# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-20T14:59:45+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 'Cryst. Growth & Design') AND volume = 5 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"4500068","16.8018","0.0008","16.8018","0.0008","7.1674","0.0004","90","","90","","90","","2023.36","0.18","223","2","223","2","","","","","","","Synthesized by the authors. See text","3","I 41/a :2","-I 4ad","88","tetrakis(4-aminophenyl)methane","tetrakis(4-aminophenyl)methane","","- C25 H24 N4 -","- C25 H24 N4 -","- C100 H96 N16 -","4","0.25","","Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines","Cryst. Growth & Design","2005","5","","1451","1456","10.1021/cg049566f","","","1.54178","CuKα","","0.0475","0.0412","","","0.1191","0.1245","","","","","","1.082","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500069","12.7089","0.0001","12.7089","0.0001","8.2149","0.0001","90","","90","","90","","1326.84","0.02","220","2","220","2","","","","","","","Synthesized by the authors. See text","4","I -4","I -4","82","","","","- C29 H32 N4 O4 -","- C29 H32 N4 O4 -","- C58 H64 N8 O8 -","2","0.25","","Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines","Cryst. Growth & Design","2005","5","","1451","1456","10.1021/cg049566f","","","1.54178","CuKα","","0.0321","0.0312","","","0.0849","0.0857","","","","","","1.075","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500070","10.6545","0.0019","14.404","0.003","29.086","0.005","90","","90","","90","","4463.8","1.4","293","2","293","2","","","","","","","Synthesized by the authors. See text","4","P 21 21 21","P 2ac 2ab","19","","","","- C26.5 H25.5 N4.5 O1.5 -","- C26.5 H25.5 N4.5 O1.5 -","- C212 H204 N36 O12 -","8","2","","Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines","Cryst. Growth & Design","2005","5","","1451","1456","10.1021/cg049566f","","","1.54178","CuKα","","0.0879","0.07","","","0.2008","0.2314","","","","","","1.232","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500071","32.927","0.0017","9.33","0.007","21.448","0.003","90","","99.103","0.012","90","","6506","5","290","2","290","2","","","","","","","Synthesized by the authors. See text","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24.667 N4 O0.333 -","- C26 H24 N4 O0.333333 -","- C312 H288 N48 O4 -","12","3","","Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines","Cryst. Growth & Design","2005","5","","1451","1456","10.1021/cg049566f","","","1.54178","CuKα","","0.0898","0.0837","","","0.1889","0.1907","","","","","","1.021","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500072","6.0353","0.0002","24.6349","0.0006","28.1607","0.0007","90","","90","","90","","4186.9","0.2","293","2","293","2","","","","","","","Synthesized by the authors. See text","4","P 21 21 21","P 2ac 2ab","19","","","","- C46 H52 N6 O7 -","- C46 H52 N6 O7 -","- C184 H208 N24 O28 -","4","1","","Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest","Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines","Cryst. Growth & Design","2005","5","","1451","1456","10.1021/cg049566f","","","1.54178","CuKα","","0.0725","0.0495","","","0.1229","0.1408","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500073","12.2162","0.001","21.2975","0.0017","30.884","0.002","93.026","0.003","94.69","0.004","96.419","0.003","7942.5","1","223","2","223","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C134.5 H128 N40 O7.5 S5 -","- C134.5 H128 N40 O7.5 S5 -","- C269 H256 N80 O15 S10 -","2","1","","Eric Demers; Thierry Maris; James D. Wuest","Molecular Tectonics. Porous Hydrogen-Bonded Networks Built from Derivatives of 2,2',7,7'-Tetraphenyl-9,9'-spirobi[9H-fluorene]","Cryst. Growth & Design","2005","5","","1227","1235","10.1021/cg049575o","","","1.54178","CuKα","","0.1295","0.0929","","","0.2332","0.24","","","","","","1.025","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500074","13.458","0.002","17.788","0.002","20.721","0.003","81.076","0.008","74.96","0.008","70.755","0.008","4509.6","1.1","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","P 1","P 1","1","","","","- C150 H178 N40 O17 S14 -","- C144 H88 N40 O13 S11 -","- C144 H88 N40 O13 S11 -","1","1","","Eric Demers; Thierry Maris; James D. Wuest","Molecular Tectonics. Porous Hydrogen-Bonded Networks Built from Derivatives of 2,2',7,7'-Tetraphenyl-9,9'-spirobi[9H-fluorene]","Cryst. Growth & Design","2005","5","","1227","1235","10.1021/cg049575o","","","1.54178","CuKα","","0.104","0.0957","","","0.2236","0.2289","","","","","","1.107","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500075","8.7222","0.0002","10.4838","0.0002","16.7599","0.0004","85.288","0.002","88.006","0.002","70.332","0.002","1438.22","0.06","223","2","223","2","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C31 H24 N4 O11 -","- C31 H24 N4 O11 -","- C62 H48 N8 O22 -","2","1","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.0692","0.0616","","","0.1794","0.1879","","","","","","1.073","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500076","14.006","0.0003","15.852","0.0003","14.318","0.0004","90","","99.78","0.002","90","","3132.73","0.13","293","2","293","2","","","","","","","Synthesized by the authors. See text","4","C 1 2/c 1","-C 2yc","15","","","","- C31 H14 Cl6 N4 -","- C31 H14 Cl6 N4 -","- C124 H56 Cl24 N16 -","4","0.5","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.5418","CuKα","","0.0719","0.069","","","0.1648","0.1665","","","","","","1.019","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500077","16.116","0.0008","16.2973","0.0008","18.7307","0.0009","64.223","0.003","69.471","0.003","89.408","0.003","4089.3","0.4","223","2","223","2","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C102 