0.0932","0.0442","","","0.0793","0.094","","","","","","0.979","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218170","12.4567","0.0016","11.7829","0.0015","12.1147","0.0016","90","","91.889","0.002","90","","1777.2","0.4","153","2","153.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 Cd N4 O6 P2 -","- C40 H38 Cd N4 O6 P2 -","- C80 H76 Cd2 N8 O12 P4 -","2","0.5","","Zubatyuk, Roman I.; Sinelshchikova, Anna A.; Enakieva, Yulia Y.; Gorbunova, Yulia G.; Tsivadze, Aslan Y.; Nefedov, Sergey E.; Bessmertnykh-Lemeune, Alla; Guilard, Roger; Shishkin, Oleg V.","Insights into the crystal packing of phosphorylporphyrins based on the topology of their intermolecular interaction energies","CrystEngComm","2014","16","45","10428","","10.1039/C4CE01623H","","","0.71073","MoKα","","0.0461","0.0333","","","0.0768","0.0827","","","","","","0.967","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218177","10.4858","0.0003","18.8309","0.0006","4.813","0.0002","90","","90","","90","","950.36","0.06","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C9 H6 N4 O2 Zn -","- C9 H6 N4 O2 Zn -","- C36 H24 N16 O8 Zn4 -","4","1","","Calahorro, Antonio J.; Macchi, Piero; Salinas-Castillo, Alfonso; Sebastián, Eider San; Seco, José M.; Rodríguez-Diéguez, Antonio","Photoluminescence of the first examples of metal‒organic frameworks with two novel tetrazolatephenyl acetic acid derivatives: an experimental and theoretical study","CrystEngComm","2014","16","45","10492","","10.1039/C4CE00662C","","","0.71069","MoKα","","0.0386","0.0319","","","0.0731","0.0784","","","","","","1.08","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218178","18.5081","0.0005","4.823","0.0001","10.9635","0.0004","90","","90","","90","","978.65","0.05","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C9 H6 N4 O2 Zn -","- C9 H6 N4 O2 Zn -","- C36 H24 N16 O8 Zn4 -","4","1","","Calahorro, Antonio J.; Macchi, Piero; Salinas-Castillo, Alfonso; Sebastián, Eider San; Seco, José M.; Rodríguez-Diéguez, Antonio","Photoluminescence of the first examples of metal‒organic frameworks with two novel tetrazolatephenyl acetic acid derivatives: an experimental and theoretical study","CrystEngComm","2014","16","45","10492","","10.1039/C4CE00662C","","","0.71069","MoKα","","0.0536","0.0347","","","0.058","0.0677","","","","","","1.049","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218179","8.093","0.005","9.502","0.005","12.751","0.005","82.472","0.005","82.927","0.005","86.586","0.005","963.8","0.9","295","","295","","","","","","","","","7","P -1","-P 1","2","","Tetrafluoro-1,4-diiodobenzene bis(N-(4-acetophenyl)-2-oxy-1-naphthaldiminato)-copper(ii)","","- C44 H28 Cu F4 I2 N2 O4 -","- C44 H28 Cu F4 I2 N2 O4 -","- C44 H28 Cu F4 I2 N2 O4 -","1","0.5","","Cinčić, Dominik; Friščić, Tomislav","Synthesis of an extended halogen-bonded metal‒organic structure in a one-pot mechanochemical reaction that combines covalent bonding, coordination chemistry and supramolecular synthesis","CrystEngComm","2014","16","44","10169","","10.1039/C4CE01815J","","","0.71073","MoKα","","0.058","0.0363","","","0.0879","0.0938","","","","","","0.985","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218183","12.0014","0.0007","7.104","0.0004","3.538","0.0002","90","","90","","90","","301.64","0.03","180","2","180","2","","","","","","","","5","C m m m","-C 2 2","65","","","","- C4 H4 Cl2 Co N2 -","- C4 H4 Cl2 Co N2 -","- C8 H8 Cl4 Co2 N4 -","2","0.125","","de Campos, Elvio Antonio; Silva, Nuno J. O.; Shi, Fa-Nian; Rocha, João","Cobalt(ii)‒pyrazine‒chloride coordination polymers: synthesis, reactivity and magnetic properties","CrystEngComm","2014","16","45","10439","","10.1039/C4CE01413H","","","0.71073","MoKα","","0.0309","0.0261","","","0.0634","0.0654","","","","","","1.14","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218184","7.1489","0.0006","7.1489","0.0006","10.6653","0.0017","90","","90","","90","","545.07","0.11","296","2","296","2","","","","","","","","5","I -4","I -4","82","","","","- C8 H8 Cl2 Co N4 -","- C8 H8 Cl2 Co N4 -","- C16 H16 Cl4 Co2 N8 -","2","0.25","","de Campos, Elvio Antonio; Silva, Nuno J. O.; Shi, Fa-Nian; Rocha, João","Cobalt(ii)‒pyrazine‒chloride coordination polymers: synthesis, reactivity and magnetic properties","CrystEngComm","2014","16","45","10439","","10.1039/C4CE01413H","","","0.71073","MoKα","","0.0509","0.0358","","","0.0763","0.0832","","","","","","1.068","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218185","7.1449","0.0011","7.1449","0.0011","10.633","0.002","90","","90","","90","","542.81","0.16","180","2","180","2","","","","","","","","5","I -4","I -4","82","","","","- C8 H8 Cl2 Co N4 -","- C8 H8 Cl2 Co N4 -","- C16 H16 Cl4 Co2 N8 -","2","0.25","","de Campos, Elvio Antonio; Silva, Nuno J. O.; Shi, Fa-Nian; Rocha, João","Cobalt(ii)‒pyrazine‒chloride coordination polymers: synthesis, reactivity and magnetic properties","CrystEngComm","2014","16","45","10439","","10.1039/C4CE01413H","","","0.71073","MoKα","","0.0879","0.042","","","0.0696","0.0834","","","","","","0.993","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218186","10.4759","0.0011","33.017","0.003","28.548","0.003","90","","97.288","0.001","90","","9794.5","1.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C83 H77 Cd2 N11 O15 -","- C83 H77 Cd2 N11 O15 -","- C332 H308 Cd8 N44 O60 -","4","1","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.1055","0.0617","","","0.1513","0.1602","","","","","","1.01","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7218187","11.853","0.006","12.385","0.006","21.013","0.01","90","","99.597","0.007","90","","3042","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 N2 O6 Zn -","- C36 H28 N2 O6 Zn -","- C144 H112 N8 O24 Zn4 -","4","1","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.1152","0.0462","","","0.0662","0.0751","","","","","","1.063","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218188","23.362","0.002","18.6642","0.0016","14.8125","0.0013","90","","90","","90","","6458.7","1","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C72 H70 Cd N4 O18 -","- C72 H70 Cd N4 O18 -","- C288 H280 Cd4 N16 O72 -","4","0.5","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.1613","0.0659","","","0.1488","0.1852","","","","","","0.847","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218189","13.1085","0.0012","16.6562","0.0016","13.6422","0.0014","90","","92.185","0.001","90","","2976.4","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H28 N4 O6 Zn -","- C33 H28 N4 O6 Zn -","- C132 H112 N16 O24 Zn4 -","4","1","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.1013","0.0686","","","0.1958","0.2213","","","","","","1.023","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218190","11.0849","0.0013","11.6224","0.0014","13.0516","0.0015","71.141","0.001","86.977","0.002","69.796","0.001","1490","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H30 Cd N4 O7 -","- C33 H30 Cd N4 O7 -","- C66 H60 Cd2 N8 O14 -","2","1","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.1181","0.0556","","","0.0863","0.1031","","","","","","0.838","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218191","9.3381","0.0005","25.7913","0.0012","15.3127","0.0006","90","","95.891","0.004","90","","3668.5","0.3","121.3","0.1","121.3","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C76 H70 Cd3 Cl2 N12 O12 -","- C76 H70 Cd3 Cl2 N12 O12 -","- C152 H140 Cd6 Cl4 N24 O24 -","2","0.5","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.0786","0.0597","","","0.1247","0.1343","","","","","","1.132","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218192","40.431","0.003","18.1158","0.001","35.3525","0.0018","90","","123.886","0.008","90","","21496","3","104.3","0.8","104.3","0.8","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C123 H92 N20 O32 Zn6 -","- C123 H92 N20 O32 Zn6 -","- C492 H368 N80 O128 Zn24 -","4","0.5","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","1.54184","CuKα","","0.1303","0.0792","","","0.2136","0.2369","","","","","","1.015","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218193","36.873","0.003","9.3152","0.0009","10.9288","0.0011","90","","93.643","0.001","90","","3746.2","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H36 Cd2 N12 O8 -","- C33 H36 Cd2 N12 O8 -","- C132 H144 Cd8 N48 O32 -","4","0.5","","Cao, Tingting; Peng, Yanqiang; Liu, Ting; Wang, Suna; Dou, Jianmin; Li, Yunwu; Zhou, Changhui; Li, Dacheng; Bai, Junfeng","Assembly of a series of d10coordination polymers of pamoic acid through a mixed-ligand synthetic strategy: syntheses, structures and fluorescence properties","CrystEngComm","2014","16","46","10658","","10.1039/C4CE01356E","","","0.71073","MoKα","","0.125","0.1045","","","0.2754","0.2856","","","","","","1.115","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218194","7.9572","0.0006","15.2139","0.0011","24.9697","0.0017","90","","90.666","0.005","90","","3022.6","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H29 N3 O9 Zn2 -","- C30 H29 N3 O9 Zn2 -","- C120 H116 N12 O36 Zn8 -","4","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.062","0.0528","","","0.1428","0.1487","","","","","","1.097","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218195","7.9713","0.001","15.4036","0.0016","25.046","0.003","90","","90.562","0.01","90","","3075.2","0.6","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H31 N3 O9 Zn2 -","- C31 H31 N3 O9 Zn2 -","- C124 H124 N12 O36 Zn8 -","4","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0782","0.0574","","","0.1438","0.155","","","","","","1.073","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218196","8.1511","0.0006","16.0769","0.0012","24.7374","0.0018","90","","90.796","0.003","90","","3241.4","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H33 N3 O9 Zn2 -","- C32 H33 N3 O9 Zn2 -","- C128 H132 N12 O36 Zn8 -","4","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0348","0.0331","","","0.0981","0.1007","","","","","","1.062","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218197","19.347","0.0019","11.084","0.0013","10.8074","0.001","90","","92.93","0.007","90","","2314.5","0.4","123","2","123","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C28 H29 N3 O -","- C28 H29 N3 O -","- C112 H116 N12 O4 -","4","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0417","0.0349","","","0.0855","0.0893","","","","","","1.035","","","","has coordinates","180512","2020-10-21","18:00:00",""
"7218198","15.1693","0.0008","17.4457","0.001","17.6212","0.0016","104.114","0.004","112.607","0.004","109.132","0.003","3683.4","0.5","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C144 H164 N12 O39 Zn8 -","- C144 H164 N12 O39 Zn8 -","- C144 H164 N12 O39 Zn8 -","1","0.5","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0772","0.0594","","","0.1704","0.1876","","","","","","1.035","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218199","10.7384","0.0005","11.181","0.0006","13.7983","0.0007","91.221","0.003","103.627","0.003","94.827","0.003","1602.91","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C70 H82 N6 O10 Zn2 -","- C70 H82 N6 O10 Zn2 -","- C70 H82 N6 O10 Zn2 -","1","0.5","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0567","0.0444","","","0.1151","0.1241","","","","","","1.023","","","","has coordinates,has disorder","180512","2020-10-21","18:00:00",""
"7218200","14.2398","0.0007","14.7602","0.0007","15.7924","0.0008","89.058","0.002","66.11","0.002","87.738","0.002","3032.5","0.3","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H74 N6 O10 Zn2 -","- C66 H74 N6 O10 Zn2 -","- C132 H148 N12 O20 Zn4 -","2","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0515","0.0443","","","0.1122","0.1179","","","","","","1.049","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218201","10.8959","0.0006","11.2529","0.0007","12.1372","0.0007","109.804","0.002","102.546","0.002","91.431","0.002","1358.81","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H62 N6 O10 Zn2 -","- C60 H62 N6 O10 Zn2 -","- C60 H62 N6 O10 Zn2 -","1","0.5","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0344","0.0324","","","0.0845","0.0863","","","","","","1.051","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218202","15.1794","0.0006","17.1547","0.0007","17.2922","0.0007","115.89","0.002","100.999","0.002","108.227","0.002","3554.1","0.3","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H78 N6 O20 Zn4 -","- C68 H74 N6 O20 Zn4 -","- C136 H148 N12 O40 Zn8 -","2","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0685","0.0516","","","0.1364","0.149","","","","","","1.043","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218203","10.9315","0.0007","11.2063","0.0008","13.3817","0.0009","96.615","0.003","102.46","0.003","99.944","0.003","1556.69","0.18","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H78 N6 O10 Zn2 -","- C68 H78 N6 O10 Zn2 -","- C68 H78 N6 O10 Zn2 -","1","0.5","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.039","0.0348","","","0.0877","0.0911","","","","","","1.031","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218204","10.0691","0.0008","10.7273","0.0009","11.9802","0.0009","93.2","0.003","106.786","0.003","117.792","0.003","1067.91","0.15","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H27 N3 O -","- C27 H27 N3 O -","- C54 H54 N6 O2 -","2","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.0357","0.0334","","","0.0916","0.0937","","","","","","1.044","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218205","8.0908","0.0009","29.735","0.003","16.6368","0.0018","90","","99.076","0.009","90","","3952.4","0.7","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H43 N3 O11 Zn2 -","- C37 H43 N3 O11 Zn2 -","- C148 H172 N12 O44 Zn8 -","4","1","","Klein, Y. Maximilian; Constable, Edwin C.; Housecroft, Catherine E.; Zampese, Jennifer A.; Crochet, Aurélien","Greasy tails switch 1D-coordination [{Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)}n] polymers to discrete [Zn2(OAc)4(4′-(4-ROC6H4)-4,2′:6′,4′′-tpy)2] complexes","CrystEngComm","2014","16","42","9915","","10.1039/C4CE01422G","","","1.54178","CuKα","","0.1554","0.1061","","","0.2826","0.3108","","","","","","1.136","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218212","22.95","0.004","34.573","0.005","17.549","0.005","90","","104.677","0.002","90","","13470","5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","C-methylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C78 H71 N9 O17 -","- C78 H69 N9 O17 -","- C624 H552 N72 O136 -","8","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.1572","0.0619","","","0.1255","0.162","","","","","","0.99","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218213","17.524","0.0004","17.9622","0.0004","18.5524","0.0004","99.369","0.001","100.579","0.001","110.01","0.001","5230.6","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","C-methylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C117 H121 N9 O31 -","- C117 H121 N9 O31 -","- C234 H242 N18 O62 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","1.54178","CuKα","","0.0684","0.0556","","","0.1728","0.1896","","","","","","1.066","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218214","29.9239","0.0011","19.772","0.0007","23.7677","0.0009","90","","116.033","0.002","90","","12635.5","0.8","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","C-methylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C71 H78 N6 O17 -","- C71 H78 N6 O17 -","- C568 H624 N48 O136 -","8","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.7749","synchrotron","","0.0774","0.057","","","0.1556","0.1679","","","","","","1.047","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218215","7.3273","0.0008","16.7326","0.0019","23.611","0.003","85.742","0.002","83.946","0.002","86.963","0.002","2867.8","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","C-ethyl-pyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C66 H60 N8 O14 -","- C66 H60 N8 O14 -","- C132 H120 N16 O28 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.1029","0.0456","","","0.0982","0.1225","","","","","","0.984","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218216","12.6468","0.0016","15.636","0.002","16.887","0.002","64.978","0.002","81.891","0.002","68.093","0.002","2806.9","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","C-ethylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C67 H66 N6 O15 -","- C67 H66 N6 O15 -","- C134 H132 N12 O30 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.0975","0.0577","","","0.1506","0.1785","","","","","","1.023","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218217","12.5764","0.0016","15.566","0.002","16.818","0.002","65.345","0.002","82.005","0.002","68.245","0.002","2778.6","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","C-ethylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C66 H64 N6 O15 -","- C66 H64 N6 O15 -","- C132 H128 N12 O30 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.1061","0.0586","","","0.1405","0.1638","","","","","","1.049","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218218","15.986","0.003","13.95","0.003","19.675","0.004","90","","99.924","0.003","90","","4322","1.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C-ethylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C51 H51 N3 O13 -","- C51 H51 N3 O13 -","- C204 H204 N12 O52 -","4","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.0895","0.0485","","","0.1104","0.1349","","","","","","1.017","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218219","12.453","0.003","15.858","0.003","19.087","0.006","110.506","0.004","94.181","0.004","110.339","0.003","3228","1.