H64 N8 O18 -","- C102 H64 N8 O18 -","- C204 H128 N16 O36 -","2","1","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.0785","0.0687","","","0.1591","0.1605","","","","","","1.005","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500078","13.3274","0.0006","14.2569","0.0007","14.8016","0.0007","93.161","0.003","98.071","0.003","109.723","0.003","2605.3","0.2","223","2","223","2","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C65 H52 N4 O6 -","- C65 H52 N4 O6 -","- C130 H104 N8 O12 -","2","1","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.0719","0.0567","","","0.1776","0.1884","","","","","","1.102","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500079","12.3873","0.0003","12.3873","0.0003","24.1863","0.0007","90","","90","","90","","3711.27","0.17","223","2","223","2","","","","","","","Synthesized by the authors. See text","4","I 41/a :2","-I 4ad","88","","","","- C49 H28 N4 O8 -","- C49 H28 N4 O8 -","- C196 H112 N16 O32 -","4","0.25","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.044","0.0429","","","0.1096","0.1104","","","","","","1.034","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500080","13.2114","0.0009","13.2114","0.0009","21.539","0.003","90","","90","","90","","3759.4","0.6","223","2","223","2","","","","","","","Synthesized by the authors. See text","3","I 41/a :2","-I 4ad","88","","","","- C53 H28 N4 -","- C53 H28 N4 -","- C212 H112 N16 -","4","0.25","","Eric Demers; Thierry Maris; Janie Cabana; Jean-Hugues Fournier; James D. Wuest","Weakly Bonded Molecular Networks Built from Tetranitro and Tetracyanospirobifluorenes","Cryst. Growth & Design","2005","5","","1237","1245","10.1021/cg049590t","","","1.54178","CuKα","","0.0664","0.0629","","","0.1509","0.1517","","","","","","1.063","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4504834","9.557","0.002","9.922","0.003","10.7","0.003","113.32","0.02","97.01","0.02","89.95","0.02","923.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H32 N O3.5 -","- C18 H27 N O2 -","- C36 H54 N2 O4 -","2","1","","Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi","Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids","Crystal Growth & Design","2005","5","4","1545","","10.1021/cg050020i","","","0.7093","MoKα","","0.1157","0.0864","","","0.2722","0.2997","","","","","","1.156","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504835","8.552","0.0011","8.9702","0.0012","10.2765","0.0014","83.15","0.002","67.768","0.002","70.608","0.002","688.32","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H24 N O2 -","- C14 H24 N O2 -","- C28 H48 N2 O4 -","2","1","","Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi","Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids","Crystal Growth & Design","2005","5","4","1545","","10.1021/cg050020i","","","0.71073","MoKα","","0.0573","0.0494","","","0.1323","0.1388","","","","","","1.041","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504836","15.7571","0.0014","20.4569","0.0018","22.128","0.002","90","","90.719","0.002","90","","7132.2","1.1","293","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C76 H112 N4 O8 -","- C76 H112 N4 O8 -","- C304 H448 N16 O32 -","4","1","","Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi","Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids","Crystal Growth & Design","2005","5","4","1545","","10.1021/cg050020i","","","0.71073","MoKα","","0.0883","0.0538","","","0.1376","0.1557","","","","","","1.028","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504837","10.4672","0.0017","11.4926","0.0019","13.068","0.002","75.368","0.003","75.277","0.003","84.51","0.003","1470.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H52 N2 O4 -","- C32 H52 N2 O4 -","- C64 H104 N4 O8 -","2","1","","Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi","Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids","Crystal Growth & Design","2005","5","4","1545","","10.1021/cg050020i","","","0.71073","MoKα","","0.0533","0.0507","","","0.1392","0.142","","","","","","1.044","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504838","8.9399","0.0007","19.3683","0.0015","20.2739","0.0015","90","","90","","90","","3510.4","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C35 H60 N2 O5 -","- C35 H60 N2 O5 -","- C140 H240 N8 O20 -","4","1","","Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi","Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids","Crystal Growth & Design","2005","5","4","1545","","10.1021/cg050020i","","","0.71073","MoKα","","0.0434","0.0399","","","0.097","0.0991","","","","","","1.042","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504839","9.136","0.003","9.681","0.003","12.462","0.003","105.299","0.004","111.071","0.004","96.687","0.005","964.3","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H29 N O4 -","- C20 H29 N O4 -","- C40 H58 N2 O8 -","2","1","","Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi","Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids","Crystal Growth & Design","2005","5","4","1545","","10.1021/cg050020i","","","0.71073","MoKα","","0.0792","0.0731","","","0.2117","0.2182","","","","","","1.125","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504840","6.7129","0.0008","9.6624","0.0011","13.4553","0.0016","106.402","0.002","97.426","0.002","107.732","0.002","775.01","0.16","303","2","303","2","","","","","","","","6","P -1","-P 1","2","","Bis(N-methylethylenediammonium hydrate)dodecachloro- Tetracadmate(II) dihydrate","","- C3 H16 Cd2 Cl6 N2 O2 -","- C3 H5.5 Cd2 Cl6 N2 O2 -","- C6 H11 Cd4 Cl12 N4 O4 -","2","1","","Thorn, Adrienne; Willett, Roger D.; Twamley, Brendan","Retro-Crystal Engineering Analysis of TwoN-Methylethylenediammonium Cadmium Halide Salts Obtained by Dimensional Reduction and Recombination of the Hexagonal CdX2Lattice","Crystal Growth & Design","2005","5","2","673","","10.1021/cg030059s","","","0.71073","MoKα","","0.0499","0.0307","","","0.072","0.0798","","","","","","1.203","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504841","8.0197","0.0008","10.3911","0.001","13.4772","0.0013","76.223","0.002","81.478","0.002","67.596","0.002","1006.39","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(N-methylethylenediammonium hydrate)octabromide- tricadmate(II) hydrate","","- C3 H13 Br8 Cd3 N2 O1.59 -","- C3 H12 Br8 Cd3 N2 O1.619 -","- C6 H24 Br16 Cd6 N4 O3.238 -","2","1","","Thorn, Adrienne; Willett, Roger D.; Twamley, Brendan","Retro-Crystal Engineering Analysis of TwoN-Methylethylenediammonium Cadmium Halide Salts Obtained by Dimensional Reduction and Recombination of the Hexagonal CdX2Lattice","Crystal Growth & Design","2005","5","2","673","","10.1021/cg030059s","","","0.71073","MoKα","","0.0684","0.037","","","0.0837","0.0961","","","","","","0.941","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504842","10.034","0.004","11.784","0.004","8.386","0.003","90","","90","","90","","991.6","0.6","110","2","110","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-butyl-3-methylimidazolium bromide","","- C8 H15 Br N2 -","- C8 H15 Br N2 -","- C32 H60 Br4 N8 -","4","1","","Golovanov, Denis G.; Lyssenko, Konstantin A.; Antipin, Mikhail Yu.; Vygodskii, Yakov S.; Lozinskaya, Elena I.; Shaplov, Alexander S.","Cocrystal of an Ionic Liquid with Organic Molecules as a Mimic of Ionic Liquid Solution","Crystal Growth & Design","2005","5","1","337","","10.1021/cg030086i","","","0.71073","MoKα","","0.0446","0.033","","","0.0731","0.0757","","","","","","0.976","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504843","8.738","0.004","9.057","0.003","14.888","0.005","90","","95.454","0.012","90","","1172.9","0.8","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H17 Br N2 -","- C9 H17 Br N2 -","- C36 H68 Br4 N8 -","4","1","","Golovanov, Denis G.; Lyssenko, Konstantin A.; Antipin, Mikhail Yu.; Vygodskii, Yakov S.; Lozinskaya, Elena I.; Shaplov, Alexander S.","Cocrystal of an Ionic Liquid with Organic Molecules as a Mimic of Ionic Liquid Solution","Crystal Growth & Design","2005","5","1","337","","10.1021/cg030086i","","","0.71073","MoKα","","0.0761","0.0522","","","0.1204","0.1283","","","","","","1.074","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504844","8.033","0.004","9.962","0.005","14.235","0.007","90","","106.328","0.009","90","","1093.2","0.9","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-di(iso-propyl)imidazolium bromide","","- C9 H17 Br N2 -","- C9 H17 Br N2 -","- C36 H68 Br4 N8 -","4","1","","Golovanov, Denis G.; Lyssenko, Konstantin A.; Antipin, Mikhail Yu.; Vygodskii, Yakov S.; Lozinskaya, Elena I.; Shaplov, Alexander S.","Cocrystal of an Ionic Liquid with Organic Molecules as a Mimic of Ionic Liquid Solution","Crystal Growth & Design","2005","5","1","337","","10.1021/cg030086i","","","0.71073","MoKα","","0.0337","0.0263","","","0.0577","0.0603","","","","","","1.068","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504845","8.956","0.003","15.313","0.005","11.66","0.004","90","","94.62","0.02","90","","1593.9","0.9","293","2","110","2","","","","","","","","4","C 1 c 1","C -2yc","9","","'cocrystal of 1-methyl-3-n-butyl imidazolium bromide with paraphenilendiamine","","- C14 H23 Br N4 -","- C14 H23 Br N4 -","- C56 H92 Br4 N16 -","4","1","","Golovanov, Denis G.; Lyssenko, Konstantin A.; Antipin, Mikhail Yu.; Vygodskii, Yakov S.; Lozinskaya, Elena I.; Shaplov, Alexander S.","Cocrystal of an Ionic Liquid with Organic Molecules as a Mimic of Ionic Liquid Solution","Crystal Growth & Design","2005","5","1","337","","10.1021/cg030086i","","","0.71073","MoKα","","0.0671","0.0487","","","0.0959","0.1","","","","","","1.028","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504846","34.9491","0.0003","17.4843","0.0002","24.7004","0.0003","90","","98.497","0.001","90","","14927.8","0.3","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C150.2 H118.2 Ag4 Cl6.6 F12 O24 P4 -","- C150.2 H118.2 Ag4 Cl6.6 F12 O24 P4 -","- C600.8 H472.8 Ag16 Cl26.4 F48 O96 P16 -","4","0.5","","Eisler, Dana J.; Puddephatt, Richard J.","Self-Assembly of Coordination Polymers from Tetraphosphinitoresorcinarene Complexes of Silver(I)","Crystal Growth & Design","2005","5","1","57","","10.1021/cg034203l","","","0.71073","MoKα","","0.1031","0.0791","","","0.2213","0.2423","","","","","","1.043","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504847","24.2596","0.0001","23.8932","0.0001","26.6121","0.0002","90","","92.363","0.001","90","","15412.3","0.15","200","2","200","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C152 H140 Ag4 Cl4 F12 O31 P4 S4 -","- C152 H140 Ag4 Cl4 F12 O31 P4 S4 -","- C608 H560 Ag16 Cl16 F48 O124 P16 S16 -","4","1","","Eisler, Dana J.; Puddephatt, Richard J.","Self-Assembly of Coordination Polymers from Tetraphosphinitoresorcinarene Complexes of Silver(I)","Crystal Growth & Design","2005","5","1","57","","10.1021/cg034203l","","","0.71073","MoKα","","0.0934","0.069","","","0.1873","0.2091","","","","","","1.017","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504848","15.099","0.004","35.962","0.01","14.662","0.004","90","","102.29","0.005","90","","7779","4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H74 N4 Na O25.5 S8 -","- C72 H65 N4 Na O25.5 S8 -","- C288 H260 N16 Na4 O102 S32 -","4","1","","Liu, Yu; Wang, Hao; Zhang, Heng-Yi; Wang, Li-Hua","Layered Assembly Formed by Benzyl Viologen andp-Sulfonatothiacalix[4]arene and Their Complexation Thermodynamics","Crystal