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","C-propylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C71.5 H79 N6 O17 -","- C71.5 H78 N6 O17 -","- C143 H156 N12 O34 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.1131","0.0677","","","0.1782","0.207","","","","","","1.067","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7218220","12.6569","0.001","15.762","0.0013","18.771","0.002","109.665","0.001","92.113","0.001","111.92","0.001","3214.3","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","C-propylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C72 H80 N6 O17 -","- C72 H78 N6 O17 -","- C144 H156 N12 O34 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.0691","0.0479","","","0.1234","0.1371","","","","","","1.047","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218221","12.618","0.003","15.758","0.003","18.702","0.004","109.763","0.003","92.291","0.003","112.029","0.003","3184.2","1.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","C-propylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C73 H82 N6 O17 -","- C73 H80 N6 O17 -","- C146 H160 N12 O34 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.7749","synchrotron","","0.089","0.0615","","","0.1671","0.1892","","","","","","1.036","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218222","11.8485","0.0016","12.7498","0.0017","18.287","0.002","84.294","0.002","85.839","0.002","63.72","0.002","2463.5","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","C-propylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C57 H65 N3 O18 -","- C57 H65 N3 O18 -","- C114 H130 N6 O36 -","2","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.7749","synchrotron","","0.0863","0.0631","","","0.1649","0.185","","","","","","1.039","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218223","18.733","0.002","12.8486","0.0013","22.432","0.002","90","","106.873","0.001","90","","5166.8","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C-propylpyrogallol[4]arene with 1-(2-pyridylazo)-2-napthol","","","- C57 H66 N4 O15 -","- C57 H62 N4 O15 -","- C228 H248 N16 O60 -","4","1","","Pfeiffer, Constance R.; Fowler, Drew A.; Teat, Simon; Atwood, Jerry L.","Cocrystallization of pyrogallol[4]arenes with 1-(2-pyridylazo)-2-naphthol","CrystEngComm","2014","16","47","10760","","10.1039/C4CE01768D","","","0.71073","MoKα","","0.1318","0.0599","","","0.1468","0.189","","","","","","1.031","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218224","10.771","0.002","6.4406","0.0013","19.57","0.004","90","","98.21","0.03","90","","1343.7","0.5","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H28 N2 O4 Zn -","- C32 H28 N2 O4 Zn -","- C64 H56 N4 O8 Zn2 -","2","0.5","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.0299","0.0277","","","0.0763","0.0777","","","","","","1.085","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218225","10.388","0.002","14.804","0.003","20.219","0.004","83.24","0.03","84.1","0.03","87.45","0.03","3069.7","1.1","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H68 N4 O8 Zn2 -","- C64 H68 N4 O8 Zn2 -","- C128 H136 N8 O16 Zn4 -","2","1","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.0786","0.0485","","","0.1174","0.1326","","","","","","1.012","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218226","15.281","0.003","21.46","0.004","15.867","0.003","90","","94.63","0.03","90","","5186.3","1.7","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26.5 H20.75 N1.25 O4 Zn -","- C26.5 H20.75 N1.25 O4 Zn -","- C212 H166 N10 O32 Zn8 -","8","1","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.0756","0.0593","","","0.1533","0.1694","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218227","16.26","0.003","16.26","0.003","16.549","0.003","90","","90","","90","","4375.4","1.4","223","2","223","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C26 H20 N O5 Zn -","- C26 H20 N O5 Zn -","- C208 H160 N8 O40 Zn8 -","8","0.5","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.0487","0.0421","","","0.1117","0.1189","","","","","","1.052","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218228","15.063","0.003","6.1809","0.0012","23.546","0.008","90","","117.92","0.02","90","","1937","0.9","223","2","223","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C42 H38 N2 O5 Zn -","- C42 H38 N2 O5 Zn -","- C84 H76 N4 O10 Zn2 -","2","0.5","","Ge, Yu; Li, Ni-Ya; Ma, Wei; Liu, Dong; Tang, Xiao-Yan","Structural diversity and photoluminescence properties of zinc coordination polymers constructed from 1,4-bis[2-(4-pyridyl)ethenyl]-2,3,5,6-tetramethylbenzene and para-dicarboxylates","CrystEngComm","2014","16","48","10949","","10.1039/C4CE01635A","","","0.71073","MoKα","","0.078","0.0691","","","0.1995","0.2073","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218229","16.99","0.003","18.475","0.004","11.966","0.002","90","","92.92","0.03","90","","3751.1","1.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C29 H17 F18 N4 Nd O6 -","- C29 H17 F18 N4 Nd O6 -","- C116 H68 F72 N16 Nd4 O24 -","4","1","","Sun, Ou; Gao, Ting; Sun, Jingwen; Li, Guangming; Li, Hongfeng; Xu, Hui; Wang, Cheng; Yan, Pengfei","A series of lanthanide(iii) complexes constructed from Schiff base and β-diketonate ligands","CrystEngComm","2014","16","45","10460","","10.1039/C4CE01556H","","","0.71073","MoKα","","0.0547","0.0356","","","0.0838","0.0915","","","","","","0.962","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218230","16.975","0.003","18.527","0.004","11.936","0.002","90","","93.47","0.03","90","","3746.9","1.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C29 H17 F18 N4 O6 Sm -","- C29 H17 F18 N4 O6 Sm -","- C116 H68 F72 N16 O24 Sm4 -","4","1","","Sun, Ou; Gao, Ting; Sun, Jingwen; Li, Guangming; Li, Hongfeng; Xu, Hui; Wang, Cheng; Yan, Pengfei","A series of lanthanide(iii) complexes constructed from Schiff base and β-diketonate ligands","CrystEngComm","2014","16","45","10460","","10.1039/C4CE01556H","","","0.71073","MoKα","","0.0514","0.036","","","0.0877","0.0968","","","","","","0.988","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218231","16.936","0.003","18.506","0.004","11.923","0.002","90","","93.65","0.03","90","","3729.3","1.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C29 H17 Eu F18 N4 O6 -","- C29 H17 Eu F18 N4 O6 -","- C116 H68 Eu4 F72 N16 O24 -","4","1","","Sun, Ou; Gao, Ting; Sun, Jingwen; Li, Guangming; Li, Hongfeng; Xu, Hui; Wang, Cheng; Yan, Pengfei","A series of lanthanide(iii) complexes constructed from Schiff base and β-diketonate ligands","CrystEngComm","2014","16","45","10460","","10.1039/C4CE01556H","","","0.71073","MoKα","","","0.0409","","","0.1118","0.1207","","","","","","1.045","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218232","17.701","0.0005","19.2428","0.0004","23.1401","0.0007","67.657","0.002","83.186","0.002","63.229","0.002","6495.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H58 F60 Gd4 N12 O24 -","- C96 H58 F60 Gd4 N12 O24 -","- C192 H116 F120 Gd8 N24 O48 -","2","1","","Sun, Ou; Gao, Ting; Sun, Jingwen; Li, Guangming; Li, Hongfeng; Xu, Hui; Wang, Cheng; Yan, Pengfei","A series of lanthanide(iii) complexes constructed from Schiff base and β-diketonate ligands","CrystEngComm","2014","16","45","10460","","10.1039/C4CE01556H","","","0.71073","MoKα","","0.0857","0.055","","","0.1431","0.1611","","","","","","1.081","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218233","12.44","0.005","20.322","0.005","20.819","0.005","70.278","0.005","74.202","0.005","79.033","0.005","4739","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C69 H36 Dy3 F48 N11 O16 -","- C69 H36 Dy3 F48 N11 O16 -","- C138 H72 Dy6 F96 N22 O32 -","2","1","","Sun, Ou; Gao, Ting; Sun, Jingwen; Li, Guangming; Li, Hongfeng; Xu, Hui; Wang, Cheng; Yan, Pengfei","A series of lanthanide(iii) complexes constructed from Schiff base and β-diketonate ligands","CrystEngComm","2014","16","45","10460","","10.1039/C4CE01556H","","","0.71069","MoKα","","0.0832","0.0527","","","0.1139","0.1334","","","","","","1.039","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218234","23.313","0.005","11.45","0.002","24.062","0.005","90","","90","","90","","6423","2","293","2","293","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C44 H20 F36 N4 O12 Yb2 -","- C44 H20 F36 N4 O12 Yb2 -","- C176 H80 F144 N16 O48 Yb8 -","4","0.5","","Sun, Ou; Gao, Ting; Sun, Jingwen; Li, Guangming; Li, Hongfeng; Xu, Hui; Wang, Cheng; Yan, Pengfei","A series of lanthanide(iii) complexes constructed from Schiff base and β-diketonate ligands","CrystEngComm","2014","16","45","10460","","10.1039/C4CE01556H","","","0.71073","MoKα","","0.0771","0.0541","","","0.1405","0.1546","","","","","","1.079","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218244","12.123","0.0006","16.851","0.0008","17.716","0.0008","106.672","0.004","109.3","0.004","99.89","0.004","3126.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H68 N2 O30 Zn3 -","- C52 H52 N2 O30 Zn3 -","- C104 H104 N4 O60 Zn6 -","2","1","","Zhang, Hang; Jiang, Wei; Yang, Jin; Liu, Ying-Ying; Song, Shuyan; Ma, Jian-Fang","Four coordination polymers constructed by a novel octacarboxylate functionalized calix[4]arene ligand: syntheses, structures, and photoluminescence property","CrystEngComm","2014","16","42","9939","","10.1039/C4CE01581A","","","0.71069","MoKα","","0.111","0.0775","","","0.2248","0.2573","","","","","","1.035","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218245","16.719","0.0004","16.719","0.0004","24.598","0.0007","90","","90","","120","","5954.6","0.3","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C54 H82 Co4 N2 O39 -","- C54 H54 Co4 N2 O39 -","- C162 H162 Co12 N6 O117 -","3","0.5","","Zhang, Hang; Jiang, Wei; Yang, Jin; Liu, Ying-Ying; Song, Shuyan; Ma, Jian-Fang","Four coordination polymers constructed by a novel octacarboxylate functionalized calix[4]arene ligand: syntheses, structures, and photoluminescence property","CrystEngComm","2014","16","42","9939","","10.1039/C4CE01581A","","","0.71069","MoKα","","0.0948","0.065","","","0.1805","0.1996","","","","","","1.11","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218246","16.719","0.0007","16.719","0.0007","24.598","0.001","90","","90","","120","","5954.6","0.4","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C54 H82 N2 Ni4 O39 -","- C54 H54 N2 Ni4 O39 -","- C162 H162 N6 Ni12 O117 -","3","0.5","","Zhang, Hang; Jiang, Wei; Yang, Jin; Liu, Ying-Ying; Song, Shuyan; Ma, Jian-Fang","Four coordination polymers constructed by a novel octacarboxylate functionalized calix[4]arene ligand: syntheses, structures, and photoluminescence property","CrystEngComm","2014","16","42","9939","","10.1039/C4CE01581A","","","0.71069","MoKα","","0.1284","0.0746","","","0.1964","0.2379","","","","","","1.022","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218247","12.3029","0.0013","17.4336","0.0019","17.492","0.0018","67.67","0.01","76.2","0.009","71.884","0.009","3267.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H84 Mn3 N2 O39 -","- C53 H54 Mn3 N2 O39 -","- C106 H108 Mn6 N4 O78 -","2","1","","Zhang, Hang; Jiang, Wei; Yang, Jin; Liu, Ying-Ying; Song, Shuyan; Ma, Jian-Fang","Four coordination polymers constructed by a novel octacarboxylate functionalized calix[4]arene ligand: syntheses, structures, and photoluminescence property","CrystEngComm","2014","16","42","9939","","10.1039/C4CE01581A","","","0.71073","MoKα","","0.2191","0.0903","","","0.1829","0.2496","","","","","","0.973","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218258","15.675","0.002","18.849","0.005","19.855","0.005","90","","90","","90","","5866","2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H42 N4 O8 S -","- C22 H42 N4 O8 S -","- C176 H336 N32 O64 S8 -","8","2","","Gopinath, Pushparathinam; Ramkumar, Venkatachalam; Muraleedharan, Kannoth Manheri","Peptide turns through just ‘one atom’! A sulfamide group nucleates folding and stabilizes new supramolecular topologies in short peptides","CrystEngComm","2014","16","45","10371","","10.1039/C4CE01938E","","","0.71073","MoKα","","0.0708","0.0473","","","0.1106","0.1297","","","","","","1.032","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218259","9.1689","0.0004","15.824","0.0005","21.6607","0.001","90","","90","","90","","3142.7","0.2","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H46 N4 O8 S -","- C24 H46 N4 O8 S -","- C96 H184 N16 O32 S4 -","4","1","","Gopinath, Pushparathinam; Ramkumar, Venkatachalam; Muraleedharan, Kannoth Manheri","Peptide turns through just ‘one atom’! A sulfamide group nucleates folding and stabilizes new supramolecular topologies in short peptides","CrystEngComm","2014","16","45","10371","","10.1039/C4CE01938E","","","0.71073","MoKα","","0.1329","0.0743","","","0.1899","0.2296","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218260","10.551","0.003","15.765","0.005","20.395","0.005","90","","90","","90","","3392.4","1.7","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H50 N4 O8 S -","- C26 H50 N4 O8 S -","- C104 H200 N16 O32 S4 -","4","1","","Gopinath, Pushparathinam; Ramkumar, Venkatachalam; Muraleedharan, Kannoth Manheri","Peptide turns through just ‘one atom’! A sulfamide group nucleates folding and stabilizes new supramolecular topologies in short peptides","CrystEngComm","2014","16","45","10371","","10.1039/C4CE01938E","","","0.71073","MoKα","","0.0691","0.0536","","","0.1299","0.1423","","","","","","1.036","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218261","4.9125","0.0002","9.3729","0.0004","12.3508","0.0005","110.316","0.002","90.313","0.002","100.233","0.001","523.43","0.04","298","2","298","2","","","","","","","","5","P 1","P 1","1","","","","- C14 H26 N4 O8 S -","- C14 H26 N4 O8 S -","- C14 H26 N4 O8 S -","1","1","","Gopinath, Pushparathinam; Ramkumar, Venkatachalam; Muraleedharan, Kannoth Manheri","Peptide turns through just ‘one atom’! A sulfamide group nucleates folding and stabilizes new supramolecular topologies in short peptides","CrystEngComm","2014","16","45","10371","","10.1039/C4CE01938E","","","0.71073","MoKα","","0.0325","0.032","","","0.0869","0.0877","","","","","","1.062","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218267","37.303","0.0017","8.9433","0.0004","12.9288","0.0006","90","","100.327","0.002","90","","4243.3","0.3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(BEDT-TTF)ethyl thiophene-2-carboxylate","","- C17 H14 O2 S9 -","- C17 H14 O2 S9 -","- C136 H112 O16 S72 -","8","1","","Wang, Qiang; Wallis, John D.; Wu, Yiliang; Pilkington, Melanie","A structural investigation of novel thiophene-functionalized BEDT-TTF donors for application as organic field-effect transistors","CrystEngComm","2014","16","44","10235","","10.1039/C4CE01686F","","","0.71073","MoKα","","0.0547","0.053","","","0.1198","0.1208","","","","","","1.113","","","","has coordinates,has disorder","180513","2020-10-21","18:00:00",""
"7218268","6.5563","0.0005","9.9629","0.0008","16.1326","0.0013","105.019","0.002","96.449","0.002","97.549","0.002","997.1","0.14","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","2-(BEDT-TTF)methyl thiophene-2-carboxylate","","- C16 H12 O2 S9 -","- C16 H12 O2 S9 -","- C32 H24 O4 S18 -","2","1","","Wang, Qiang; Wallis, John D.; Wu, Yiliang; Pilkington, Melanie","A structural investigation of novel thiophene-functionalized BEDT-TTF donors for application as organic field-effect transistors","CrystEngComm","2014","16","44","10235","","10.1039/C4CE01686F","","","0.71073","MoKα","","0.039","0.0357","","","0.0793","0.083","","","","","","1.147","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218269","8.204","0.003","12.534","0.003","18.02","0.005","90","","102.77","0.03","90","","1807.1","1","250","2","250","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C21 H16 N2 O7 -","- C21 H16 N2 O7 -","- C84 H64 N8 O28 -","4","1","","Sowa, Michał; Ślepokura, Katarzyna; Matczak-Jon, Ewa","Improving solubility of fisetin by cocrystallization","CrystEngComm","2014","16","46","10592","","10.1039/C4CE01713G","","","0.71073","MoKα","","0.1207","0.0584","","","0.1188","0.1316","","","","","","1","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218270","7.553","0.002","14.247","0.005","15.149","0.005","66.25","0.04","79.39","0.03","81.05","0.03","1460.6","0.9","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H30 N8 O10 -","- C31 H30 N8 O10 -","- C62 H60 N16 O20 -","2","1","","Sowa, Michał; Ślepokura, Katarzyna; Matczak-Jon, Ewa","Improving solubility of fisetin by cocrystallization","CrystEngComm","2014","16","46","10592","","10.1039/C4CE01713G","","","0.71073","MoKα","","0.161","0.0663","","","0.107","0.1224","","","","","","1.005","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218271","3.4771","0.0008","10.671","0.002","10.22","0.002","90","","94.143","0.004","90","","378.21","0.13","140","2","140","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C H2 Ag N5 -","- C H2 Ag N5 -","- C4 H8 Ag4 N20 -","4","1","","Zhang, Qi; Chen, Dong; He, Xuan; Huang, Shiliang; Huang, Jinglun; Zhou, Xiaoqing; Yang, Zongwei; Li, Jinshan; Li, Hongzhen; Nie, Fude","Structures, photoluminescence and photocatalytic properties of two novel metal‒organic frameworks based on tetrazole derivatives","CrystEngComm","2014","16","45","10485","","10.1039/C4CE01388C","","","0.71073","MoKα","","0.0382","0.0338","","","0.0965","0.0986","","","","","","1.16","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218272","4.5401","0.0006","11.0469","0.0015","14.585","0.002","90","","93.647","0.002","90","","730.02","0.17","140","2","140","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H8 Ag N7 -","- C3 H8 Ag N7 -","- C12 H32 Ag4 N28 -","4","1","","Zhang, Qi; Chen, Dong; He, Xuan; Huang, Shiliang; Huang, Jinglun; Zhou, Xiaoqing; Yang, Zongwei; Li, Jinshan; Li, Hongzhen; Nie, Fude","Structures, photoluminescence and photocatalytic properties of two novel metal‒organic frameworks based on tetrazole derivatives","CrystEngComm","2014","16","45","10485","","10.1039/C4CE01388C","","","0.71073","MoKα","","0.0336","0.0268","","","0.072","0.075","","","","","","1.146","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218273","10.0914","0.0005","12.6143","0.0006","13.2987","0.0006","99.312","0.003","100.74","0.004","96.354","0.004","1623.89","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H44 Cl6 La2 N4 O14 -","- C66 H44 Cl6 La2 N4 O14 -","- C66 H44 Cl6 La2 N4 O14 