Growth & Design","2005","5","1","231","","10.1021/cg0342157","","","0.71073","MoKα","","0.1602","0.0809","","","0.171","0.2094","","","","","","1.029","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504849","6.7051","0.0001","31.4258","0.0006","10.5128","0.0003","90","","100.936","0.0006","90","","2174.96","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Mn N6 O7 S2 -","- C14 H22 Mn N6 O7 S2 -","- C56 H88 Mn4 N24 O28 S8 -","4","1","","Sun, Hao-Ling; Gao, Song; Ma, Bao-Qing; Su, Gang; Batten, Stuart R.","Structures and Magnetism of a Series Mn(II) Coordination Polymers Containing Pyrazine-Dioxide Derivatives and Different Anions","Crystal Growth & Design","2005","5","1","269","","10.1021/cg034223n","","","0.71073","MoKα","","0.1081","0.0519","","","0.1307","0.1484","","","","","","1.07","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504850","5.6867","0.0011","7.7266","0.0015","7.7669","0.0016","66.61","0.03","85.83","0.03","88.36","0.03","312.4","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H12 Mn N8 O4 -","- C6 H12 Mn N8 O4 -","- C6 H12 Mn N8 O4 -","1","0.5","","Sun, Hao-Ling; Gao, Song; Ma, Bao-Qing; Su, Gang; Batten, Stuart R.","Structures and Magnetism of a Series Mn(II) Coordination Polymers Containing Pyrazine-Dioxide Derivatives and Different Anions","Crystal Growth & Design","2005","5","1","269","","10.1021/cg034223n","","","0.71073","MoKα","","0.0469","0.0388","","","0.0997","0.1033","","","","","","1.367","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504851","6.5035","0.0007","7.287","0.0006","7.5566","0.0008","70.18","0.006","80.994","0.007","86.808","0.008","332.75","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H8 Mn N8 O2 -","- C10 H8 Mn N8 O2 -","- C10 H8 Mn N8 O2 -","1","0.5","","Sun, Hao-Ling; Gao, Song; Ma, Bao-Qing; Su, Gang; Batten, Stuart R.","Structures and Magnetism of a Series Mn(II) Coordination Polymers Containing Pyrazine-Dioxide Derivatives and Different Anions","Crystal Growth & Design","2005","5","1","269","","10.1021/cg034223n","","","0.71073","MoKα","","0.0523","0.0398","","","0.0941","0.0971","","","","","","1.465","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504852","9.3968","0.0008","11.5836","0.0004","13.1449","0.0007","90","","97.382","0.006","90","","1418.95","0.15","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H12 Mn N8 O3 -","- C10 H12 Mn N8 O3 -","- C40 H48 Mn4 N32 O12 -","4","0.5","","Sun, Hao-Ling; Gao, Song; Ma, Bao-Qing; Su, Gang; Batten, Stuart R.","Structures and Magnetism of a Series Mn(II) Coordination Polymers Containing Pyrazine-Dioxide Derivatives and Different Anions","Crystal Growth & Design","2005","5","1","269","","10.1021/cg034223n","","","0.71073","MoKα","","0.0648","0.0369","","","0.089","0.0999","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504853","14.1063","0.0009","7.6324","0.0004","15.6342","0.001","90","","114.183","0.002","90","","1535.54","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Cu O8 -","- C14 H8 Cu O8 -","- C56 H32 Cu4 O32 -","4","1","","Wang, Ruihu; Zhou, Youfu; Sun, Yanqiong; Yuan, Daqiang; Han, Lei; Lou, Benyong; Wu, Benlai; Hong, Maochun","Syntheses and Crystal Structures of Copper(II) Coordination Polymers Comprising Discrete Helical Chains","Crystal Growth & Design","2005","5","1","251","","10.1021/cg034237t","","","0.71073","MoKα","","0.0829","0.0778","","","0.1886","0.1918","","","","","","1.256","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504854","20.194","0.002","9.5131","0.0009","11.4251","0.0012","90","","117.022","0.002","90","","1955.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Cu0.5 N O2 -","- C12 H8 Cu0.5 N O2 -","- C96 H64 Cu4 N8 O16 -","8","1","","Wang, Ruihu; Zhou, Youfu; Sun, Yanqiong; Yuan, Daqiang; Han, Lei; Lou, Benyong; Wu, Benlai; Hong, Maochun","Syntheses and Crystal Structures of Copper(II) Coordination Polymers Comprising Discrete Helical Chains","Crystal Growth & Design","2005","5","1","251","","10.1021/cg034237t","","","0.71073","MoKα","","0.0532","0.0398","","","0.0955","0.105","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504855","22.073","0.002","15.3244","0.0016","16.022","0.0016","90","","125.849","0.002","90","","4392.9","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 Cu N2 O4 -","- C26 H18 Cu N2 O4 -","- C208 H144 Cu8 N16 O32 -","8","1","","Wang, Ruihu; Zhou, Youfu; Sun, Yanqiong; Yuan, Daqiang; Han, Lei; Lou, Benyong; Wu, Benlai; Hong, Maochun","Syntheses and Crystal Structures of Copper(II) Coordination Polymers Comprising Discrete Helical Chains","Crystal Growth & Design","2005","5","1","251","","10.1021/cg034237t","","","0.71073","MoKα","","0.1516","0.0948","","","0.1538","0.1788","","","","","","1.244","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504856","8.2881","0.0019","8.2881","0.0019","10.566","0.003","90","","90","","120","","628.6","0.3","150","2","150","2","","","","","","","'hydrothermal synthesis at 180 deg C for 3 days'","6","P -3","-P 3","147","en-pillared layered zinc hydroxysulphate","","","- C H16 N O13 S Zn4 -","- C0.99 H9.96 N O12.97 S Zn4 -","- C1.98 H19.92 N2 O25.94 S2 Zn8 -","2","0.333333","","Rujiwatra, Apinpus; Mander, Gavin J.; Kepert, Cameron J.; Rosseinsky, Matthew J.","Synthesis and Characterization of Subcell−Supercell Related Ethylenediamine-Pillared Zinc Hydroxysulfates","Crystal Growth & Design","2005","5","1","183","","10.1021/cg034242x","","","0.6941","Synchrotron","","0.0549","0.0463","","","0.1152","0.1188","","","","","","1.08","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504857","21.926","0.002","21.926","0.002","10.5643","0.0009","90","","90","","120","","4398.4","0.7","150","2","150","2","","","","","","","'hydrothermal synthesis at 180 