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0508","0.0347","","","0.0603","0.0659","","","","","","1.013","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218274","8.4595","0.0005","12.9231","0.0008","15.4404","0.0009","98.995","0.006","100.654","0.007","100.68","0.006","1598.09","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H44 Ce2 Cl6 N4 O14 -","- C66 H44 Ce2 Cl6 N4 O14 -","- C66 H44 Ce2 Cl6 N4 O14 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.057","0.0384","","","0.0688","0.0755","","","","","","0.995","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218275","8.4411","0.0003","12.9074","0.0004","15.4508","0.0005","98.976","0.001","100.829","0.001","100.727","0.002","1592.4","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H44 Cl6 N4 Nd2 O14 -","- C66 H44 Cl6 N4 Nd2 O14 -","- C66 H44 Cl6 N4 Nd2 O14 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0532","0.037","","","0.0653","0.0716","","","","","","1.037","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218276","10.0492","0.0004","11.9135","0.0005","14.3855","0.0006","110.397","0.002","96.364","0.003","102.19","0.002","1545.56","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 N4 O12 Sm2 -","- C66 H40 Cl6 N4 O12 Sm2 -","- C66 H40 Cl6 N4 O12 Sm2 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0247","0.0213","","","0.0503","0.0523","","","","","","1.044","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218277","10.0755","0.0003","11.8866","0.0003","14.3488","0.0004","110.75","0.03","96.41","0.03","101.87","0.02","1540.3","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 Gd2 N4 O12 -","- C66 H40 Cl6 Gd2 N4 O12 -","- C66 H40 Cl6 Gd2 N4 O12 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0317","0.0249","","","0.0513","0.0539","","","","","","1.028","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218278","10.0939","0.0003","11.8412","0.0004","14.2899","0.0005","111.041","0.002","96.482","0.001","101.468","0.001","1530.25","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 Ho2 N4 O12 -","- C66 H40 Cl6 Ho2 N4 O12 -","- C66 H40 Cl6 Ho2 N4 O12 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.033","0.0258","","","0.0512","0.0541","","","","","","1.03","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218279","10.0959","0.0003","11.8279","0.0003","14.274","0.0004","111.186","0.0009","96.461","0.0009","101.386","0.0011","1526.17","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 Er2 N4 O12 -","- C66 H40 Cl6 Er2 N4 O12 -","- C66 H40 Cl6 Er2 N4 O12 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0292","0.0236","","","0.0493","0.0515","","","","","","1.035","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218280","10.1079","0.0003","11.819","0.0003","14.2667","0.0004","111.32","0.002","96.529","0.003","101.207","0.002","1525.43","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 N4 O12 Tm2 -","- C66 H40 Cl6 N4 O12 Tm2 -","- C66 H40 Cl6 N4 O12 Tm2 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0341","0.0267","","","0.0554","0.0586","","","","","","1.035","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218281","10.0937","0.0008","11.8057","0.0009","14.2502","0.0011","111.386","0.005","96.465","0.004","101.209","0.005","1519.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 N4 O12 Yb2 -","- C66 H40 Cl6 N4 O12 Yb2 -","- C66 H40 Cl6 N4 O12 Yb2 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0373","0.0284","","","0.0551","0.0586","","","","","","0.995","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218282","10.1082","0.0005","11.7926","0.0005","14.244","0.0007","111.419","0.003","96.559","0.003","101.088","0.002","1519.19","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 Lu2 N4 O12 -","- C66 H40 Cl6 Lu2 N4 O12 -","- C66 H40 Cl6 Lu2 N4 O12 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0664","0.0407","","","0.0588","0.0661","","","","","","0.986","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218283","10.0929","0.0008","11.8472","0.0009","14.288","0.0011","111.16","0.003","96.429","0.004","101.497","0.004","1529.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H40 Cl6 N4 O12 Y2 -","- C66 H40 Cl6 N4 O12 Y2 -","- C66 H40 Cl6 N4 O12 Y2 -","1","0.5","","Carter, Korey P.; Zulato, Cecília H. F.; Cahill, Christopher L.","Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes","CrystEngComm","2014","16","44","10189","","10.1039/C4CE01806K","","x-ray","0.71073","MoKα","","0.0696","0.0422","","","0.0744","0.083","","","","","","1.011","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218284","7.1325","0.0014","11.657","0.002","11.979","0.002","61.83","0.03","86.14","0.03","76.85","0.03","854","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H9 F4 N3 O4 -","- C18 H9 F4 N3 O4 -","- C36 H18 F8 N6 O8 -","2","1","","Meng, Xiao; Chen, Hao; Xu, Shu; Ma, Yuguo","Metal-free 1,3-dipolar cycloaddition polymerization via prearrangement of azide and alkyne in the solid state","CrystEngComm","2014","16","43","9983","","10.1039/C4CE01690D","","","0.71073","MoKα","","0.1244","0.1067","","","0.2711","0.29","","","","","","1.155","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218285","5.8306","0.0012","9.969","0.002","15.544","0.003","71.39","0.03","87.46","0.03","86.71","0.03","854.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H11 F4 N3 O4 -","- C19 H11 F4 N3 O4 -","- C38 H22 F8 N6 O8 -","2","1","","Meng, Xiao; Chen, Hao; Xu, Shu; Ma, Yuguo","Metal-free 1,3-dipolar cycloaddition polymerization via prearrangement of azide and alkyne in the solid state","CrystEngComm","2014","16","43","9983","","10.1039/C4CE01690D","","","0.71073","MoKα","","0.0475","0.0453","","","0.1157","0.1176","","","","","","1.093","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218286","5.653","0.004","9.661","0.008","18.613","0.014","93.602","0.015","91.807","0.014","96.604","0.014","1007","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H17 F4 N3 O4 -","- C22 H17 F4 N3 O4 -","- C44 H34 F8 N6 O8 -","2","1","","Meng, Xiao; Chen, Hao; Xu, Shu; Ma, Yuguo","Metal-free 1,3-dipolar cycloaddition polymerization via prearrangement of azide and alkyne in the solid state","CrystEngComm","2014","16","43","9983","","10.1039/C4CE01690D","","","0.71073","MoKα","","0.0825","0.0697","","","0.1598","0.1685","","","","","","1.142","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218287","7.5088","0.0015","10.929","0.002","12.823","0.003","112.78","0.03","93.81","0.03","105.56","0.03","917.3","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H13 F4 N3 O4 -","- C20 H13 F4 N3 O4 -","- C40 H26 F8 N6 O8 -","2","1","","Meng, Xiao; Chen, Hao; Xu, Shu; Ma, Yuguo","Metal-free 1,3-dipolar cycloaddition polymerization via prearrangement of azide and alkyne in the solid state","CrystEngComm","2014","16","43","9983","","10.1039/C4CE01690D","","","0.71073","MoKα","","0.0575","0.0523","","","0.1245","0.1291","","","","","","1.085","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218294","8.4167","0.0011","10.2057","0.0014","11.0501","0.0015","83.969","0.003","78.625","0.002","79.928","0.003","913.7","0.2","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H36 F12 Li2 N6 O8 S4 -","- C18 H36 F12 Li2 N6 O8 S4 -","- C18 H36 F12 Li2 N6 O8 S4 -","1","0.5","","Moriya, Makoto; Nomura, Kuniyoshi; Sakamoto, Wataru; Yogo, Toshinobu","Precisely controlled supramolecular ionic conduction paths and their structure‒conductivity relationships for lithium ion transport","CrystEngComm","2014","16","45","10512","","10.1039/C4CE01417K","","","0.71073","MoKα","","0.0447","0.0401","","","0.1046","0.1084","","","","","","1.048","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218295","12.4175","0.0014","9.8024","0.0011","15.7042","0.0016","90","","105.303","0.003","90","","1843.8","0.3","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H36 F12 Li2 N6 O8 S4 -","- C18 H36 F12 Li2 N6 O8 S4 -","- C36 H72 F24 Li4 N12 O16 S8 -","2","0.5","","Moriya, Makoto; Nomura, Kuniyoshi; Sakamoto, Wataru; Yogo, Toshinobu","Precisely controlled supramolecular ionic conduction paths and their structure‒conductivity relationships for lithium ion transport","CrystEngComm","2014","16","45","10512","","10.1039/C4CE01417K","","","0.71073","MoKα","","0.1295","0.0876","","","0.1839","0.2038","","","","","","1.082","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218296","11.964","0.003","10.381","0.003","16.974","0.004","90","","100.531","0.004","90","","2072.6","0.9","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H48 F12 Li2 N6 O8 S4 -","- C24 H48 F12 Li2 N6 O8 S4 -","- C48 H96 F24 Li4 N12 O16 S8 -","2","0.5","","Moriya, Makoto; Nomura, Kuniyoshi; Sakamoto, Wataru; Yogo, Toshinobu","Precisely controlled supramolecular ionic conduction paths and their structure‒conductivity relationships for lithium ion transport","CrystEngComm","2014","16","45","10512","","10.1039/C4CE01417K","","","0.71073","MoKα","","0.0362","0.0324","","","0.0877","0.091","","","","","","1.016","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218297","12.2852","0.0014","13.5924","0.0016","16.4701","0.0019","90","","90","","90","","2750.3","0.6","153","2","153","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C14 H32 F6 Li2 N4 O6 S2 -","- C14 H32 F6 Li2 N4 O6 S2 -","- C56 H128 F24 Li8 N16 O24 S8 -","4","0.5","","Moriya, Makoto; Nomura, Kuniyoshi; Sakamoto, Wataru; Yogo, Toshinobu","Precisely controlled supramolecular ionic conduction paths and their structure‒conductivity relationships for lithium ion transport","CrystEngComm","2014","16","45","10512","","10.1039/C4CE01417K","","","0.71073","MoKα","","0.0889","0.0732","","","0.2063","0.2276","","","","","","1.042","","","","has coordinates","180513","2020-10-21","18:00:00",""
"7218309","9.523","0.005","14.45","0.006","20.41","0.009","71.148","0.014","79.669","0.017","76.292","0.015","2566","2","250","2","250","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H26 Cu3 O16 S2 -","- C16 H20 Cu3 O16 S2 -","- C64 H80 Cu12 O64 S8 -","4","2","","Yoneyama, Shota; Kodama, Takeshi; Kikuchi, Koichi; Fujii, Yutaka; Kikuchi, Hikomitsu; Fujita, Wataru","Preparation, crystal structure, and magnetic properties of a copper hydroxy salt with diamond chain magnetic network","CrystEngComm","2014","16","45","10385","","10.1039/C4CE01642D","","","0.71075","MoKα","","0.1355","0.0625","","","0.1423","0.183","","","","","","1.033","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218310","5.712","0.004","8.741","0.006","27.1","0.016","97.596","0.009","91.516","0.006","100.966","0.01","1314.8","1.5","250","","250","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H26 Cu3 O16 S2 -","- C16 H16 Cu2.5 O16 S2 -","- C32 H32 Cu5 O32 S4 -","2","1","","Yoneyama, Shota; Kodama, Takeshi; Kikuchi, Koichi; Fujii, Yutaka; Kikuchi, Hikomitsu; Fujita, Wataru","Preparation, crystal structure, and magnetic properties of a copper hydroxy salt with diamond chain magnetic network","CrystEngComm","2014","16","45","10385","","10.1039/C4CE01642D","","","0.71075","MoKα","","","0.0479","","","","0.133","","","","","","1.041","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218311","6.8581","0.0002","14.7849","0.0004","17.3015","0.0006","90","","90.966","0.002","90","","1754.06","0.09","296","","296","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.1196","0.051","","0.1015","0.0512","0.0512","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218312","6.8234","0.0004","14.7074","0.0007","17.2","0.002","90","","90.814","0.007","90","","1725.9","0.2","296","","296","","","","164630","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.0732","0.0501","","0.0671","0.0396","0.0396","","","","","","0.9999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218313","6.6545","0.0002","14.3261","0.0005","16.7183","0.0014","90","","90.46","0.005","90","","1593.75","0.15","296","","296","","","","1085560","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.0642","0.0354","","0.0571","0.0385","0.0385","","","","","","0.9999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218314","6.5502","0.0004","14.1051","0.0007","16.497","0.003","90","","90.396","0.008","90","","1524.1","0.3","296","","296","","","","2037080","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.0467","0.0326","","0.0438","0.0348","0.0348","","","","","","0.9999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218315","6.4636","0.0002","13.8775","0.0005","16.3094","0.0016","90","","90.317","0.005","90","","1462.91","0.16","296","","296","","","","3019480","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.0477","0.0339","","0.0413","0.0355","0.0355","","","","","","0.9998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218316","6.4012","0.0004","13.7152","0.0009","16.187","0.003","90","","90.438","0.008","90","","1421.1","0.3","296","","296","","","","3963500","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.0506","0.034","","0.0452","0.0367","0.0367","","","","","","0.9999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218317","6.3469","0.0005","13.6039","0.001","16.105","0.003","90","","90.549","0.01","90","","1390.5","0.3","296","","296","","","","4882700","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H13 B F I N2 O -","- C20 H13 B F I N2 O -","- C80 H52 B4 F4 I4 N8 O4 -","4","1","","Wesela-Bauman, Grzegorz; Parsons, Simon; Serwatowski, Janusz; Woźniak, Krzysztof","Effect of high pressure on the crystal structure and charge transport properties of the (2-fluoro-3-pyridyl)(4-iodophenyl)borinic 8-oxyquinolinate complex","CrystEngComm","2014","16","47","10780","","10.1039/C4CE01730G","","","0.71073","MoKα","","0.0615","0.0392","","0.0553","0.0417","0.0417","","","","","","0.9999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218320","5.0587","0.0004","5.0974","0.0004","24.1635","0.0019","84.859","0.002","84.33","0.002","88.194","0.002","617.38","0.08","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","DW-10-7 (3-pyridyl)-CONH-(CH2)8-NHCO-(3-pyridyl), I-(CF2)2-I","","- C22 H26 F4 I2 N4 O2 -","- C22 H26 F4 I2 N4 O2 -","- C22 H26 F4 I2 N4 O2 -","1","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0235","0.0219","","","0.0563","0.0599","","","","","","0.989","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218321","5.0194","0.0003","5.0906","0.0003","26.5502","0.0014","85.503","0.002","85.901","0.002","88.219","0.001","674.36","0.07","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","DW-10-8 (3-pyridyl)-CONH-(CH2)8-NHCO-(3-pyridyl), I-(CF2)4-I","","- C24 H26 F8 I2 N4 O2 -","- C24 H26 F8 I2 N4 O2 -","- C24 H26 F8 I2 N4 O2 -","1","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0168","0.0161","","","0.041","0.0414","","","","","","1.022","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218322","5.0345","0.0012","5.1049","0.0012","29.113","0.007","85.793","0.006","87.469","0.007","88.033","0.005","745.1","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","DW-10-9 (3-pyridyl)-CONH-(CH2)8-NHCO-(3-pyridyl), I-(CF2)6-I","","- C26 H26 F12 I2 N4 O2 -","- C26 H26 F12 I2 N4 O2 -","- C26 H26 F12 I2 N4 O2 -","1","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0287","0.0281","","","0.072","0.0725","","","","","","1.131","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218323","5.0593","0.0007","5.0774","0.0007","22.229","0.003","94.513","0.005","91.986","0.004","91.522","0.004","568.66","0.14","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","DW-8-7 (3-pyridyl)-CONH-(CH2)6-NHCO-(3-pyridyl), I-(CF2)2-I","","- C20 H22 F4 I2 N4 O2 -","- C20 H22 F4 I2 N4 O2 -","- C20 H22 F4 I2 N4 O2 -","1","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0259","0.0244","","","0.0688","0.0752","","","","","","1.183","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218324","64.445","0.006","4.9349","0.0004","9.1473","0.0008","90","","90","","90","","2909.1","0.4","120","2","120","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","DW-8-9 (3-pyridyl)-CONH-(CH2)6-NHCO-(3-pyridyl), I-(CF2)6-I","","- C24 H22 F12 I2 N4 O2 -","- C24 H22 F12 I2 N4 O2 -","- C96 H88 F48 I8 N16 O8 -","4","1","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0496","0.0367","","","0.106","0.1164","","","","","","1.048","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218325","5.0528","0.0004","5.1104","0.0004","29.87","0.002","86.386","0.002","87.93","0.002","87.776","0.002","768.75","0.1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","DW-8-18 (3-pyridyl)-CONH-(CH2)6-NHCO-(3-pyridyl), I-(CF2)8-I","","- C26 H22 F16 I2 N4 O2 -","- C26 H22 F16 I2 N4 O2 -","- C26 H22 F16 I2 N4 O2 -","1","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0301","0.0273","","","0.071","0.0729","","","","","","0.975","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218326","40.059","0.005","5.6695","0.0005","9.7828","0.0012","90","","102.959","0.003","90","","2165.2","0.4","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H18 F4 I2 N4 O2 -","- C18 H18 F4 I2 N4 O2 -","- C72 H72 F16 I8 N16 O8 -","4","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0179","0.0142","","","0.0342","0.0361","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218327","4.9772","0.0012","10.655","0.003","12.169","0.003","71.067","0.002","88.865","0.003","86.924","0.002","609.6","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H18 F8 I2 N4 O2 -","- C20 H18 F8 I2 N4 O2 -","- C20 H18 F8 I2 N4 O2 -","1","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0269","0.0225","","","0.0498","0.0525","","","","","","1.021","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218328","49.953","0.003","5.5707","0.0003","9.7257","0.0006","90","","95.234","0.002","90","","2695.1","0.3","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","DW-6-9 (3-pyridyl)-COHN-(CH2)4-NHCO-(3-pyridyl), I-(CF2)6-I","","- C22 H18 F12 I2 N4 O2 -","- C22 H18 F12 I2 N4 O2 -","- C88 H72 F48 I8 N16 O8 -","4","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0233","0.022","","","0.0567","0.0574","","","","","","1.033","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218329","54.569","0.003","5.6337","0.0003","9.7038","0.0006","90","","92.37","0.002","90","","2980.6","0.3","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","DW-6-18 (3-pyridyl)-COHN-(CH2)4-NHCO-(3-pyridyl), I-(CF2)8-I","","- C24 H18 F16 I2 N4 O2 -","- C24 H18 