deg C for 3 days'","6","P -3","-P 3","147","","","","- C7 H106 N7 O88 S7 Zn28 -","- C6.99 H69.96 N6.99 O88 S7 Zn28 -","- C13.98 H139.92 N13.98 O176 S14 Zn56 -","2","0.333333","","Rujiwatra, Apinpus; Mander, Gavin J.; Kepert, Cameron J.; Rosseinsky, Matthew J.","Synthesis and Characterization of Subcell−Supercell Related Ethylenediamine-Pillared Zinc Hydroxysulfates","Crystal Growth & Design","2005","5","1","183","","10.1021/cg034242x","","","0.6923","Synchrotron","","0.0957","0.0481","","","0.1369","0.1555","","","","","","0.882","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504858","26.186","0.005","13.52","0.003","19.559","0.004","90","","106.6","0.03","90","","6636","3","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C12 H48 Mo8 N12 Ni3 O48 P V8 -","- C12 H48 Mo8 N12 Ni3 O48 P V8 -","- C48 H192 Mo32 N48 Ni12 O192 P4 V32 -","4","0.5","","Liu, Cai-Ming; Zhang, De-Qing; Zhu, Dao-Ben","3D Supramolecular Array Assembled by Cross-like Arrangement of 1D Sandwich Mixed Molybdenum−Vanadium Polyoxometalate Bridged Coordination Polymer Chains: Hydrothermal Synthesis and Crystal Structure of {[MoVI5MoV3VIV8O40(PO4)][Ni(en)2]}[Ni(en)2]2·4H2O","Crystal Growth & Design","2005","5","4","1639","","10.1021/cg049556e","","","0.71073","MoKα","","0.058","0.0371","","","0.0948","0.0987","","","","","","0.932","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504859","13.7913","0.0013","13.7913","0.0013","11.728","0.002","90","","90","","120","","1931.8","0.4","293","2","293","2","","","","","","","","6","P -3","-P 3","147","","","","- C78 H72 Br2 Li2 O6 P6 -","- C78 H72 Br2 Li2 O6 P6 -","- C78 H72 Br2 Li2 O6 P6 -","1","0.166667","","Liu, Xi; Guo,; Liu, Bin; Chen, Wen-Tong; Huang, Jin-Shun","A Novel 2-D Honeycomb-like Lithium Coordination Polymer Containing 42-Membered Rings","Crystal Growth & Design","2005","5","3","841","","10.1021/cg049570r","","","0.71073","MoKα","","0.0907","0.0554","","","0.1254","0.1413","","","","","","1.003","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504860","9.2133","0.0011","11.6848","0.0013","12.1071","0.0015","104.058","0.009","98.623","0.008","94.9","0.007","1239.9","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","3-[(benzimidazol-1-yl)methyl]benzamide","","- C15 H13 N3 O -","- C15 H13 N3 O -","- C60 H52 N12 O4 -","4","2","","Aakeröy, Christer B.; Desper, John; Urbina, Joaquin F.","Syntheses and Crystal Structures of Versatile Supramolecular Reagents Based upon [(Benzimidazol-1-yl)methyl]-benzamides","Crystal Growth & Design","2005","5","3","1283","","10.1021/cg049579t","","","0.71073","MoKα","","0.0894","0.051","","","0.1208","0.1409","","","","","","0.988","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504861","9.9852","0.0013","15.912","0.002","8.368","0.0013","90","","93.48","0.009","90","","1327.1","0.3","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[(2-methylbenzimidazol-1-yl)methyl]benzamide","","- C16 H15 N3 O -","- C16 H15 N3 O -","- C64 H60 N12 O4 -","4","1","","Aakeröy, Christer B.; Desper, John; Urbina, Joaquin F.","Syntheses and Crystal Structures of Versatile Supramolecular Reagents Based upon [(Benzimidazol-1-yl)methyl]-benzamides","Crystal Growth & Design","2005","5","3","1283","","10.1021/cg049579t","","","0.71073","MoKα","","0.1462","0.0514","","","0.1119","0.148","","","","","","0.895","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504862","8.8067","0.0007","11.8803","0.0012","14.0856","0.0015","74.8","0.004","72.485","0.005","68.786","0.004","1290.5","0.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","3-[(2-chlorobenzimidazol-1-yl)methyl]-benzamide","","- C15 H12 Cl N3 O -","- C15 H12 Cl N3 O -","- C60 H48 Cl4 N12 O4 -","4","2","","Aakeröy, Christer B.; Desper, John; Urbina, Joaquin F.","Syntheses and Crystal Structures of Versatile Supramolecular Reagents Based upon [(Benzimidazol-1-yl)methyl]-benzamides","Crystal Growth & Design","2005","5","3","1283","","10.1021/cg049579t","","","0.71073","MoKα","","0.0653","0.0438","","","0.1209","0.1305","","","","","","1.007","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504863","6.0212","0.001","12.4652","0.0019","19.166","0.003","90","","90","","90","","1438.5","0.4","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-[(2-chlorobenzimidazol-1-yl)methyl]benzamide","","- C15 H14 Cl N3 O2 -","- C15 H14 Cl N3 O2 -","- C60 H56 Cl4 N12 O8 -","4","1","","Aakeröy, Christer B.; Desper, John; Urbina, Joaquin F.","Syntheses and Crystal Structures of Versatile Supramolecular Reagents Based upon [(Benzimidazol-1-yl)methyl]-benzamides","Crystal Growth & Design","2005","5","3","1283","","10.1021/cg049579t","","","0.71073","MoKα","","0.0602","0.0382","","","0.0755","0.0821","","","","","","0.937","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504864","7.5178","0.0009","9.185","0.0011","15.085","0.0015","105.516","0.006","100.6","0.007","100.339","0.008","957.4","0.2","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","3-[(benzimidazol-1-yl)methyl]benzamide, 4-nitrobenzoic acid","","- C22 H18 N4 O5 -","- C22 H18 N4 O5 -","- C44 H36 N8 O10 -","2","1","","Aakeröy, Christer B.; Desper, John; Urbina, Joaquin F.","Syntheses and Crystal Structures of Versatile Supramolecular Reagents Based upon [(Benzimidazol-1-yl)methyl]-benzamides","Crystal Growth & Design","2005","5","3","1283","","10.1021/cg049579t","","","0.71073","MoKα","","0.0794","0.0529","","","0.1338","0.1513","","","","","","0.977","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504865","7.5292","0.0005","11.098","0.0008","17.2512","0.0011","81.865","0.004","77.854","0.003","74.581","0.004","1352.89","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","3-[(2-methylbenzimidazol-1-yl)methyl]PhCOOH,(4-NO2PhCOOH)2","","- C30 