F16 I2 N4 O2 -","- C96 H72 F64 I8 N16 O8 -","4","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0326","0.0266","","","0.0618","0.0641","","","","","","1.07","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218330","12.7557","0.0006","9.5667","0.0005","9.7394","0.0005","90","","110.988","0.001","90","","1109.65","0.1","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","DW-3-8 (3-pyridyl)-CONH-(CH2)4-NHCO-(3-pyridyl), I-(CF2)4-I","","- C18 H14 F8 I2 N4 O2 -","- C18 H14 F8 I2 N4 O2 -","- C36 H28 F16 I4 N8 O4 -","2","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0285","0.0252","","","0.0607","0.0631","","","","","","1.069","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218331","13.7352","0.0008","9.3958","0.0005","9.8519","0.0006","90","","103.888","0.002","90","","1234.25","0.12","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","DW-3-9 (3-pyridyl)-CONH-(CH2)2-NHCO-(3-pyridyl), I-(CF2)6-I","","- C20 H14 F12 I2 N4 O2 -","- C20 H14 F12 I2 N4 O2 -","- C40 H28 F24 I4 N8 O4 -","2","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0242","0.0211","","","0.0472","0.0484","","","","","","1.034","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218332","15.1894","0.0018","9.3947","0.0011","9.8668","0.0011","90","","95.169","0.004","90","","1402.3","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","DW-3-18 (3-pyridyl)-CONH-(CH2)2-NHCO-(3-pyridyl), I-(CF2)8-I","","- C22 H14 F16 I2 N4 O2 -","- C22 H14 F16 I2 N4 O2 -","- C44 H28 F32 I4 N8 O4 -","2","0.5","","Aakeröy, Christer B.; Welideniya, Dhanushi; Desper, John; Moore, Curtis","Halogen-bond driven co-crystallization of potential anti-cancer compounds: a structural study","CrystEngComm","2014","16","44","10203","","10.1039/C4CE01614A","","","0.71073","MoKα","","0.0335","0.03","","","0.0897","0.1023","","","","","","1.213","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218342","9.2374","0.0013","13.1931","0.0019","13.996","0.002","62.333","0.004","87.519","0.005","89.003","0.005","1509.2","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H72 Cl10 Cu N8 O4 -","- C54 H72 Cl10 Cu N8 O4 -","- C54 H72 Cl10 Cu N8 O4 -","1","0.5","","Li, Lei; Maddalena, Francesco; Oliveros, Malena; Caironi, Mario; Guo, Fang; Martí-Rujas, Javier","A second sphere coordination adduct containing one-dimensional water/methanol channels: X-ray structures, thermal stability and single crystal impedance spectroscopy analysis","CrystEngComm","2014","16","47","10888","","10.1039/C4CE01570C","","","1.54178","CuKα","","0.0465","0.0407","","","0.1105","0.1121","","","","","","1.056","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218343","9.3862","0.0016","13.686","0.002","13.827","0.002","60.772","0.011","85.924","0.013","85.375","0.014","1544","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4,4-methylene dianiline copper chloride","","- C53 H66 Cl12 Cu N8 -","- C53.002 H66.004 Cl12.004 Cu N8 -","- C53.002 H66.004 Cl12.004 Cu N8 -","1","0.5","","Li, Lei; Maddalena, Francesco; Oliveros, Malena; Caironi, Mario; Guo, Fang; Martí-Rujas, Javier","A second sphere coordination adduct containing one-dimensional water/methanol channels: X-ray structures, thermal stability and single crystal impedance spectroscopy analysis","CrystEngComm","2014","16","47","10888","","10.1039/C4CE01570C","","","1.54178","CuKα","","0.1912","0.1499","","","0.3867","0.4092","","","","","","1.524","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218344","27.4518","0.0011","27.4518","0.0011","18.2099","0.0008","90","","90","","90","","13723","1","100","2","100","2","","","","","","","","4","P 4 c c","P 4 -2c","103","","5,10,15,20-tetra(4-hydroxyphenyl)-21,23H-porphyrin nitrobenzene hexasolvate","","- C80 H60 N10 O16 -","- C80 H60 N10 O16 -","- C640 H480 N80 O128 -","8","1","","Seidel, Rüdiger W.; Goddard, Richard; Oppel, Iris M.","Isomorphous free-base, Ni(ii)- and Cu(ii)-5,10,15,20-tetra(4-hydroxyphenyl)porphyrin nitrobenzene hexasolvates with tetragonal 3D hydrogen-bonded network structures","CrystEngComm","2014","16","45","10505","","10.1039/C4CE01881H","","","1.54178","CuKα","","0.0845","0.0776","","","0.2015","0.2099","","","","","","1.036","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218345","27.3385","0.0007","27.3385","0.0007","18.3255","0.0008","90","","90","","90","","13696.4","0.8","108","2","108","2","","","","","","","","5","P 4 c c","P 4 -2c","103","","5,10,15,20-tetra(4-hydroxyphenyl)porphyrinatonickel(II) nitrobenzene hexasolvate","","- C80 H58 N10 Ni O16 -","- C80 H58 N10 Ni O16 -","- C640 H464 N80 Ni8 O128 -","8","1","","Seidel, Rüdiger W.; Goddard, Richard; Oppel, Iris M.","Isomorphous free-base, Ni(ii)- and Cu(ii)-5,10,15,20-tetra(4-hydroxyphenyl)porphyrin nitrobenzene hexasolvates with tetragonal 3D hydrogen-bonded network structures","CrystEngComm","2014","16","45","10505","","10.1039/C4CE01881H","","","0.71073","MoKα","","0.1655","0.0781","","","0.1737","0.218","","","","","","1.02","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218346","27.3921","0.0007","27.3921","0.0007","18.3185","0.0009","90","","90","","90","","13744.9","0.8","108","2","108","2","","","","","","","","5","P 4 c c","P 4 -2c","103","","5,10,15,20-tetra(4-hydroxyphenyl)porphyrinatocopper(II) nitrobenzene hexasolvate","","- C80 H58 Cu N10 O16 -","- C80 H58 Cu N10 O16 -","- C640 H464 Cu8 N80 O128 -","8","1","","Seidel, Rüdiger W.; Goddard, Richard; Oppel, Iris M.","Isomorphous free-base, Ni(ii)- and Cu(ii)-5,10,15,20-tetra(4-hydroxyphenyl)porphyrin nitrobenzene hexasolvates with tetragonal 3D hydrogen-bonded network structures","CrystEngComm","2014","16","45","10505","","10.1039/C4CE01881H","","","0.71073","MoKα","","0.1366","0.0769","","","0.1768","0.2131","","","","","","1.024","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218354","11.378","0.005","12.184","0.005","23.328","0.005","83.715","0.005","81.99","0.005","70.714","0.005","3015.7","1.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H70 Cu5 Eu2 N20 O95 Si2 W22 -","- C44 H36 Cu5 Eu2 N20 O95 Si2 W22 -","- C44 H36 Cu5 Eu2 N20 O95 Si2 W22 -","1","0.5","","Zhou, Wanli; Zhang, Zheyu; Peng, Jun; Wang, Xiang; Shi, Zhenyu; Li, Guangzhe","A series of hybrids with a framework constructed from {‒SiW11‒Ln‒SiW11‒}nchains and {Cu/bimpy} ribbons","CrystEngComm","2014","16","47","10893","","10.1039/C4CE01409J","","","0.71069","MoKα","","0.0715","0.0511","","","0.1091","0.1312","","","","","","1.046","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218355","11.384","0.005","12.189","0.005","23.331","0.005","83.75","0.005","82.022","0.005","70.697","0.005","3019","1.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H66 Cu5 N20 O93 Si2 Sm2 W22 -","- C44 H36 Cu5 N20 O93 Si2 Sm2 W22 -","- C44 H36 Cu5 N20 O93 Si2 Sm2 W22 -","1","0.5","","Zhou, Wanli; Zhang, Zheyu; Peng, Jun; Wang, Xiang; Shi, Zhenyu; Li, Guangzhe","A series of hybrids with a framework constructed from {‒SiW11‒Ln‒SiW11‒}nchains and {Cu/bimpy} ribbons","CrystEngComm","2014","16","47","10893","","10.1039/C4CE01409J","","","0.71069","MoKα","","0.083","0.0584","","","0.1584","0.185","","","","","","1.017","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218356","11.458","0.0016","12.263","0.0018","24.833","0.004","94.768","0.002","100.812","0.002","114.139","0.002","3077.5","0.8","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H70 Cu5 Ho2 N20 O95 Si2 W22 -","- C44 H36 Cu5 Ho2 N20 O95 Si2 W22 -","- C44 H36 Cu5 Ho2 N20 O95 Si2 W22 -","1","0.5","","Zhou, Wanli; Zhang, Zheyu; Peng, Jun; Wang, Xiang; Shi, Zhenyu; Li, Guangzhe","A series of hybrids with a framework constructed from {‒SiW11‒Ln‒SiW11‒}nchains and {Cu/bimpy} ribbons","CrystEngComm","2014","16","47","10893","","10.1039/C4CE01409J","","","0.71069","MoKα","","0.0904","0.0586","","","0.1436","0.1669","","","","","","1.025","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218357","11.335","0.005","12.152","0.005","23.319","0.005","83.543","0.005","81.741","0.005","71.112","0.005","3000.1","1.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H70 Cu5 N20 O95 Si2 W22 Y2 -","- C44 H36 Cu5 N20 O95 Si2 W22 Y2 -","- C44 H36 Cu5 N20 O95 Si2 W22 Y2 -","1","0.5","","Zhou, Wanli; Zhang, Zheyu; Peng, Jun; Wang, Xiang; Shi, Zhenyu; Li, Guangzhe","A series of hybrids with a framework constructed from {‒SiW11‒Ln‒SiW11‒}nchains and {Cu/bimpy} ribbons","CrystEngComm","2014","16","47","10893","","10.1039/C4CE01409J","","","0.71069","MoKα","","0.0808","0.0506","","","0.1232","0.1439","","","","","","1.057","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218358","11.322","0.005","12.139","0.005","23.311","0.005","83.586","0.005","81.753","0.005","71.169","0.005","2993.6","1.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H68 Ce2 Cu5 N20 O94 Si2 W22 -","- C44 H36 Ce2 Cu5 N20 O94 Si2 W22 -","- C44 H36 Ce2 Cu5 N20 O94 Si2 W22 -","1","0.5","","Zhou, Wanli; Zhang, Zheyu; Peng, Jun; Wang, Xiang; Shi, Zhenyu; Li, Guangzhe","A series of hybrids with a framework constructed from {‒SiW11‒Ln‒SiW11‒}nchains and {Cu/bimpy} ribbons","CrystEngComm","2014","16","47","10893","","10.1039/C4CE01409J","","","0.71069","MoKα","","0.0705","0.0502","","","0.1169","0.1254","","","","","","1.033","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218359","10.765","0.002","11.596","0.003","12.705","0.003","77.594","0.011","65.275","0.011","65.336","0.011","1307.6","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H22 F3 N5 O2 S -","- C27 H22 F3 N5 O2 S -","- C54 H44 F6 N10 O4 S2 -","2","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.0855","0.059","","","0.172","0.1915","","","","","","1.056","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218360","9.1324","0.0002","11.6423","0.0003","14.2374","0.0003","92.939","0.002","99.316","0.002","110.239","0.002","1392.12","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H24 F3 N5 O2 S -","- C29 H24 F3 N5 O2 S -","- C58 H48 F6 N10 O4 S2 -","2","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.1641","0.0624","","","0.143","0.1832","","","","","","0.96","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218361","7.989","0.0008","11.3277","0.0011","15.7937","0.0015","78.78","0.006","81.807","0.006","83.993","0.006","1383.3","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H26 F3 N5 O2 S -","- C29 H26 F3 N5 O2 S -","- C58 H52 F6 N10 O4 S2 -","2","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.0961","0.0626","","","0.1597","0.1813","","","","","","1.013","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218362","21.71","0.004","9.5377","0.0016","27.024","0.005","90","","92.813","0.008","90","","5588.9","1.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H25 F3 N5 O2.5 S -","- C28.5 H25 F3 N5 O2.5 S -","- C228 H200 F24 N40 O20 S8 -","8","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.0811","0.0636","","","0.176","0.1955","","","","","","1.04","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7218363","21.952","0.004","9.4776","0.0017","27.112","0.004","90","","92.885","0.012","90","","5633.6","1.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H26 F3 N5 O2.5 S -","- C29 H26 F3 N5 O2.5 S -","- C232 H208 F24 N40 O20 S8 -","8","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.0996","0.0578","","","0.1318","0.1529","","","","","","1.01","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7218364","21.9683","0.0005","9.4685","0.0002","27.2121","0.0006","90","","93.42","0.001","90","","5650.2","0.2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H26 F3 N5 O3 S -","- C29 H26 F3 N5 O3 S -","- C232 H208 F24 N40 O24 S8 -","8","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.1109","0.0642","","","0.1725","0.2","","","","","","1.044","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218365","21.3705","0.0011","10.0269","0.0004","27.7028","0.0011","90","","91.927","0.004","90","","5932.8","0.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30.5 H27 F3 N5 O2.5 S -","- C30.5 H27 F3 N5 O2.5 S -","- C244 H216 F24 N40 O20 S8 -","8","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.0839","0.0634","","","0.1728","0.1899","","","","","","1.139","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7218366","21.606","0.003","10.0057","0.0016","27.794","0.005","90","","91.919","0.006","90","","6005.2","1.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H28 F3 N5 O2.5 S -","- C31 H28 F3 N5 O2.5 S -","- C248 H224 F24 N40 O20 S8 -","8","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.2142","0.0823","","","0.2226","0.2987","","","","","","1.012","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7218367","21.5985","0.0015","9.937","0.0007","28.061","0.002","90","","92.248","0.003","90","","6017.9","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H28 F3 N5 O3 S -","- C31 H28 F3 N5 O3 S -","- C248 H224 F24 N40 O24 S8 -","8","1","","Wang, Xiaojuan; Zhang, Qi; Jiang, Linglei; Xu, Yun; Mei, Xuefeng","Isostructurality in six celecoxib co-crystals introduced by solvent inclusion","CrystEngComm","2014","16","48","10959","","10.1039/C4CE01854K","","","0.71073","MoKα","","0.1288","0.0818","","","0.2448","0.2803","","","","","","1.072","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218368","12.9273","0.0011","9.3874","0.0009","18.211","0.0016","90","","107.861","0.004","90","","2103.5","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H34 Br2 Co3 N4 O12 -","- C36 H34 Br2 Co3 N4 O12 -","- C72 H68 Br4 Co6 N8 O24 -","2","0.5","","Xu, Ling; Liu, Bing; Liu, Sheng-Xian; Jiao, Huan; de Castro, Baltazar; Cunha-Silva, Luís","The influence of 1-alkyl-3-methyl imidazolium ionic liquids on a series of cobalt-1,4-benzenedicarboxylate metal‒organic frameworks","CrystEngComm","2014","16","46","10649","","10.1039/C4CE01722F","","","0.71073","MoKα","","0.112","0.0774","","","0.195","0.2066","","","","","","1.006","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218369","12.9773","0.0006","9.4496","0.0004","18.231","0.0009","90","","108.237","0.002","90","","2123.38","0.17","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H38 Br2 Co3 N4 O12 -","- C38 H38 Br2 Co3 N4 O12 -","- C76 H76 Br4 Co6 N8 O24 -","2","0.5","","Xu, Ling; Liu, Bing; Liu, Sheng-Xian; Jiao, Huan; de Castro, Baltazar; Cunha-Silva, Luís","The influence of 1-alkyl-3-methyl imidazolium ionic liquids on a series of cobalt-1,4-benzenedicarboxylate metal‒organic frameworks","CrystEngComm","2014","16","46","10649","","10.1039/C4CE01722F","","","0.71073","MoKα","","0.0458","0.0321","","","0.0742","0.0822","","","","","","0.952","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7218370","13.0822","0.0012","9.7472","0.0008","18.0158","0.0016","90","","108.963","0.003","90","","2172.6","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H42 Br2 Co3 N4 O12 -","- C40 H42 Br2 Co3 N4 O12 -","- C80 H84 Br4 Co6 N8 O24 -","2","0.5","","Xu, Ling; Liu, Bing; Liu, Sheng-Xian; Jiao, Huan; de Castro, Baltazar; Cunha-Silva, Luís","The influence of 1-alkyl-3-methyl imidazolium ionic liquids on a series of cobalt-1,4-benzenedicarboxylate metal‒organic frameworks","CrystEngComm","2014","16","46","10649","","10.1039/C4CE01722F","","","0.71073","MoKα","","0.0849","0.0474","","","0.0994","0.1142","","","","","","1.06","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218371","33.093","0.003","9.6403","0.0009","18.513","0.0019","90","","92.954","0.005","90","","5898.3","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H50 Co3 N4 O16 -","- C50 H50 Co3 N4 O16 -","- C200 H200 Co12 N16 O64 -","4","0.5","","Xu, Ling; Liu, Bing; Liu, Sheng-Xian; Jiao, Huan; de Castro, Baltazar; Cunha-Silva, Luís","The influence of 1-alkyl-3-methyl imidazolium ionic liquids on a series of cobalt-1,4-benzenedicarboxylate metal‒organic frameworks","CrystEngComm","2014","16","46","10649","","10.1039/C4CE01722F","","","0.71073","MoKα","","0.0939","0.068","","","0.1929","0.2061","","","","","","1.007","","","","has coordinates","180514","2020-10-21","18:00:00",""
"7218388","8.9605","0.0002","10.9173","0.0003","12.2318","0.0003","90","","102.135","0.002","90","","1169.83","0.05","120","0.14","120","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C10 H16 N3 O P -","- C10 H16 N3 O P -","- C40 H64 N12 O4 P4 -","4","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","0.7107","MoKα","","0.0452","0.0334","","","0.0404","0.0411","","","","2.33","2.33","2.15","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218389","9.3055","0.0003","10.8856","0.0003","12.9523","0.0004","90","","93.386","0.002","90","","1309.73","0.07","120","0.14","120","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C12 H20 N3 O P -","- C12 H20 N3 O P -","- C48 H80 N12 O4 P4 -","4","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","1.5418","CuKα","","0.0361","0.0303","","","0.0383","0.0391","","","","2.31","2.31","2.19","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218390","10.5318","0.0003","9.1502","0.0003","40.9969","0.001","90","","90","","90","","3950.8","0.2","120","0.1","120","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H26 N3 O P -","- C22 H26 N3 O P -","- C176 H208 N24 O8 P8 -","8","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","1.5418","CuKα","","0.0426","0.0316","","","0.039","0.0399","","","","2.11","2.11","1.93","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218391","36.2225","0.0016","36.2225","0.0016","5.4306","0.0002","90","","90","","90","","7125.3","0.5","120","0.1","120","","","","","","","","","5","I 41/a :1","I 4bw -1bw","88","","","","- C20 H22 N3 O P -","- C20 H22 N3 O P -","- C320 H352 N48 O16 P16 -","16","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","1.5418","CuKα","","0.0617","0.0407","","","0.0433","0.046","","","","1.9","1.9","1.73","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218392","9.4194","0.0002","9.5502","0.0002","10.1063","0.0003","106.381","0.002","91.21","0.002","115.19","0.002","778.78","0.04","119.8","0.3","119.8","","","","","","","","","7","P -1","-P 1","2","","","","- C10 H22 Cl2 N3 O2 P Sn0 -","- C10 H22 Cl2 N3 O2 P -","- C20 H44 Cl4 N6 O4 P2 -","2","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","0.7107","MoKα","","0.0365","0.0289","","","0.0824","0.0856","","","","1.48","1.48","1.41","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218393","11.3283","0.0003","11.3283","0.0003","14.4747","0.0003","90","","90","","90","","1857.54","0.08","119.8","0.6","119.8","","","","","","","","","6","P 43","P 4cw","78","","","","- C14 H26 Cl2 N3 O2 P -","- C14 H26 Cl2 N3 O2 P -","- C56 H104 Cl8 N12 O8 P4 -","4","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","0.7107","MoKα","","0.049","0.0336","","","0.03","0.0316","","","","1.46","1.46","1.4","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218394","13.2836","0.0003","9.9293","0.0002","17.5975","0.0005","90","","109.596","0.002","90","","2186.62","0.09","119.9","0.6","119.9","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 Cl2 N3 O2 P -","- C19 H28 Cl2 N3 O2 P -","- C76 H112 Cl8 N12 O8 P4 -","4","1","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","0.7107","MoKα","","0.0453","0.0303","","","0.0332","0.0348","","","","1.88","1.88","1.74","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218395","11.3453","0.0004","12.3967","0.0004","25.1236","0.0008","94.263","0.002","98.121","0.003","116.378","0.003","3096.2","0.2","120","0.14","120","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H32 Cl2 N3 O2 P -","- C35 H32 Cl2 N3 O2 P -","- C140 H128 Cl8 N12 O8 P4 -","4","2","","Pourayoubi, Mehrdad; Toghraee, Maryam; Zhu, Jianfeng; Dušek, Michal; Bereciartua, Pablo J.; Eigner, Václav","Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and15N NMR study","CrystEngComm","2014","16","47","10870","","10.1039/C4CE01793E","","x-ray","1.5418","CuKα","","0.0387","0.0296","","","0.0656","0.0698","","","","1.44","1.44","1.37","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218404","7.1884","0.0002","10.329","0.0003","12.3618","0.0004","90","","90","","90","","917.85","0.05","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- O11 P Rb V2 -","- O11 P Rb V2 -","- O44 P4 Rb4 V8 -","4","1","","Gautier, R.; Auguste, S.; Clevers, S.; Dupray, V.; Coquerel, G.; Le Fur, E.","Influence of the cation size on the second harmonic generation response of chiral A(VO2)2(PO4)·3H2O (A = K+, NH4+and Rb+)","CrystEngComm","2014","16","47","10902","","10.1039/C4CE01847H","","x-ray","0.71069","MoKα","","0.0537","0.0386","","","0.0702","0.0748","","","","","","1.161","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218405","7.1203","0.0001","10.1782","0.0002","12.3477","0.0003","90","","90","","90","","894.86","0.03","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- K O11 P V2 -","- K O11 P V2 -","- K4 O44 P4 V8 -","4","1","","Gautier, R.; Auguste, S.; Clevers, S.; Dupray, V.; Coquerel, G.; Le Fur, E.","Influence of the cation size on the second harmonic generation response of chiral A(VO2)2(PO4)·3H2O (A = K+, NH4+and Rb+)","CrystEngComm","2014","16","47","10902","","10.1039/C4CE01847H","","x-ray","0.71069","MoKα","","0.0292","0.0263","","","0.0679","0.0687","","","","","","1.217","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218410","10.6792","0.0015","9.1741","0.0014","9.0549","0.0012","90","","100.211","0.003","90","","873.1","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","trans-1,4-cyclohexanedimethanol","","- C8 H16 O2 -","- C8 H16 O2 -","- C32 H64 O8 -","4","1","","Rosado, Mário T. S.; Maria, Teresa M. R.; Castro, Ricardo A. E.; Canotilho, João; Silva, Manuela Ramos; Eusébio, M. Ermelinda S.","Molecular structure and polymorphism of a cyclohexanediol: trans-1,4-cyclohexanedimethanol","CrystEngComm","2014","16","48","10977","","10.1039/C4CE01211A","","","0.71073","MoKα","","0.1269","0.0533","","","0.1261","0.1573","","","","","","0.99","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218411","5.1064","0.0004","5.1749","0.0004","16.3054","0.001","88.25","0.005","81.485","0.005","79.662","0.005","419.2","0.05","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","trans-1,4-cyclohexanedimethanol","","- C8 H16 O2 -","- C8 H16 O2 -","- C16 H32 O4 -","2","1","","Rosado, Mário T. S.; Maria, Teresa M. R.; Castro, Ricardo A. E.; Canotilho, João; Silva, Manuela Ramos; Eusébio, M. Ermelinda S.","Molecular structure and polymorphism of a cyclohexanediol: trans-1,4-cyclohexanedimethanol","CrystEngComm","2014","16","48","10977","","10.1039/C4CE01211A","","","0.71073","MoKα","","0.1254","0.06","","","0.1756","0.2336","","","","","","0.917","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218446","7.8024","0.0013","15.776","0.003","22.417","0.004","90","","100.022","0.003","90","","2717.2","0.8","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 N4 O8 Zn -","- C27 H18 N4 O8 Zn -","- C108 H72 N16 O32 Zn4 -","4","1","","Wu, He; Sun, Wujuan; Shi, Ting; Liao, Xuzhao; Zhao, Wenjie; Yang, Xuwu","The various architectures and properties of a series of coordination polymers tuned by the central metals and auxiliary N-donor ligands","CrystEngComm","2014","16","48","11088","","10.1039/C4CE01602E","","","0.71073","MoKα","","0.1071","0.0617","","","0.1639","0.1878","","","","","","1.013","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218447","20.2193","0.0004","6.5716","0.0001","27.935","0.0005","90","","90","","90","","3711.81","0.11","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H12 O9 Zn2 -","- C15 H12 O9 Zn2 -","- C120 H96 O72 Zn16 -","8","1","","Wu, He; Sun, Wujuan; Shi, Ting; Liao, Xuzhao; Zhao, Wenjie; Yang, Xuwu","The various architectures and properties of a series of coordination polymers tuned by the central metals and auxiliary N-donor ligands","CrystEngComm","2014","16","48","11088","","10.1039/C4CE01602E","","","0.71073","MoKα","","0.0647","0.0401","","","0.0972","0.1197","","","","","","1.01","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218448","29.778","0.002","6.6754","0.0005","19.4782","0.0014","90","","113.623","0.001","90","","3547.4","0.4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H23 Cd3 N0 O17 -","- C30 H22 Cd3 O17 -","- C120 H88 Cd12 O68 -","4","0.5","","Wu, He; Sun, Wujuan; Shi, Ting; Liao, Xuzhao; Zhao, Wenjie; Yang, Xuwu","The various architectures and properties of a series of coordination polymers tuned by the central metals and auxiliary N-donor ligands","CrystEngComm","2014","16","48","11088","","10.1039/C4CE01602E","","","0.71073","MoKα","","0.0507","0.037","","","0.1361","0.1484","","","","","","1.055","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218449","10.0131","0.0012","24.639","0.003","13.7618","0.0016","90","","109.151","0.002","90","","3207.3","0.7","296","2","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H20 Cd3 N2 O13 -","- C34 H20 Cd3 N2 O13 -","- C136 H80 Cd12 N8 O52 -","4","0.5","","Wu, He; Sun, Wujuan; Shi, Ting; Liao, Xuzhao; Zhao, Wenjie; Yang, Xuwu","The various architectures and properties of a series of coordination polymers tuned by the central metals and auxiliary N-donor ligands","CrystEngComm","2014","16","48","11088","","10.1039/C4CE01602E","","","0.71073","MoKα","","0.089","0.0488","","","0.1064","0.1372","","","","","","1.003","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218450","10.0418","0.0012","9.7038","0.0012","26.051","0.003","90","","95.109","0.002","90","","2528.4","0.5","296","2","296","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C54 H46 Cd3 N8 O18 -","- C54 H46 Cd3 N8 O18 -","- C108 H92 Cd6 N16 O36 -","2","0.5","","Wu, He; Sun, Wujuan; Shi, Ting; Liao, Xuzhao; Zhao, Wenjie; Yang, Xuwu","The various architectures and properties of a series of coordination polymers tuned by the central metals and auxiliary N-donor ligands","CrystEngComm","2014","16","48","11088","","10.1039/C4CE01602E","","","0.71073","MoKα","","0.0893","0.0574","","","0.1065","0.1284","","","","","","1.015","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218452","5.708","0.005","10.8436","0.001","14.131","0.014","96.952","0.019","93.91","0.02","90.07","0.02","866.2","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2-Bromomandelic Acid","","","- C8 H7 Br O3 -","- C8 H7 Br O3 -","- C32 H28 Br4 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.107","0.0717","","","0.1576","0.1788","","","","","","1.204","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218453","8.1888","0.0012","10.1998","0.0014","9.2654","0.0012","90","","92.709","0.007","90","","773.02","0.18","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 F O3 -","- C8 H7 F O3 -","- C32 H28 F4 O12 -","4","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0847","0.0602","","","0.1587","0.1743","","","","","","1.061","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218454","5.805","0.003","10.732","0.006","13.969","0.007","96.527","0.013","92.909","0.013","90.058","0.013","863.5","0.8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 I O3 -","- C8 H7 I O3 -","- C32 H28 I4 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0799","0.0602","","","0.1284","0.136","","","","","","1.09","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218455","8.833","0.005","9.263","0.005","10.75","0.005","73.23","0.005","81.067","0.005","77.849","0.005","819.1","0.7","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71073","MoKα","","0.0653","0.0443","","","0.1082","0.1212","","","","","","1.052","","","","has coordinates","183084","2020-10-21","18:00:00",""
"7218456","8.8529","0.0007","8.921","0.0006","10.7745","0.0008","90","","90.568","0.006","90","","850.89","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 Br O3 -","- C8 H7 Br O3 -","- C32 H28 Br4 O12 -","4","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0299","0.0264","","","0.0646","0.0678","","","","","","1.064","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218457","8.8285","0.0005","9.3102","0.0007","10.4698","0.0007","92.436","0.008","90.26","0.008","94.119","0.008","857.54","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 Br O3 -","- C8 H7 Br O3 -","- C32 H28 Br4 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","x-ray","0.71075","MoKα","","0.0984","0.0516","","","0.0864","0.1005","","","","","","1.036","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218458","8.6521","0.0015","8.9195","0.0015","10.7309","0.0017","90","","90.9","0.006","90","","828","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 Cl O3 -","- C8 H7 Cl O3 -","- C32 H28 Cl4 O12 -","4","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0964","0.0554","","","0.1217","0.1395","","","","","","1.05","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218459","9.0086","0.0005","9.6372","0.0007","10.5702","0.0007","86.602","0.005","88.612","0.005","85.623","0.004","913.22","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","3-Trifluoromomandelic Acid","","","- C9 H7 F3 O3 -","- C9 H7 F3 O3 -","- C36 H28 F12 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","x-ray","0.71075","MoKα","","0.0692","0.0543","","","0.1263","0.1326","","","","","","1.107","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7218460","8.1424","0.0006","10.2396","0.0007","9.3604","0.0006","90","","91.016","0.008","90","","780.3","0.09","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 F O3 -","- C8 H7 F O3 -","- C32 H28 F4 O12 -","4","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","x-ray","0.71075","MoKα","","0.1836","0.1026","","","0.2744","0.3223","","","","","","1.08","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218461","6.8488","0.0004","14.1055","0.001","15.0534","0.001","104.634","0.007","94.543","0.007","90.699","0.006","1401.87","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 I O3 -","- C8 H7 I O3 -","- C48 H42 I6 O18 -","6","3","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0853","0.0549","","","0.1094","0.12","","","","","","1.045","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218462","8.5713","0.0005","9.3327","0.0007","10.5393","0.0007","92.391","0.006","94.241","0.006","90.556","0.006","839.96","0.1","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","3-methylmandelic acid","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","x-ray","0.71075","MoKα","","0.0798","0.0513","","","0.1175","0.1321","","","","","","1.032","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218463","19.5315","0.0014","9.741","0.0007","9.1389","0.0006","90","","101.132","0.004","90","","1706","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 Br O3 -","- C8 H7 Br O3 -","- C64 H56 Br8 O24 -","8","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","x-ray","0.71075","MoKα","","0.113","0.0847","","","0.207","0.2205","","","","","","1.161","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218464","4.9711","0.0004","14.9062","0.0012","16.792","0.0013","88.109","0.008","85.871","0.008","84.381","0.009","1234.68","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 Cl O3 -","- C8 H7 Cl O3 -","- C48 H42 Cl6 O18 -","6","3","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","x-ray","0.71075","MoKα","","0.305","0.1238","","","0.2195","0.3039","","","","","","1.01","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218465","9.8173","0.0005","9.692","0.0005","19.9217","0.0014","90","","90","","90","","1895.54","0.19","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H7 F3 O3 -","- C9 H7 F3 O3 -","- C72 H56 F24 O24 -","8","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.1612","0.0832","","","0.1104","0.13","","","","","","1.133","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218466","4.9583","0.0005","10.3607","0.0011","17.675","0.002","76.455","0.005","83.237","0.006","88.779","0.006","876.58","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 I O3 -","- C8 H7 I O3 -","- C32 H28 I4 O12 -","4","2","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0852","0.0615","","","0.1576","0.1692","","","","","","1.063","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218467","9.8365","0.0007","9.4215","0.0007","19.239","0.0015","90","","90","","90","","1783","0.2","120","2","120","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C72 H80 O24 -","8","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71073","MoKα","","0.192","0.071","","","0.1594","0.2198","","","","","","0.996","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218468","20.805","0.003","15.649","0.003","5.3033","0.0007","90","","90","","90","","1726.6","0.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C9 H10 O4 -","- C9 H10 O4 -","- C72 H80 O32 -","8","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71073","MoKα","","0.1957","0.0767","","","0.1049","0.132","","","","","","0.992","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218469","18.6794","0.0013","5.1376","0.0002","9.214","0.004","90","","103.682","0.012","90","","859.2","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 O4 -","- C9 H10 O4 -","- C36 H40 O16 -","4","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0433","0.0336","","","0.0916","0.0958","","","","","","1.098","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218470","5.0748","0.001","5.2814","0.001","15.032","0.004","91.142","0.007","92.37","0.007","111.42","0.008","374.47","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 F O3 -","- C8 H7 F O3 -","- C16 H14 F2 O6 -","2","1","","Coles, S. J.; Ellis, A. L.; Leung, K.; Sarson, J.; Threlfall, T. L.; Tizzard, G. J.","Relationships between the racemic structures of substituted mandelic acids containing 8- and 10-membered hydrogen bonded dimer rings","CrystEngComm","2014","16","47","10816","","10.1039/C4CE01832J","","","0.71075","MoKα","","0.0906","0.0616","","","0.155","0.1666","","","","","","1.116","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218480","12.809","0.002","13.372","0.002","7.3552","0.0011","90","","90","","90","","1259.8","0.3","130","2","130","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C8 H17 N5 O6 -","- C8 H17 N5 O6 -","- C32 H68 N20 O24 -","4","1","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.0643","0.0459","","","0.0806","0.0856","","","","","","0.91","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218481","7.1418","0.0009","10.6881","0.0013","15.8359","0.0019","90","","92.827","0.002","90","","1207.3","0.3","130","2","130","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H15 N5 O5 -","- C8 H15 N5 O5 -","- C32 H60 N20 O20 -","4","2","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.0378","0.0331","","","0.0712","0.0721","","","","","","0.964","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218482","7.576","0.0014","8.3143","0.0015","8.5662","0.0016","63.075","0.002","88.633","0.003","81.063","0.003","474.58","0.15","130","2","130","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H14 N5 O3 -","- C6 H14 N5 O3 -","- C12 H28 N10 O6 -","2","1","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.045","0.0376","","","0.0991","0.1022","","","","","","1.093","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218483","13.1608","0.0014","12.6922","0.0014","19.7008","0.0018","90","","120.795","0.002","90","","2826.8","0.5","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H58 N20 O17 -","- C50 H58 N20 O17 -","- C100 H116 N40 O34 -","2","0.5","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.0993","0.0473","","","0.0934","0.1012","","","","","","0.927","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7218484","8.9093","0.0016","10.772","0.002","12.425","0.002","71.502","0.003","74.311","0.003","80.732","0.003","1085","0.3","130","2","130","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H24 N10 O4 -","- C20 H24 N10 O4 -","- C40 H48 N20 O8 -","2","1","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.0678","0.0437","","","0.0781","0.086","","","","","","0.923","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218485","8.2558","0.0012","14.578","0.002","13.1414","0.0019","90","","102.833","0.002","90","","1542.1","0.4","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N5 O5 -","- C13 H17 N5 O5 -","- C52 H68 N20 O20 -","4","1","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.065","0.0414","","","0.0873","0.0928","","","","","","0.894","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218486","8.0245","0.0007","13.0557","0.0011","22.2369","0.0019","87.683","0.002","82.848","0.002","73.025","0.002","2210.8","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H17 N5 O5 -","- C13 H17 N5 O5 -","- C78 H102 N30 O30 -","6","3","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.0916","0.0535","","","0.0895","0.0995","","","","","","0.953","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218487","11.7133","0.0007","12.8357","0.0007","19.3224","0.0011","90","","90.355","0.001","90","","2905","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 N10 O8 -","- C26 H30 N10 O8 -","- C104 H120 N40 O32 -","4","1","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.055","0.0441","","","0.1001","0.1074","","","","","","1.045","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7218488","9.406","0.003","11.576","0.003","11.779","0.003","90","","107.623","0.004","90","","1222.4","0.6","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H14 N5 O2 -","- C11 H14 N5 O2 -","- C44 H56 N20 O8 -","4","1","","Şerb, Mihaela-Diana; Kalf, Irmgard; Englert, Ulli","Biguanide and squaric acid as pH-dependent building blocks in crystal engineering","CrystEngComm","2014","16","46","10631","","10.1039/C4CE01643B","","","0.71073","MoKα","","0.0413","0.0353","","","0.0962","0.0985","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218489","19.965","0.003","6.112","0.001","19.828","0.003","90","","111.194","0.002","90","","2255.9","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 Nd2 O17 S2 -","- C14 H14 Nd2 O17 S2 -","- C56 H56 Nd8 O68 S8 -","4","0.5","","Li, Zhao-Hao; Xue, Li-Ping; Shan, Li-Li; Zhao, Bang-Tun; Kan, Jian; Su, Wei-Ping","Hydrogen bonded-extended lanthanide coordination polymers decorated with 2,3-thiophenedicarboxylate and oxalate: synthesis, structures, and properties","CrystEngComm","2014","16","47","10824","","10.1039/C4CE01734J","","","0.71073","MoKα","","0.0191","0.0189","","","0.0509","0.0511","","","","","","1.029","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218490","19.746","0.006","6.0662","0.0019","19.785","0.006","90","","111.051","0.003","90","","2211.7","1.