H25 N5 O9 -","- C30 H25 N5 O9 -","- C60 H50 N10 O18 -","2","1","","Aakeröy, Christer B.; Desper, John; Urbina, Joaquin F.","Syntheses and Crystal Structures of Versatile Supramolecular Reagents Based upon [(Benzimidazol-1-yl)methyl]-benzamides","Crystal Growth & Design","2005","5","3","1283","","10.1021/cg049579t","","","0.71073","MoKα","","0.1211","0.0491","","","0.1016","0.1269","","","","","","0.837","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504866","11.902","0.004","11.061","0.003","3.9951","0.0013","90","","90.849","0.007","90","","525.9","0.3","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H7 Br2 N -","- C12 H7 Br2 N -","- C24 H14 Br4 N2 -","2","1","","Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A.","Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole","Crystal Growth & Design","2005","5","4","1443","","10.1021/cg049580s","","","0.71069","MoKα","","0.0775","0.0705","","","0.1759","0.1812","","","","","","0.998","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504867","22.6571","0.0003","4.0725","0.0001","12.5717","0.0002","90","","90","","90","","1160","0.04","296","2","296","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C13 H9 Br2 N -","- C13 H9 Br2 N -","- C52 H36 Br8 N4 -","4","1","","Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A.","Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole","Crystal Growth & Design","2005","5","4","1443","","10.1021/cg049580s","","","1.54178","CuKα","","0.0284","0.0279","","","0.0719","0.0724","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504868","7.9369","0.0015","5.8669","0.0009","20.412","0.003","90","","91.607","0.006","90","","950.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C12 H8 Br N -","- C12 H8 Br N -","- C48 H32 Br4 N4 -","4","1","","Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A.","Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole","Crystal Growth & Design","2005","5","4","1443","","10.1021/cg049580s","","","0.71069","MoKα","","0.0695","0.0604","","","0.1541","0.162","","","","","","1.11","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504869","17.661","0.004","8.0855","0.0019","39.543","0.008","90","","90.065","0.008","90","","5647","2","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C35 H37 N3 -","- C35 H37 N3 -","- C280 H296 N24 -","8","1","","Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A.","Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole","Crystal Growth & Design","2005","5","4","1443","","10.1021/cg049580s","","","1.54178","CuKα","","0.1021","0.0898","","","0.2457","0.2556","","","","","","1.043","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504870","9.0912","0.0004","7.8877","0.0003","72.467","0.003","90","","91.103","0.003","90","","5195.5","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C59 H85 N3 -","- C59 H85 N3 -","- C236 H340 N12 -","4","1","","Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A.","Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole","Crystal Growth & Design","2005","5","4","1443","","10.1021/cg049580s","","","1.54178","CuKα","","0.0622","0.0547","","","0.1387","0.1429","","","","","","1.139","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504871","6.5057","0.001","8.2178","0.0011","55.034","0.009","90","","91.781","0.002","90","","2940.8","0.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C35 H37 N3 O2 -","- C35 H37 N3 O2 -","- C140 H148 N12 O8 -","4","1","","Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A.","Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole","Crystal Growth & Design","2005","5","4","1443","","10.1021/cg049580s","","","0.71069","MoKα","","0.0809","0.0723","","","0.1635","0.1717","","","","","","1.185","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504872","12.1597","0.0002","19.8671","0.0004","15.6274","0.0002","90","","93.923","0.001","90","","3766.39","0.11","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-fluoren-9-ylidene-2-[9-(3-oxo-3-(4-methylphenyl)-prop-1-ynyl)-9H-fluoren-9-yl]-1-(4-methylphenyl)-propenone DMSO solvate","","- C48 H36 O3 S -","- C48 H36 O3 S -","- C192 H144 O12 S4 -","4","1","","Scott, Janet L.; Tanaka, Koichi","Photochromic Crystals: Toward an Understanding of Color Development in the Solid State","Crystal Growth & Design","2005","5","3","1209","","10.1021/cg049591l","","","0.71073","MoKα","","0.1686","0.0664","","","0.1362","0.1756","","","","","","0.98","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504873","8.9035","0.0002","13.1202","0.0003","18.6112","0.0006","102.77","0.001","97.995","0.001","102.662","0.001","2028.16","0.09","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","3-fluoren-9-ylidene-2-[9-(3-oxo-3-(3-methylphenyl)-prop-1-ynyl)-9H-fluoren-9-yl]-1-(4-methylphenyl)-propenone DMSO solvate","","- C50 H42 O4 S2 -","- C50 H42 O4 S2 -","- C100 H84 O8 S4 -","2","1","","Scott, Janet L.; Tanaka, Koichi","Photochromic Crystals: Toward an Understanding of Color Development in the Solid State","Crystal Growth & Design","2005","5","3","1209","","10.1021/cg049591l","","","0.71073","MoKα","","0.1243","0.0549","","","0.0993","0.1212","","","","","","1.009","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504874","40.5767","0.0008","13.9347","0.0004","27.1523","0.0008","90","","120.821","0.001","90","","13184.4","0.6","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-fluoren-9-ylidene-2-[9-(3-oxo-3-(3-methoxyphenyl)-prop-1-ynyl)-9H-fluoren-9-yl]-1-(4-methylphenyl)-propenone","","- C92 H60 O8 -","- C92 H60 O8 -","- C736 H480 O64 -","8","1","","Scott, Janet L.; Tanaka, Koichi","Photochromic Crystals: Toward an Understanding of Color Development in the Solid State","Crystal