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 Eu2 O17 S2 -","- C14 H14 Eu2 O17 S2 -","- C56 H56 Eu8 O68 S8 -","4","0.5","","Li, Zhao-Hao; Xue, Li-Ping; Shan, Li-Li; Zhao, Bang-Tun; Kan, Jian; Su, Wei-Ping","Hydrogen bonded-extended lanthanide coordination polymers decorated with 2,3-thiophenedicarboxylate and oxalate: synthesis, structures, and properties","CrystEngComm","2014","16","47","10824","","10.1039/C4CE01734J","","","0.71073","MoKα","","0.0227","0.0225","","","0.0559","0.056","","","","","","1.268","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218491","19.671","0.004","6.0556","0.0013","19.793","0.004","90","","111.098","0.002","90","","2199.7","0.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 Gd2 O17 S2 -","- C14 H14 Gd2 O17 S2 -","- C56 H56 Gd8 O68 S8 -","4","0.5","","Li, Zhao-Hao; Xue, Li-Ping; Shan, Li-Li; Zhao, Bang-Tun; Kan, Jian; Su, Wei-Ping","Hydrogen bonded-extended lanthanide coordination polymers decorated with 2,3-thiophenedicarboxylate and oxalate: synthesis, structures, and properties","CrystEngComm","2014","16","47","10824","","10.1039/C4CE01734J","","","0.71073","MoKα","","0.021","0.0206","","","0.0528","0.053","","","","","","1.095","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218492","19.621","0.003","6.0421","0.0009","19.795","0.003","90","","111.09","0.001","90","","2189.5","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 O17 S2 Tb2 -","- C14 H14 O17 S2 Tb2 -","- C56 H56 O68 S8 Tb8 -","4","0.5","","Li, Zhao-Hao; Xue, Li-Ping; Shan, Li-Li; Zhao, Bang-Tun; Kan, Jian; Su, Wei-Ping","Hydrogen bonded-extended lanthanide coordination polymers decorated with 2,3-thiophenedicarboxylate and oxalate: synthesis, structures, and properties","CrystEngComm","2014","16","47","10824","","10.1039/C4CE01734J","","","0.71073","MoKα","","0.0225","0.0224","","","0.058","0.058","","","","","","1.155","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218493","19.489","0.005","6.0107","0.0016","19.762","0.005","90","","111.257","0.002","90","","2157.5","1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 Ho2 O17 S2 -","- C14 H14 Ho2 O17 S2 -","- C56 H56 Ho8 O68 S8 -","4","0.5","","Li, Zhao-Hao; Xue, Li-Ping; Shan, Li-Li; Zhao, Bang-Tun; Kan, Jian; Su, Wei-Ping","Hydrogen bonded-extended lanthanide coordination polymers decorated with 2,3-thiophenedicarboxylate and oxalate: synthesis, structures, and properties","CrystEngComm","2014","16","47","10824","","10.1039/C4CE01734J","","","0.71073","MoKα","","0.0221","0.0215","","","0.0531","0.0533","","","","","","1.166","","","","has coordinates","180515","2020-10-21","18:00:00",""
"7218498","10.4896","0.0004","12.9381","0.0005","9.9423","0.0003","90","","117.876","0.003","90","","1192.75","0.08","270","2","270","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 Br F N O -","- C13 H11 Br F N O -","- C52 H44 Br4 F4 N4 O4 -","4","1","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.71073","MoKα","","0.0643","0.0391","","","0.0988","0.1032","","","","","","1.062","","","","has coordinates,has disorder","180515","2020-10-21","18:00:00",""
"7218499","9.5818","0.0003","11.4519","0.0003","12.5667","0.0004","109.027","0.002","94.23","0.002","105.253","0.002","1238.29","0.07","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H10.5 Br Cl N O0.75 -","- C13 H10.5 Br Cl N O0.75 -","- C52 H42 Br4 Cl4 N4 O3 -","4","2","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.71069","MoKα","","0.066","0.0467","","","0.1107","0.1208","","","","","","1.046","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218500","7.3152","0.0006","9.7141","0.0009","10.352","0.002","68.687","0.003","86.209","0.003","68.298","0.004","634.75","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 Br2 N O -","- C13 H11 Br2 N O -","- C26 H22 Br4 N2 O2 -","2","1","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.71073","MoKα","","0.1223","0.0799","","","0.2424","0.2541","","","","","","1.039","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218501","7.5841","0.0006","19.2894","0.0016","9.3211","0.0009","90","","105.886","0.004","90","","1311.5","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 Br I N O -","- C13 H11 Br I N O -","- C52 H44 Br4 I4 N4 O4 -","4","1","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.7107","MoKα","","0.0716","0.0477","","","0.1057","0.117","","","","","","1.075","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218502","7.5081","0.0003","10.494","0.0005","11.7322","0.0006","105.219","0.002","105.581","0.002","101.791","0.002","820.76","0.07","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H9 I4 N -","- C13 H9 I4 N -","- C26 H18 I8 N2 -","2","1","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.71073","MoKα","","0.1399","0.1155","","","0.3405","0.3512","","","","","","1.13","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218503","7.799","0.001","9.585","0.002","9.664","0.002","68.967","0.007","70.925","0.006","83.339","0.006","637.3","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Br N O -","- C14 H14 Br N O -","- C28 H28 Br2 N2 O2 -","2","1","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.7107","MoKα","","0.0936","0.0611","","","0.1552","0.1689","","","","","","1.002","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218504","7.7034","0.0007","9.141","0.001","12.257","0.002","88.73","0.006","78.321","0.006","71.486","0.004","800.66","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H38 Br2 N2 O -","- C34 H38 Br2 N2 O -","- C34 H38 Br2 N2 O -","1","0.5","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","","","0.7107","MoKα","","0.0779","0.0586","","","0.1529","0.1666","","","","","","1.134","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218505","18.08801","0.00059","12.04679","0.00049","7.2298","0.00019","90","","90","","90","","1575.39","0.09","293","","293","","","","","","","","","5","P c a 21","P 2c -2ac","29","9-tert-butylacridizinium bromide monohydrate","","","- C17 H20 Br N O -","- C17 H20 Br N O -","- C68 H80 Br4 N4 O4 -","4","1","","Stratford, Samuel A.; Arhangelskis, Mihails; Bučar, Dejan-Krešimir; Jones, William","Solid-state photoreactivity of 9-substituted acridizinium bromide salts","CrystEngComm","2014","16","47","10830","","10.1039/C4CE01622J","powder diffraction","","1.5406","CuKα~1~","","","","","","","","","0.021","2.552","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218507","9.4202","0.0005","16.8486","0.0006","9.1845","0.0005","90","","97.746","0.006","90","","1444.44","0.12","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(dimethylammonium)(manganese(II)-(benezenetetrasulfonate))(dimethylfornamide)","","","- C16 H32 Mn N4 O14 S4 -","- C16 H32 Mn N4 O14 S4 -","- C32 H64 Mn2 N8 O28 S8 -","2","0.5","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Schwickert, Christian; Pöttgen, Rainer; Wickleder, Mathias S.","1,2,4,5-Benzenetetrasulfonic acid and 1,4-benzenedisulfonic acid as sulfo analogues of pyromellitic and terephthalic acids for building coordination polymers of manganese","CrystEngComm","2014","16","48","11064","","10.1039/C4CE01618A","","","0.71073","MoKα","","0.0643","0.0357","","","0.0771","0.0837","","","","","","0.87","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218508","9.317","0.0007","10.4919","0.0007","19.4487","0.0012","90","","113.529","0.003","90","","1743.1","0.2","120","2","120.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(hydroxymethyldihydropyrrolium)(manganese(II)-(benezenetetrasulfonate))(N-methylpyrrolidone)","","","- C26 H40 Mn N4 O16 S4 -","- C26 H34 Mn N4 O16 S4 -","- C52 H68 Mn2 N8 O32 S8 -","2","0.5","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Schwickert, Christian; Pöttgen, Rainer; Wickleder, Mathias S.","1,2,4,5-Benzenetetrasulfonic acid and 1,4-benzenedisulfonic acid as sulfo analogues of pyromellitic and terephthalic acids for building coordination polymers of manganese","CrystEngComm","2014","16","48","11064","","10.1039/C4CE01618A","","","0.71073","MoKα","","0.0818","0.0501","","","0.131","0.1484","","","","","","1.029","","","","has coordinates,has disorder","180516","2020-10-21","18:00:00",""
"7218509","5.143","0.0007","9.262","0.0012","9.402","0.0013","93.552","0.008","99.993","0.007","99.237","0.007","433.48","0.1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","(manganese(II)-benzenedisulfonoc acid)(dimethylformamide)","","","- C12 H18 Mn N2 O8 S2 -","- C12 H18 Mn N2 O8 S2 -","- C12 H18 Mn N2 O8 S2 -","1","0.5","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Schwickert, Christian; Pöttgen, Rainer; Wickleder, Mathias S.","1,2,4,5-Benzenetetrasulfonic acid and 1,4-benzenedisulfonic acid as sulfo analogues of pyromellitic and terephthalic acids for building coordination polymers of manganese","CrystEngComm","2014","16","48","11064","","10.1039/C4CE01618A","","","0.71073","MoKα","","0.0462","0.029","","","0.0637","0.067","","","","","","0.956","","","","has coordinates,has disorder","180516","2020-10-21","18:00:00",""
"7218510","9.36","0.0004","9.8494","0.0004","10.3475","0.0005","81.606","0.002","88.941","0.002","82.364","0.002","935.35","0.07","120","2","120.15","","","","","","","","","6","P -1","-P 1","2","manganese(II)-benzenedisulfonate-dimethylacetamide","","","- C14 H22 Mn N2 O8 S2 -","- C14 H19.75 Mn N2 O8 S2 -","- C28 H39.5 Mn2 N4 O16 S4 -","2","1","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Schwickert, Christian; Pöttgen, Rainer; Wickleder, Mathias S.","1,2,4,5-Benzenetetrasulfonic acid and 1,4-benzenedisulfonic acid as sulfo analogues of pyromellitic and terephthalic acids for building coordination polymers of manganese","CrystEngComm","2014","16","48","11064","","10.1039/C4CE01618A","","","0.71073","MoKα","","0.0504","0.0348","","","0.0939","0.1002","","","","","","1.019","","","","has coordinates,has disorder","180516","2020-10-21","18:00:00",""
"7218511","9.6297","0.0003","9.7676","0.0003","10.3423","0.0003","89.371","0.001","78.839","0.001","87.604","0.002","953.55","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(manganese(II)-benzenedisulfonate)(N-methylpyrrolidone)","","","- C16 H22 Mn N2 O8 S2 -","- C16 H22 Mn N2 O8 S2 -","- C32 H44 Mn2 N4 O16 S4 -","2","1","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Schwickert, Christian; Pöttgen, Rainer; Wickleder, Mathias S.","1,2,4,5-Benzenetetrasulfonic acid and 1,4-benzenedisulfonic acid as sulfo analogues of pyromellitic and terephthalic acids for building coordination polymers of manganese","CrystEngComm","2014","16","48","11064","","10.1039/C4CE01618A","","","0.71073","MoKα","","0.0315","0.0244","","","0.0732","0.075","","","","","","1.066","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218512","19.568","0.002","20.952","0.002","23.623","0.003","74.831","0.002","86.481","0.002","64.269","0.002","8405.6","1.6","296","2","296","2","","","","","","","","9","P -1","-P 1","2","","","","- C14 H126 As6 Ce4 K14 Li4 N2 O264 W58 -","- C14 H6 As6 Ce4 K14 N2 O246 W58 -","- C14 H6 As6 Ce4 K14 N2 O246 W58 -","1","0.5","","Li, Suzhi; Wang, Yuan; Ma, Pengtao; Wang, Jingping; Niu, Jingyang","From a versatile arsenotungstate precursor to a large lanthanide-containing polyoxometalate‒carboxylate hybrid","CrystEngComm","2014","16","47","10746","","10.1039/C4CE01577K","","","0.71073","MoKα","","0.135","0.0796","","","0.1833","0.2001","","","","","","1.078","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218540","21.293","0.002","7.8312","0.0009","13.9098","0.0016","90","","109.82","0.002","90","","2182.1","0.4","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Moxonidine","4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methylpyrimidin-5-amine","","- C9 H12 Cl N5 O -","- C9 H12 Cl N5 O -","- C72 H96 Cl8 N40 O8 -","8","1","","Babu Nanubolu, Jagadeesh; Sridhar, Balasubramanian; Ravikumar, Krishnan","Understanding the amino ↔ imino tautomeric preference in (imidazole)imidazolidine-N-aryl(alkyl) systems: a case study of moxonidine drug and insights from the Cambridge structural database (CSD)","CrystEngComm","2014","16","46","10602","","10.1039/C4CE01541J","","","0.71073","MoKα","","0.0656","0.064","","","0.148","0.149","","","","","","1.271","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218541","8.5413","0.001","13.2793","0.0015","24.376","0.003","90","","90","","90","","2764.8","0.6","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Moxonidine hydrochloride monohydrate","Moxonidine hydrochloride monohydrate","","- C9 H15 Cl2 N5 O2 -","- C9 H15 Cl2 N5 O2 -","- C72 H120 Cl16 N40 O16 -","8","1","","Babu Nanubolu, Jagadeesh; Sridhar, Balasubramanian; Ravikumar, Krishnan","Understanding the amino ↔ imino tautomeric preference in (imidazole)imidazolidine-N-aryl(alkyl) systems: a case study of moxonidine drug and insights from the Cambridge structural database (CSD)","CrystEngComm","2014","16","46","10602","","10.1039/C4CE01541J","","","0.71073","MoKα","","0.0614","0.0535","","","0.1293","0.1346","","","","","","1.166","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218542","14.639","0.006","17.452","0.007","23.468","0.009","90","","90","","90","","5996","4","223","2","223","2","","","","","","","","6","P c 21 n","P -2n -2ac","33","","","","- C40 H66 Cl N26 Nd O29 -","- C40 H44 Cl N26 Nd O23 -","- C160 H176 Cl4 N104 Nd4 O92 -","4","1","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0841","0.0587","","","0.1414","0.1525","","","","","","1.011","","","","has coordinates,has disorder","180516","2020-10-21","18:00:00",""
"7218543","14.6418","0.0017","17.407","0.002","23.369","0.003","90","","90","","90","","5956.1","1.2","293","2","293","2","","","","","","","","6","P c 21 n","P -2n -2ac","33","","","","- C40 H66 Cl N26 O29 Sm -","- C40 H44 Cl N26 O23 Sm -","- C160 H176 Cl4 N104 O92 Sm4 -","4","1","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0536","0.0458","","","0.1248","0.1305","","","","","","1.054","","","","has coordinates,has disorder","180516","2020-10-21","18:00:00",""
"7218544","14.641","0.003","17.416","0.004","23.351","0.005","90","","90","","90","","5954","2","223","2","223","2","","","","","","","","6","P c 21 n","P -2n -2ac","33","","","","- C40 H66 Cl Eu N26 O29 -","- C40 H44 Cl Eu N26 O23 -","- C160 H176 Cl4 Eu4 N104 O92 -","4","1","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.067","0.0541","","","0.1421","0.1515","","","","","","1.019","","","","has coordinates,has disorder","180516","2020-10-21","18:00:00",""