Growth & Design","2005","5","3","1209","","10.1021/cg049591l","","","0.71073","MoKα","","0.2749","0.0945","","","0.1724","0.2378","","","","","","1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504875","9.7057","0.0001","17.595","0.0002","20.9577","0.0003","72.196","0.001","81.517","0.001","77.065","0.001","3309.03","0.07","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","3-fluoren-9-ylidene-2-[9-(3-oxo-3-(4-methoxyphenyl)-prop-1-ynyl)-9H-fluoren-9-yl]-1-(4-methylphenyl)-propenone","","- C92 H60 O8 -","- C92 H60 O8 -","- C184 H120 O16 -","2","1","","Scott, Janet L.; Tanaka, Koichi","Photochromic Crystals: Toward an Understanding of Color Development in the Solid State","Crystal Growth & Design","2005","5","3","1209","","10.1021/cg049591l","","","0.71073","MoKα","","0.0713","0.0465","","","0.106","0.1186","","","","","","1.024","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504876","15.332","0.0003","12.9255","0.0004","17.0902","0.0004","90","","103.065","0.003","90","","3299.16","0.15","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-fluoren-9-ylidene-2-[9-(3-oxo-3-(4-chlorophenyl)-prop-1-ynyl)-9H-fluoren-9-yl]-1-(4-methylphenyl)-propenone DMSO solvate","","- C44 H24 Cl2 O2 -","- C44 H24 Cl2 O2 -","- C176 H96 Cl8 O8 -","4","1","","Scott, Janet L.; Tanaka, Koichi","Photochromic Crystals: Toward an Understanding of Color Development in the Solid State","Crystal Growth & Design","2005","5","3","1209","","10.1021/cg049591l","","","0.71073","MoKα","","0.1987","0.0728","","","0.1487","0.19","","","","","","0.988","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504877","12.0801","0.0002","18.5467","0.0003","14.5798","0.0003","90","","108.928","0.001","90","","3089.91","0.1","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,1,4,4-tetraphenyl-3,6-dibenzoylhexa-1,2-diene-5-yne","","- C44 H30 O2 -","- C44 H30 O2 -","- C176 H120 O8 -","4","1","","Scott, Janet L.; Tanaka, Koichi","Photochromic Crystals: Toward an Understanding of Color Development in the Solid State","Crystal Growth & Design","2005","5","3","1209","","10.1021/cg049591l","","","0.71073","MoKα","","0.1392","0.0579","","","0.0989","0.123","","","","","","1.021","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504878","8.2277","0.0016","13.182","0.003","8.2269","0.0016","94.89","0.03","107.19","0.03","85.08","0.03","847.6","0.3","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Mn2 N2 O11 -","- C14 H10 Mn2 N2 O11 -","- C28 H20 Mn4 N4 O22 -","2","1","","Wei, Yongli; Hou, Hongwei; Li, Linke; Fan, Yaoting; Zhu, Yu","From Dicarboxylic Acid to Tetranuclear Metallamacrocyclic Complex and 1D and 2D Polymers","Crystal Growth & Design","2005","5","4","1405","","10.1021/cg049596i","","","0.71073","MoKα","","0.0644","0.0536","","","0.1283","0.1363","","","","","","1.124","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504879","9.834","0.002","5.5508","0.0011","14.372","0.003","90","","104.91","0.03","90","","758.1","0.3","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H3 N O4 Pb -","- C7 H3 N O4 Pb -","- C28 H12 N4 O16 Pb4 -","4","1","","Wei, Yongli; Hou, Hongwei; Li, Linke; Fan, Yaoting; Zhu, Yu","From Dicarboxylic Acid to Tetranuclear Metallamacrocyclic Complex and 1D and 2D Polymers","Crystal Growth & Design","2005","5","4","1405","","10.1021/cg049596i","","","0.71073","MoKα","","0.0511","0.0454","","0.1028","0.1003","","","","1.114","1.13","1.13","","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504880","21.488","0.004","10.875","0.002","16.501","0.003","90","","115.83","0.03","90","","3470.7","1.4","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H11 Cd N3 O4 -","- C19 H11 Cd N3 O4 -","- C152 H88 Cd8 N24 O32 -","8","1","","Wei, Yongli; Hou, Hongwei; Li, Linke; Fan, Yaoting; Zhu, Yu","From Dicarboxylic Acid to Tetranuclear Metallamacrocyclic Complex and 1D and 2D Polymers","Crystal Growth & Design","2005","5","4","1405","","10.1021/cg049596i","","","0.71073","MoKα","","0.0426","0.0313","","","0.0662","0.0693","","","","","","1.052","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504881","12.71","0.003","10.176","0.002","13.658","0.003","90","","107.15","0.03","90","","1687.9","0.7","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H13 N3 O5 Zn -","- C19 H13 N3 O5 Zn -","- C76 H52 N12 O20 Zn4 -","4","1","","Wei, Yongli; Hou, Hongwei; Li, Linke; Fan, Yaoting; Zhu, Yu","From Dicarboxylic Acid to Tetranuclear Metallamacrocyclic Complex and 1D and 2D Polymers","Crystal Growth & Design","2005","5","4","1405","","10.1021/cg049596i","","","0.71073","MoKα","","0.0608","0.0411","","","0.0839","0.0885","","","","","","1.051","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504882","7.1084","0.0014","11.495","0.002","11.91","0.002","107.28","0.03","104.18","0.03","90.19","0.03","897.9","0.3","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H11 N2 O13 Zn2 -","- C14 H6 N2 O13 Zn2 -","- C28 H12 N4 O26 Zn4 -","2","1","","Wei, Yongli; Hou, Hongwei; Li, Linke; Fan, Yaoting; Zhu, Yu","From Dicarboxylic Acid to Tetranuclear Metallamacrocyclic Complex and 1D and 2D Polymers","Crystal Growth & Design","2005","5","4","1405","","10.1021/cg049596i","","","0.71073","MoKα","","0.0898","0.0812","","","0.2194","0.2265","","","","","","1.128","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504883","12.256","0.005","33.236","0.011","8.387","0.002","90","","90","","90","","3416","2","298","1","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H14 N3 O S -","- C21 H14 N3 O S -","- C168 H112 N24 O8 S8 -","8","1","","Yao, Masaru; Asakura, Satoshi; Abe, Masahiro; Inoue, Hidenari; Yoshioka, Naoki","Formation of a One-Dimensional Stacking Structure of π-Conjugated Nitroxyl Radical Bearing a 1,2,5-Thiadiazole