"7218545","35.306","0.005","14.142","0.002","13.4153","0.0019","90","","90","","90","","6698.2","1.6","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H88 Cl Gd N26 O40 -","- C40 H44 Cl Gd N26 O25 -","- C160 H176 Cl4 Gd4 N104 O100 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.076","0.0631","","","0.148","0.1542","","","","","","1.109","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218546","35.381","0.003","14.2066","0.0013","13.4355","0.0013","90","","90","","90","","6753.3","1.1","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H88 Cl N26 O40 Tb -","- C40 H44 Cl N26 O25 Tb -","- C160 H176 Cl4 N104 O100 Tb4 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0717","0.0535","","","0.1411","0.1495","","","","","","1.084","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218547","35.375","0.004","14.1652","0.0017","13.4397","0.0016","90","","90","","90","","6734.6","1.4","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H88 Cl Dy N26 O40 -","- C40 H44 Cl Dy N26 O25 -","- C160 H176 Cl4 Dy4 N104 O100 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0729","0.0503","","","0.1349","0.1441","","","","","","1.052","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218548","35.361","0.005","14.168","0.002","13.4332","0.0019","90","","90","","90","","6730","1.6","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H88 Cl Ho N26 O40 -","- C40 H44 Cl Ho N26 O25 -","- C160 H176 Cl4 Ho4 N104 O100 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0794","0.0527","","","0.1438","0.154","","","","","","1.053","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218549","35.37","0.004","14.161","0.0017","13.4086","0.0016","90","","90","","90","","6716","1.4","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H86 Cl Er N26 O39 -","- C40 H44 Cl Er N26 O25 -","- C160 H176 Cl4 Er4 N104 O100 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.072","0.0552","","","0.1323","0.1396","","","","","","1.119","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218550","35.285","0.005","14.1423","0.0019","13.3923","0.0018","90","","90","","90","","6682.9","1.6","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H90 Cl N26 O41 Tm -","- C40 H44 Cl N26 O25 Tm -","- C160 H176 Cl4 N104 O100 Tm4 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0818","0.0533","","","0.144","0.1542","","","","","","1.05","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218551","35.396","0.004","14.1853","0.0018","13.4031","0.0017","90","","90","","90","","6729.7","1.4","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H84 Cl N26 O38 Yb -","- C40 H44 Cl N26 O25 Yb -","- C160 H176 Cl4 N104 O100 Yb4 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0665","0.0445","","","0.1268","0.1366","","","","","","1.073","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218552","35.247","0.013","14.129","0.005","13.384","0.005","90","","90","","90","","6665","4","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H86 Cl Lu N26 O39 -","- C40 H44 Cl Lu N26 O25 -","- C160 H176 Cl4 Lu4 N104 O100 -","4","0.5","","Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang","Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides","CrystEngComm","2014","16","46","10674","","10.1039/C4CE00870G","","","0.71073","MoKα","","0.0805","0.0475","","","0.1387","0.1512","","","","","","1.079","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218565","10.331","0.004","7.626","0.003","28.392","0.011","90","","90","","90","","2236.8","1.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H7 N O2 S2 -","- C12 H7 N O2 S2 -","- C96 H56 N8 O16 S16 -","8","1","","Lin, Zhenghuan; Mei, Xiaofei; Yang, E.; Li, Xiaoju; Yao, Huimei; Wen, Guixiu; Chien, Ching-Ting; Chow, Tahsin J.; Ling, Qidan","Polymorphism-dependent fluorescence of bisthienylmaleimide with different responses to mechanical crushing and grinding pressure","CrystEngComm","2014","16","48","11018","","10.1039/C4CE00963K","","","0.71073","MoKα","","","0.0825","","","0.254","0.2621","","","","","","1.077","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218566","11.228","0.004","5.689","0.002","17.281","0.007","90","","94.745","0.006","90","","1100.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 N O2 S2 -","- C12 H7 N O2 S2 -","- C48 H28 N4 O8 S8 -","4","1","","Lin, Zhenghuan; Mei, Xiaofei; Yang, E.; Li, Xiaoju; Yao, Huimei; Wen, Guixiu; Chien, Ching-Ting; Chow, Tahsin J.; Ling, Qidan","Polymorphism-dependent fluorescence of bisthienylmaleimide with different responses to mechanical crushing and grinding pressure","CrystEngComm","2014","16","48","11018","","10.1039/C4CE00963K","","","0.71073","MoKα","","","0.0437","","","0.1191","0.1225","","","","","","1.043","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218567","12.993","0.006","10.604","0.004","12.69","0.006","90","","116.119","0.007","90","","1569.9","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Cd Cl N7 O6 -","- C10 H6 Cd Cl N7 O6 -","- C40 H24 Cd4 Cl4 N28 O24 -","4","1","","Pan, Jie; Jiang, Fei-Long; Wu, Ming-Yan; Chen, Lian; Qian, Jin-Jie; Su, Kong-Zhao; Wan, Xiu-Yan; Hong, Mao-Chun","Five novel Zn(ii)/Cd(ii) coordination polymers based on bis(pyrazinyl)-triazole and varied polycarboxylates: syntheses, topologies and photoluminescence","CrystEngComm","2014","16","48","11078","","10.1039/C4CE01959H","","","0.71073","MoKα","","0.0554","0.0406","","","0.1201","0.1539","","","","","","0.992","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218568","16.646","0.009","29.783","0.016","17.274","0.009","90","","90","","90","","8564","8","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C30 H22 Cd4 N14 O14 -","- C30 H22 Cd4 N14 O14 -","- C240 H176 Cd32 N112 O112 -","8","1","","Pan, Jie; Jiang, Fei-Long; Wu, Ming-Yan; Chen, Lian; Qian, Jin-Jie; Su, Kong-Zhao; Wan, Xiu-Yan; Hong, Mao-Chun","Five novel Zn(ii)/Cd(ii) coordination polymers based on bis(pyrazinyl)-triazole and varied polycarboxylates: syntheses, topologies and photoluminescence","CrystEngComm","2014","16","48","11078","","10.1039/C4CE01959H","","","0.71073","MoKα","","0.0614","0.0578","","","0.1732","0.1795","","","","","","1.081","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218569","25.901","0.006","12.953","0.003","36.822","0.008","90","","110.234","0.003","90","","11591","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H28 Cd4 N21 O14 -","- C50 H27 Cd4 N21 O14 -","- C400 H216 Cd32 N168 O112 -","8","1","","Pan, Jie; Jiang, Fei-Long; Wu, Ming-Yan; Chen, Lian; Qian, Jin-Jie; Su, Kong-Zhao; Wan, Xiu-Yan; Hong, Mao-Chun","Five novel Zn(ii)/Cd(ii) coordination polymers based on bis(pyrazinyl)-triazole and varied polycarboxylates: syntheses, topologies and photoluminescence","CrystEngComm","2014","16","48","11078","","10.1039/C4CE01959H","","","0.71073","MoKα","","0.0562","0.0407","","","0.121","0.1431","","","","","","1.034","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218570","12.994","","16.0641","0.0001","17.3404","0.0004","114.882","0.006","98.214","0.01","102.015","0.008","3101.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C108 H60 Cd9 N42 O30 -","- C108 H60 Cd9 N42 O30 -","- C108 H60 Cd9 N42 O30 -","1","0.5","","Pan, Jie; Jiang, Fei-Long; Wu, Ming-Yan; Chen, Lian; Qian, Jin-Jie; Su, Kong-Zhao; Wan, Xiu-Yan; Hong, Mao-Chun","Five novel Zn(ii)/Cd(ii) coordination polymers based on bis(pyrazinyl)-triazole and varied polycarboxylates: syntheses, topologies and photoluminescence","CrystEngComm","2014","16","48","11078","","10.1039/C4CE01959H","","","0.71073","MoKα","","0.0312","0.027","","","0.0827","0.0926","","","","","","1.039","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218571","9.852","0.003","10.626","0.003","14.145","0.005","82.691","0.008","88.688","0.011","72.313","0.008","1399.1","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H9 N7 O19 Zn2 -","- C22 H9 N7 O19 Zn2 -","- C44 H18 N14 O38 Zn4 -","2","1","","Pan, Jie; Jiang, Fei-Long; Wu, Ming-Yan; Chen, Lian; Qian, Jin-Jie; Su, Kong-Zhao; Wan, Xiu-Yan; Hong, Mao-Chun","Five novel Zn(ii)/Cd(ii) coordination polymers based on bis(pyrazinyl)-triazole and varied polycarboxylates: syntheses, topologies and photoluminescence","CrystEngComm","2014","16","48","11078","","10.1039/C4CE01959H","","","0.71073","MoKα","","0.0368","0.0344","","","0.1002","0.1063","","","","","","1.072","","","","has coordinates","180516","2020-10-21","18:00:00",""
"7218656","10.6688","0.0003","11.4952","0.0003","12.9734","0.0003","90","","106.722","0.001","90","","1523.78","0.07","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Cu N4 O -","- C14 H15 Cu N4 O -","- C56 H60 Cu4 N16 O4 -","4","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.0458","0.0327","","","0.0843","0.0913","","","","","","1.035","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218657","9.4249","0.0002","14.2699","0.0004","11.4988","0.0003","90","","100.705","0.001","90","","1519.59","0.07","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Cu N5 O -","- C14 H16 Cu N5 O -","- C56 H64 Cu4 N20 O4 -","4","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.0404","0.0341","","","0.0973","0.1021","","","","","","1.077","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218658","10.5252","0.0002","11.1791","0.0002","13.0198","0.0002","90","","106.232","0.001","90","","1470.87","0.05","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Cu N4 O -","- C15 H17 Cu N4 O -","- C60 H68 Cu4 N16 O4 -","4","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.0339","0.0281","","","0.0723","0.0757","","","","","","1.054","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218659","20.8634","0.0007","21.3369","0.0008","22.7994","0.0008","90","","98.646","0.002","90","","10034","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H44 Cu4 N16 O2 -","- C46 H36 Cu4 N16 O2 -","- C368 H288 Cu32 N128 O16 -","8","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.1056","0.0595","","","0.1588","0.1776","","","","","","1.031","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218660","20.8705","0.0003","21.3742","0.0003","22.7059","0.0003","90","","99.182","0.001","90","","9999.1","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H48 Cu4 N16 O2 -","- C48 H42 Cu4 N16 O2 -","- C384 H336 Cu32 N128 O16 -","8","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.0641","0.0414","","","0.1065","0.1176","","","","","","1.039","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218661","21.0123","0.0005","21.4061","0.0005","22.6642","0.0005","90","","99.495","0.001","90","","10054.5","0.4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H52 Cu4 N16 O2 -","- C52 H48 Cu4 N16 O2 -","- C416 H384 Cu32 N128 O16 -","8","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.0904","0.0578","","","0.1527","0.1706","","","","","","1.073","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218662","16.2527","0.0009","12.3588","0.0008","17.4471","0.001","90","","114.657","0.003","90","","3185","0.3","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 B Cu3 F4 N8 O3 -","- C24 H18 B Cu3 F4 N8 O3 -","- C96 H72 B4 Cu12 F16 N32 O12 -","4","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.1028","0.0629","","","0.1825","0.209","","","","","","1.044","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218663","16.2717","0.0002","12.6684","0.0002","17.6021","0.0002","90","","112.523","0.001","90","","3351.68","0.08","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Cl Cu3 N8 O5 -","- C24 H18 Cl Cu3 N8 O5 -","- C96 H72 Cl4 Cu12 N32 O20 -","4","1","","Hsu, Wayne; Chen, Kuan-Ting; Li, Yu-Sian; Cheng, Po-Wen; Chen, Tsun-Ren; Chen, Jhy-Der","Crystal-to-crystal transformations and photoluminescence changes in the Cu(i) coordination networks based on a formamidinate ligand","CrystEngComm","2014","16","46","10640","","10.1039/C4CE01791A","","","0.71073","MoKα","","0.0641","0.0457","","","0.1423","0.1562","","","","","","1.05","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218664","27.319","0.003","8.7331","0.0007","55.699","0.008","90","","95.685","0.009","90","","13223","3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Hexamethylenetetramine 5,10,15,20-tetra(perfluoro-4'-iodophenyl)porphyrin","","- C50 H22 F16 I4 N8 -","- C50 H22 F16 I4 N8 -","- C400 H176 F128 I32 N64 -","8","2","","Syssa-Magalé, Jean-Laurent; Boubekeur, Kamal; Leroy, Jacques; Chamoreau, Lise-Marie; Fave, Claire; Schöllhorn, Bernd","Directed synthesis of a halogen-bonded open porphyrin network","CrystEngComm","2014","16","45","10380","","10.1039/C4CE01704H","","","0.71073","MoKα","","0.1201","0.0565","","","0.0818","0.1058","","","","","","0.992","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218665","5.8849","0.0013","24.903","0.003","6.2247","0.0008","90","","98.864","0.011","90","","901.3","0.3","250","2","250","2","","","","","","","","5","P 1 m 1","P -2y","6","","Hexamethylenetetramine 1,3,5-Trifluoro-2,4,6-tri-iodobenzene","","- C12 H12 F3 I3 N4 -","- C12 H12 F3 I3 N4 -","- C24 H24 F6 I6 N8 -","2","1","","Syssa-Magalé, Jean-Laurent; Boubekeur, Kamal; Leroy, Jacques; Chamoreau, Lise-Marie; Fave, Claire; Schöllhorn, Bernd","Directed synthesis of a halogen-bonded open porphyrin network","CrystEngComm","2014","16","45","10380","","10.1039/C4CE01704H","","","0.71073","MoKα","","0.0337","0.0292","","","0.0683","0.0699","","","","","","1.043","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218666","6.2751","0.0003","23.2198","0.0011","11.8609","0.0006","90","","103.297","0.005","90","","1681.88","0.15","250","2","250","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4-Diazabicyclo(2.2.2)octane 1,3,5-Trifluoro-2,4,6-tri-iodobenzene","","- C12 H12 F3 I3 N2 -","- C12 H12 F3 I3 N2 -","- C48 H48 F12 I12 N8 -","4","1","","Syssa-Magalé, Jean-Laurent; Boubekeur, Kamal; Leroy, Jacques; Chamoreau, Lise-Marie; Fave, Claire; Schöllhorn, Bernd","Directed synthesis of a halogen-bonded open porphyrin network","CrystEngComm","2014","16","45","10380","","10.1039/C4CE01704H","","","0.71073","MoKα","","0.0576","0.0342","","","0.0784","0.0972","","","","","","1.089","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218667","4.114","0.0008","9.071","0.0009","24.104","0.005","90","","91.621","0.019","90","","899.2","0.3","250","2","250","2","","","","","","","","5","P 1 n 1","P -2yac","7","","1,3,5-Trifluoro-2,4,6-tri-iodobenzene 4,4'-bipyridine","","- C16 H8 F3 I3 N2 -","- C16 H8 F3 I3 N2 -","- C32 H16 F6 I6 N4 -","2","1","","Syssa-Magalé, Jean-Laurent; Boubekeur, Kamal; Leroy, Jacques; Chamoreau, Lise-Marie; Fave, Claire; Schöllhorn, Bernd","Directed synthesis of a halogen-bonded open porphyrin network","CrystEngComm","2014","16","45","10380","","10.1039/C4CE01704H","","","0.71073","MoKα","","0.0725","0.0566","","","0.1403","0.1488","","","","","","1.07","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7218668","6.8359","0.0004","10.9401","0.0006","11.4732","0.0007","107.204","0.005","92.82","0.006","105.33","0.004","782.88","0.09","250","2","250","2","","","","","","","","5","P -1","-P 1","2","","1,4-Diazabicyclo(2.2.2)octane tetrafluoro-1,4-diiodobenzene","","- C12 H12 F4 I2 N2 -","- C12 H12 F4 I2 N2 -","- C24 H24 F8 I4 N4 -","2","1","","Syssa-Magalé, Jean-Laurent; Boubekeur, Kamal; Leroy, Jacques; Chamoreau, Lise-Marie; Fave, Claire; Schöllhorn, Bernd","Directed synthesis of a halogen-bonded open porphyrin network","CrystEngComm","2014","16","45","10380","","10.1039/C4CE01704H","","","0.71073","MoKα","","0.068","0.0337","","","0.0667","0.0756","","","","","","0.99","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7218669","14.6834","0.0014","14.9015","0.0014","20.0367","0.0018","90","","107.315","0.001","90","","4185.4","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C67 H90 Ag15 F6 N3 O4 -","- C67 H90 Ag15 F6 N3 O4 -","- C134 H180 Ag30 F12 N6 O8 -","2","0.5","","Zhou, Kun; Qin, Chao; Wang, Xin-Long; Yan, Li-Kai; Shao, Kui-Zhan; Su, Zhong-Min","Ag(i)-mediated formation of a 2D cyano-bridged multinuclear silver(i) alkynyl network coupled with the C‒C bond cleavage of acetonitrile","CrystEngComm","2014","16","45","10376","","10.1039/C4CE01707B","","","0.71073","MoKα","","0.0991","0.0553","","","0.1356","0.1572","","","","","","1.028","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218670","9.733","0.004","9.733","0.004","74.51","0.02","90","","90","","90","","7058","5","333","2","333","2","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(ethylenedithio)tetrathiafulvalenium_tetrabromomanganate(II)_dichlorobenzene_(4/1/1)","","","- C46 H36 Br4 Cl2 Mn S32 -","- C46 H36 Br4 Cl2 Mn S32 -","- C184 H144 Br16 Cl8 Mn4 S128 -","4","0.25","","Zhilyaeva, Elena I.; Shilov, Gennadii V.; Torunova, Svetlana A.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergey I.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transitions in θ-(ET)4MnBr4(C6H6−nCln) (n = 1, 2) driven by ordering in anion and/or cation layers","CrystEngComm","2014","16","43","10103","","10.1039/C4CE01440E","","","0.71073","MoKα","","0.2577","0.0474","","","0.0767","0.0875","","","","","","0.935","","","","has coordinates,has disorder","288536","2023-12-24","00:28:32",""
"7218671","9.401","0.004","9.981","0.004","74.39","0.04","91.03","0.04","89.57","0.04","89.71","0.04","6979","6","260","2","260","2","","","","","","","","6","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","bis(ethylenedithio)tetrathiafulvalenium_tetrabromomanganate(II)_dichlorobenzene_(4/1/1)","","","- C46 H36 Br4 Cl2 Mn S32 -","- C46 H36 Br4 Cl2 Mn S32 -","- C184 H144 Br16 Cl8 Mn4 S128 -","4","","","Zhilyaeva, Elena I.; Shilov, Gennadii V.; Torunova, Svetlana A.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergey I.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transitions in θ-(ET)4MnBr4(C6H6−nCln) (n = 1, 2) driven by ordering in anion and/or cation layers","CrystEngComm","2014","16","43","10103","","10.1039/C4CE01440E","","","0.71073","MoKα","","0.2171","0.0523","","","0.0871","0.0992","","","","","","0.995","","","","has coordinates","288536","2023-12-24","00:28:33",""
"7218672","9.6621","0.0002","9.6621","0.0002","74.3763","0.0015","90","","90","","90","","6943.5","0.2","260","2","260","2","","","","","","","","6","I 41/a :2","-I 4ad","88","bis(ethylenedithio)tetrathiafulvalenium_tetrabromomanganate(II)_chlorobenzene_(4/1/1)","","","- C46 H37 Br4 Cl Mn S32 -","- C46 H37 Br4 Cl Mn S32 -","- C184 H148 Br16 Cl4 Mn4 S128 -","4","0.25","","Zhilyaeva, Elena I.; Shilov, Gennadii V.; Torunova, Svetlana A.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergey I.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transitions in θ-(ET)4MnBr4(C6H6−nCln) (n = 1, 2) driven by ordering in anion and/or cation layers","CrystEngComm","2014","16","43","10103","","10.1039/C4CE01440E","","","0.71073","MoKα","","0.0769","0.0497","","","0.1294","0.1581","","","","","","0.925","","","","has coordinates,has disorder","288536","2023-12-24","00:28:33",""
"7218673","9.5178","0.0009","74.375","0.005","9.7697","0.0011","90","","90.326","0.01","90","","6915.7","1.1","220","2","220","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","bis(ethylenedithio)tetrathiafulvalenium_tetrabromomanganate (II)_chlorobenzene_(4/1/1)","","","- C46 H37 Br4 Cl Mn S32 -","- C46 H37 Br4 Cl Mn S32 -","- C184 H148 Br16 Cl4 Mn4 S128 -","4","0.5","","Zhilyaeva, Elena I.; Shilov, Gennadii V.; Torunova, Svetlana A.; Flakina, Alexandra M.; Lyubovskii, Rustem B.; Pesotskii, Sergey I.; Aldoshin, Sergey M.; Lyubovskaya, Rimma N.","Phase transitions in θ-(ET)4MnBr4(C6H6−nCln) (n = 1, 2) driven by ordering in anion and/or cation layers","CrystEngComm","2014","16","43","10103","","10.1039/C4CE01440E","","","0.71073","MoKα","","0.1534","0.1108","","","0.276","0.3274","","","","","","1.043","","","","has coordinates,has disorder","288536","2023-12-24","00:28:33",""
"7218680","9.4847","0.0002","16.2433","0.0003","16.9867","0.0003","97.456","0.001","101.802","0.002","102.069","0.002","2464.05","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H37.33 Cl5 Co N6 O3.67 -","- C14 H37.33 Cl5 Co N6 O3.665 -","- C56 H149.32 Cl20 Co4 N24 O14.66 -","4","2","","Ling, Irene; Sobolev, Alexandre N.; Hashim, Rauzah; Harrowfield, Jack M.","Stereochemistry of cage amine complexes ‒ probing the ligand conformational flexibility with hydrogen bonds","CrystEngComm","2014","16","48","11058","","10.1039/C4CE01980F","","","0.71073","MoKα","","0.0337","0.0286","","","0.0727","0.0755","","","","","","1.004","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218681","9.7649","0.0004","27.6067","0.0008","9.5645","0.0004","90","","117.183","0.005","90","","2293.59","0.18","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H70 Br Cl9 Co2 N12 O5 -","- C28 H70 Br Cl9 Co2 N12 O5 -","- C56 H140 Br2 Cl18 Co4 N24 O10 -","2","0.5","","Ling, Irene; Sobolev, Alexandre N.; Hashim, Rauzah; Harrowfield, Jack M.","Stereochemistry of cage amine complexes ‒ probing the ligand conformational flexibility with hydrogen bonds","CrystEngComm","2014","16","48","11058","","10.1039/C4CE01980F","","","0.71073","MoKα","","0.0873","0.0543","","","0.1532","0.1622","","","","","","1.019","","","","has coordinates,has disorder","180517","2020-10-21","18:00:00",""
"7218682","8.9691","0.0001","15.3233","0.0002","16.3516","0.0002","90","","90","","90","","2247.3","0.05","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H35 Cl3 Co N7 O5 -","- C14 H35 Cl3 Co N7 O5 -","- C56 H140 Cl12 Co4 N28 O20 -","4","1","","Ling, Irene; Sobolev, Alexandre N.; Hashim, Rauzah; Harrowfield, Jack M.","Stereochemistry of cage amine complexes ‒ probing the ligand conformational flexibility with hydrogen bonds","CrystEngComm","2014","16","48","11058","","10.1039/C4CE01980F","","","0.71073","MoKα","","0.0345","0.0326","","","0.0872","0.0884","","","","","","1.005","","","","has coordinates","180517","2020-10-21","18:00:00",""
"7235394","8.152","0.002","20.538","0.005","12.736","0.003","90","","93.44","0.02","90","","2128.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H46 Cu3 N10 O20 -","- C34 H46 Cu3 N10 O20 -","- C68 H92 Cu6 N20 O40 -","2","0.5","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Bauzá, Antonio; Zarghami, Sara; Ballester, Pablo; Mague, Joel T.; Frontera, Antonio","On the importance of non covalent interactions in the structure of coordination Cu(ii) and Co(ii) complexes of pyrazine- and pyridine-dicarboxylic acid derivatives: experimental and theoretical views","CrystEngComm","2014","16","27","6149","","10.1039/C4CE00003J","","","0.71073","MoKα","","0.0594","0.0351","","","0.0903","0.1002","","","","","","1.019","","","","has coordinates","232757","2020-10-21","18:00:00",""
"7235395","11.986","0.002","7.6602","0.0014","15.75","0.003","90","","94.123","0.003","90","","1442.3","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Cu N4 O7 -","- C12 H14 Cu N4 O7 -","- C48 H56 Cu4 N16 O28 -","4","1","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Bauzá, Antonio; Zarghami, Sara; Ballester, Pablo; Mague, Joel T.; Frontera, Antonio","On the importance of non covalent interactions in the structure of coordination Cu(ii) and Co(ii) complexes of pyrazine- and pyridine-dicarboxylic acid derivatives: experimental and theoretical views","CrystEngComm","2014","16","27","6149","","10.1039/C4CE00003J","","","0.71073","MoKα","","0.0352","0.0305","","","0.081","0.0847","","","","","","1.047","","","","has coordinates","232757","2020-10-21","18:00:00",""
"7235396","12.5445","0.0004","7.3874","0.0003","11.8763","0.0006","90","","111.118","0.001","90","","1026.68","0.07","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H10 Co N2 O8 -","- C6 H10 Co N2 O8 -","- C24 H40 Co4 N8 O32 -","4","0.5","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Bauzá, Antonio; Zarghami, Sara; Ballester, Pablo; Mague, Joel T.; Frontera, Antonio","On the importance of non covalent interactions in the structure of coordination Cu(ii) and Co(ii) complexes of pyrazine- and pyridine-dicarboxylic acid derivatives: experimental and theoretical views","CrystEngComm","2014","16","27","6149","","10.1039/C4CE00003J","","","1.54178","Cu","","0.0201","0.0198","","","0.0548","0.0551","","","","","","1.091","","","","has coordinates","232757","2020-10-21","18:00:00",""
"7235397","8.3425","0.0005","27.164","0.0017","9.5946","0.0006","90","","98.111","0.002","90","","2152.5","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 Cu2 N2 O15 -","- C14 H20 Cu2 N2 O15 -","- C56 H80 Cu8 N8 O60 -","4","1","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Bauzá, Antonio; Zarghami, Sara; Ballester, Pablo; Mague, Joel T.; Frontera, Antonio","On the importance of non covalent interactions in the structure of coordination Cu(ii) and Co(ii) complexes of pyrazine- and pyridine-dicarboxylic acid derivatives: experimental and theoretical views","CrystEngComm","2014","16","27","6149","","10.1039/C4CE00003J","","","0.71073","MoKα","","0.0426","0.04","","","0.1237","0.1253","","","","","","1.171","","","","has coordinates","232757","2020-10-21","18:00:00",""
"7235398","13.1423","0.0003","8.5766","0.0002","15.1489","0.0003","90","","101.323","0.001","90","","1674.29","0.06","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H13 Cd N2 O5 -","- C21 H13 Cd N2 O5 -","- C84 H52 Cd4 N8 O20 -","4","1","","Zhang, Xiao-jing; Li, Jian-qiang; Liu, Shu-juan; Luo, Ming-biao; Xu, Wen-yuan; Luo, Feng","An unprecedented (4,8)-connected net featuring gsp2 topology and containing an exceptional coordination mode of acylamide ligand","CrystEngComm","2014","16","24","5216","","10.1039/c4ce00146j","","","0.71073","MoKα","","0.0277","0.0247","","","0.0646","0.0671","","","","","","1.102","","","","has coordinates","232759","2020-10-21","18:00:00",""
"7235399","8.6936","0.0008","11.192","0.0011","16.621","0.0016","92.087","0.001","105.046","0.001","95.751","0.001","1550.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Cr N5 O17 -","- C26 H28 Cr N5 O17 -","- C52 H56 Cr2 N10 O34 -","2","1","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Karrabi, Zahra; Molčanov, Krešimir; Eydizadeh, Ehsan; Mague, Joel T.; Bauzá, Antonio; Frontera, Antonio","Crystal engineering with coordination compounds of NiII, CoII, and CrIII bearing dipicolinic acid driven by the nature of the noncovalent interactions","CrystEngComm","2014","16","24","5352","","10.1039/c4ce00325j","","","0.71073","MoKα","","0.0401","0.0371","","","0.0978","0.1008","","","","","","1.063","","","","has coordinates,has disorder","232761","2020-10-21","18:00:00",""
"7235400","13.402","0.0002","10.0271","0.0001","19.8799","0.0003","90","","108.994","0.002","90","","2526.07","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H20 Cr N3 O10 -","- C27 H20 Cr N3 O10 -","- C108 H80 Cr4 N12 O40 -","4","1","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Karrabi, Zahra; Molčanov, Krešimir; Eydizadeh, Ehsan; Mague, Joel T.; Bauzá, Antonio; Frontera, Antonio","Crystal engineering with coordination compounds of NiII, CoII, and CrIII bearing dipicolinic acid driven by the nature of the noncovalent interactions","CrystEngComm","2014","16","24","5352","","10.1039/c4ce00325j","","x-ray","1.54179","CuKα","","","0.0382","","","","0.1217","","","","","","1.103","","","","has coordinates","232761","2020-10-21","18:00:00",""
"7235401","35.1399","0.0009","9.6985","0.0002","18.5587","0.0005","90","","119.555","0.003","90","","5501.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H47 Cr2 N8 O22.55 -","- C54 H47 Cr2 N8 O22.55 -","- C216 H188 Cr8 N32 O90.2 -","4","0.5","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Karrabi, Zahra; Molčanov, Krešimir; Eydizadeh, Ehsan; Mague, Joel T.; Bauzá, Antonio; Frontera, Antonio","Crystal engineering with coordination compounds of NiII, CoII, and CrIII bearing dipicolinic acid driven by the nature of the noncovalent interactions","CrystEngComm","2014","16","24","5352","","10.1039/c4ce00325j","","x-ray","1.54184","CuKα","","","0.0365","","","","0.108","","","","","","1.06","","","","has coordinates","232761","2020-10-21","18:00:00",""
"7235402","13.676","0.003","10.0513","0.0019","13.785","0.003","90","","115.251","0.013","90","","1713.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 N2 Ni O11 -","- C14 H14 N2 Ni O11 -","- C56 H56 N8 Ni4 O44 -","4","1","","Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Karrabi, Zahra; Molčanov, Krešimir; Eydizadeh, Ehsan; Mague, Joel T.; Bauzá, Antonio; Frontera, Antonio","Crystal engineering with coordination compounds of NiII, CoII, and CrIII bearing dipicolinic acid driven by the nature of the noncovalent interactions","CrystEngComm","2014","16","24","5352","","10.1039/c4ce00325j","","","0.71073","MoKα","","0.0516","0.0384","","","0.0962","0.1028","","","","","","1.045","","","","has coordinates","232761","2020-10-21","18:00:00",""
"7235403","12.328","0.005","16.545","0.007","12.821","0.005","90","","109.19","0.005","90","","2469.7","1.7","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C50 H70 N4 O20 S -","- C50 H70 N4 O20 S -","- C100 H140 N8 O40 S2 -","2","0.5","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.7749","synchrotron","","0.085","0.0668","","","0.2","0.2194","","","","","","1.068","","","","has coordinates,has disorder","232764","2020-10-21","18:00:00",""
"7235404","12.72","0.003","39.701","0.01","16.861","0.004","90","","95.212","0.004","90","","8480","4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","c2phemimetso4","","","- C84 H110 N6 O27 S3 -","- C84 H104 N6 O27 S3 -","- C336 H416 N24 O108 S12 -","4","1","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.71073","MoKα","","0.1209","0.0728","","","0.1867","0.2195","","","","","","1.043","","","","has coordinates,has disorder","232764","2020-10-21","18:00:00",""
"7235405","9.9102","0.0015","14.121","0.002","14.877","0.002","91.328","0.002","96.132","0.002","96.436","0.002","2055.7","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","2DFMJ12","","","- C42 H53 N3 O17 S -","- C42 H51 N3 O17 S -","- C84 H102 N6 O34 S2 -","2","1","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.7749","synchrotron","","0.0936","0.0575","","","0.14","0.1598","","","","","","1.008","","","","has coordinates,has disorder","232764","2020-10-21","18:00:00",""
"7235406","19.3218","0.0016","14.7252","0.0012","32.896","0.003","90","","104.855","0.002","90","","9046.7","1.3","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","3DFMJ12","","","- C87 H122 N4 O36 S -","- C87 H108 N4 O36 S -","- C348 H432 N16 O144 S4 -","4","1","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.7749","synchrotron","","0.0962","0.0766","","","0.2043","0.2276","","","","","","1.022","","","","has coordinates,has disorder","232764","2020-10-21","18:00:00",""
"7235407","10.059","0.0019","14.556","0.003","15.558","0.003","92.816","0.002","93.863","0.002","96.287","0.002","2255.5","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","C2emimMeCN","","","- C46 H61 N3 O17 S -","- C46 H59 N3 O17 S -","- C92 H118 N6 O34 S2 -","2","1","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.71073","MoKα","","0.084","0.0499","","","0.1268","0.1502","","","","","","1.013","","","","has coordinates,has disorder","232764","2020-10-21","18:00:00",""
"7235408","21.075","0.009","12.796","0.006","18.229","0.008","90","","96.533","0.006","90","","4884","4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","pgc4emimace","","","- C50 H72 N2 O18 S -","- C50 H72 N2 O18 S -","- C200 H288 N8 O72 S4 -","4","1","","Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Beavers, Christine M.; Baker, Gary A.; Atwood, Jerry L.","Illuminating host‒guest cocrystallization between pyrogallol[4]arenes and the ionic liquid 1-ethyl-3-methylimidazolium ethylsulfate","CrystEngComm","2014","16","27","6010","","10.1039/C4CE00359D","","","0.71073","MoKα","","0.2169","0.0934","","","0.2099","0.2636","","","","","","1.024","","","","has coordinates","232764","2020-10-21","18:00:00",""
"7235410","11.532","0.002","13.619","0.003","11.371","0.002","90","","95.74","0.03","90","","1776.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N4 O2 -","- C20 H18 N4 O2 -","- C80 H72 N16 O8 -","4","1","","Chen, Shuo; Fan, Rui-Qing; Wang, Xin-Ming; Yang, Yu-Lin","Novel bright blue emissions IIB group complexes constructed with various polyhedron-induced 2-[2′-(6-methoxy-pyridyl)]-benzimidazole derivatives","CrystEngComm","2014","16","27","6114","","10.1039/c4ce00382a","","","0.71073","MoKα","","0.0739","0.0435","","","0.1106","0.1229","","","","","","1.034","","","","has coordinates","232767","2020-10-21","18:00:00",""
"7235411","15.01","0.003","9.2532","0.0019","16.741","0.003","90","","113.64","0.03","90","","2130","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cl2 N4 O2 Zn -","- C20 H18 Cl2 N4 O2 Zn -","- C80 H72 Cl8 N16 O8 Zn4 -","4","1","","Chen, Shuo; Fan, Rui-Qing; Wang, Xin-Ming; Yang, Yu-Lin","Novel bright blue emissions IIB group complexes constructed with various polyhedron-induced 2-[2′-(6-methoxy-pyridyl)]-benzimidazole derivatives","CrystEngComm","2014","16","27","6114","","10.1039/c4ce00382a","","","0.71073","MoKα","","0.0649","0.0411","","","0.0839","0.0929","","","","","","1.07","","","","has coordinates","232767","2020-10-21","18:00:00",""
"7235412","10.023","0.002","14.669","0.003","14.429","0.003","90","","96.56","0.03","90","","2107.6","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Cd4","","","- C20 H18 Cd Cl2 N4 O2 -","- C20 H18 Cd Cl2 N4 O2 -","- C80 H72 Cd4 Cl8 N16 O8 -","4","1","","Chen, Shuo; Fan, Rui-Qing; Wang, Xin-Ming; Yang, Yu-Lin","Novel bright blue emissions IIB group complexes constructed with various polyhedron-induced 2-[2′-(6-methoxy-pyridyl)]-benzimidazole derivatives","CrystEngComm","2014","16","27","6114","","10.1039/c4ce00382a","","","0.71073","MoKα","","0.035","0.0291","","","0.0834","0.0866","","","","","","1.153","","","","has coordinates","232767","2020-10-21","18:00:00",""
"7235413","11.0477","0.0002","18.3261","0.0005","19.7231","0.0005","90","","91.198","0.002","90","","3992.29","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 Cd N10 O11 -","- C40 H38 Cd N10 O11 -","- C160 H152 Cd4 N40 O44 -","4","1","","Chen, Shuo; Fan, Rui-Qing; Wang, Xin-Ming; Yang, Yu-Lin","Novel bright blue emissions IIB group complexes constructed with various polyhedron-induced 2-[2′-(6-methoxy-pyridyl)]-benzimidazole derivatives","CrystEngComm","2014","16","27","6114","","10.1039/c4ce00382a","","","0.71073","MoKα","","0.065","0.0414","","","0.0939","0.1103","","","","","","1.028","","","","has coordinates","232767","2020-10-21","18:00:00",""
"7235414","7.9949","0.0016","11.283","0.002","11.996","0.002","97.51","0.03","103.89","0.03","102.5","0.03","1006.3","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H18 Cl2 Hg N4 O2 -","- C20 H18 Cl2 Hg N4 O2 -","- C40 H36 Cl4 Hg2 N8 O4 -","2","1","","Chen, Shuo; Fan, Rui-Qing; Wang, Xin-Ming; Yang, Yu-Lin","Novel bright blue emissions IIB group complexes constructed with various polyhedron-induced 2-[2′-(6-methoxy-pyridyl)]-benzimidazole derivatives","CrystEngComm","2014","16","27","6114","","10.1039/c4ce00382a","","","0.71073","MoKα","","0.0387","0.0337","","","0.0894","0.0963","","","","","","0.879","","","","has coordinates","232767","2020-10-21","18:00:00",""
"7235415","7.346","0.0015","9.4","0.0019","10.7","0.002","101.75","0.03","90.16","0.03","92.82","0.03","722.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H9 Cl2 N3 O Zn -","- C13 H11 Cl2 N3 O Zn -","- C26 H22 Cl4 N6 O2 Zn2 -","2","1","","Chen, Shuo; Fan, Rui-Qing; Wang, Xin-Ming; Yang, Yu-Lin","Novel bright blue emissions IIB group complexes constructed with various polyhedron-induced 2-[2′-(6-methoxy-pyridyl)]-benzimidazole derivatives","CrystEngComm","2014","16","27","6114","","10.1039/c4ce00382a","","","0.71073","MoKα","","0.1369","0.0785","","","0.2118","0.3374","","","","","","0.986","","","","has coordinates","232767","2020-10-21","18:00:00",""
"7235416","7.9745","0.0018","16.072","0.004","10.223","0.003","90","","110.051","0.007","90","","1230.8","0.6","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,4'-bis(9-carbazolyl)biphenyl","","- C36 H24 N2 -","- C36 H24 N2 -","- C72 H48 N4 -","2","0.5","","Gleason, Cody J.; Cox, Jordan M.; Walton, Ian M.; Benedict, Jason B.","Polymorphism and the influence of crystal structure on the luminescence of the opto-electronic material 4,4′-bis(9-carbazolyl)biphenyl","CrystEngComm","2014","16","33","7621","","10.1039/C4CE01056F","","x-ray","0.71073","MoKα","","0.0866","0.0496","","","0.1147","0.1268","","","","","","1.046","","","","has coordinates","232769","2020-10-21","18:00:00",""
"7235417","26.9518","0.0017","12.3277","0.0008","15.2781","0.001","90","","90","","90","","5076.2","0.6","90","","90","","","","","","","","","3","A e a 2","A 2 -2ab","41","","4,4'‒bis(9-carbazolyl)biphenyl","","- C36 H24 N2 -","- C36 H24 N2 -","- C288 H192 N16 -","8","1","","Gleason, Cody J.; Cox, Jordan M.; Walton, Ian M.; Benedict, Jason B.","Polymorphism and the influence of crystal structure on the luminescence of the opto-electronic material 4,4′-bis(9-carbazolyl)biphenyl","CrystEngComm","2014","16","33","7621","","10.1039/C4CE01056F","","x-ray","0.71073","MoKα","","0.0372","0.0318","","","0.0714","0.0737","","","","","","1.07","","","","has coordinates","232769","2020-10-21","18:00:00",""
"7235418","18.0076","0.001","7.3919","0.0004","36.337","0.002","90","","90","","90","","4836.8","0.5","90","","90","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","4,4'-bis(9-carbazolyl)biphenyl","","- C36 H24 N2 -","- C36 H24 N2 -","- C288 H192 N16 -","8","1","","Gleason, Cody J.; Cox, Jordan M.; Walton, Ian M.; Benedict, Jason B.","Polymorphism and the influence of crystal structure on the luminescence of the opto-electronic material 4,4′-bis(9-carbazolyl)biphenyl","CrystEngComm","2014","16","33","7621","","10.1039/C4CE01056F","","x-ray","0.71073","MoKα","","0.066","0.046","","","0.1093","0.1214","","","","","","1.022","","","","has coordinates","232769","2020-10-21","18:00:00",""