Ring and Its Magnetic Property","Crystal Growth & Design","2005","5","2","413","","10.1021/cg049599v","","","0.71073","MoKα","","","0.049","","","","0.137","","","","","","0.976","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504884","11.173","0.001","12.536","0.002","13.026","0.001","90","","90.916","0.009","90","","1824.2","0.4","296","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H18 N O -","- C25 H18 N O -","- C100 H72 N4 O4 -","4","1","","Yao, Masaru; Asakura, Satoshi; Abe, Masahiro; Inoue, Hidenari; Yoshioka, Naoki","Formation of a One-Dimensional Stacking Structure of π-Conjugated Nitroxyl Radical Bearing a 1,2,5-Thiadiazole Ring and Its Magnetic Property","Crystal Growth & Design","2005","5","2","413","","10.1021/cg049599v","","","1.5418","CuKα","","","0.044","","","","0.128","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504885","8.618","0.005","11.028","0.006","11.126","0.006","64.06","0.05","80.57","0.05","73.21","0.05","909.5","1","200","","200","","","","","","","","","4","P -1","-P 1","2","","[La(bta)(OH2)2]-4.5(H2O)","","- C12 H22 La O12.5 -","- C12 H9 La O12.5 -","- C24 H18 La2 O25 -","2","1","","Zhang, Zheng-Hua; Shen, Zhong-Liang; Okamura, Taka-aki; Zhu, Hui-Fang; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses and Structures of Two Series of Coordination Frameworks Based on the Assembly of 1,3,5-Benzenetriacetic Acid with Lanthanide Metal Salts","Crystal Growth & Design","2005","5","3","1191","","10.1021/cg049600q","","","0.71075","MoKα","","0.0415","0.0262","","","0.0559","0.0578","","","","","","0.907","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504886","8.582","0.005","10.956","0.006","11.217","0.007","64.17","0.018","79.98","0.02","73.431","0.019","908.4","0.9","200","","200","","","","","","","","","4","P -1","-P 1","2","","[Ce(bta)(H2O)2]-4(H2O)","","- C12 H21 Ce O12 -","- C12 H9 Ce O12 -","- C24 H18 Ce2 O24 -","2","1","","Zhang, Zheng-Hua; Shen, Zhong-Liang; Okamura, Taka-aki; Zhu, Hui-Fang; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses and Structures of Two Series of Coordination Frameworks Based on the Assembly of 1,3,5-Benzenetriacetic Acid with Lanthanide Metal Salts","Crystal Growth & Design","2005","5","3","1191","","10.1021/cg049600q","","","0.71075","MoKα","","0.1205","0.0763","","","0.1716","0.1797","","","","","","1","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504887","8.541","0.004","10.909","0.005","11.198","0.005","64.153","0.014","79.902","0.015","73.711","0.014","899.6","0.7","200","","200","","","","","","","","","4","P -1","-P 1","2","","[Pr(bta)(H2O)2]-2.88(H2O)-0.35EtOH","","- C12.69 H22.34 O11.98 Pr -","- C12.694 H10.735 O11.98 Pr -","- C25.388 H21.47 O23.96 Pr2 -","2","1","","Zhang, Zheng-Hua; Shen, Zhong-Liang; Okamura, Taka-aki; Zhu, Hui-Fang; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses and Structures of Two Series of Coordination Frameworks Based on the Assembly of 1,3,5-Benzenetriacetic Acid with Lanthanide Metal Salts","Crystal Growth & Design","2005","5","3","1191","","10.1021/cg049600q","","","0.71075","MoKα","","0.0578","0.0342","","","0.0533","0.0564","","","","","","0.982","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504888","11.857","0.008","12.554","0.008","12.515","0.008","119.12","0.05","98.44","0.06","108.27","0.04","1441","2","200","","200","","","","","","","","","4","P -1","-P 1","2","","[La2(bta)2(H2O)3]-2.14(H2O)","","- C24 H28.28 La2 O17.14 -","- C24 H18 La2 O17.14 -","- C48 H36 La4 O34.28 -","2","1","","Zhang, Zheng-Hua; Shen, Zhong-Liang; Okamura, Taka-aki; Zhu, Hui-Fang; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses and Structures of Two Series of Coordination Frameworks Based on the Assembly of 1,3,5-Benzenetriacetic Acid with Lanthanide Metal Salts","Crystal Growth & Design","2005","5","3","1191","","10.1021/cg049600q","","","0.71075","MoKα","","0.0336","0.0225","","","0.0478","0.0492","","","","","","0.921","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504889","11.812","0.007","12.444","0.008","12.522","0.009","118.949","0.019","108.3","0.02","98.387","0.018","1427.5","1.7","200","","200","","","","","","","","","4","P -1","-P 1","2","","[Ce2(bta)2(H2O)3]-2(H2O)","","- C24 H28 Ce2 O17 -","- C24 H18 Ce2 O17 -","- C48 H36 Ce4 O34 -","2","1","","Zhang, Zheng-Hua; Shen, Zhong-Liang; Okamura, Taka-aki; Zhu, Hui-Fang; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses and Structures of Two Series of Coordination Frameworks Based on the Assembly of 1,3,5-Benzenetriacetic Acid with Lanthanide Metal Salts","Crystal Growth & Design","2005","5","3","1191","","10.1021/cg049600q","","","0.71075","MoKα","","0.0963","0.0504","","","0.059","0.0662","","","","","","0.752","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504890","11.781","0.011","12.503","0.013","12.416","0.012","118.87","0.03","98.42","0.03","108.3","0.03","1420","3","200","","200","","","","","","","","","4","P -1","-P 1","2","","[Pr2(bta)2(H2O)3]-2(H2O)","","- C24 H28 O17 Pr2 -","- C24 H24 O17 Pr2 -","- C48 H48 O34 Pr4 -","2","1","","Zhang, Zheng-Hua; Shen, Zhong-Liang; Okamura, Taka-aki; Zhu, Hui-Fang; Sun, Wei-Yin; Ueyama, Norikazu","Syntheses and Structures of Two Series of Coordination Frameworks Based on the Assembly of 1,3,5-Benzenetriacetic Acid with Lanthanide Metal Salts","Crystal Growth & Design","2005","5","3","1191","","10.1021/cg049600q","","","0.71075","MoKα","","0.0345","0.0251","","","0.0481","0.0498","","","","","","0.949","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504891","11.7982","0.0007","12.929","0.0008","12.9381","0.0008","90","","91.429","0.001","90","","1973","0.2","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 Bi I3 N5 -","- C13 H13 Bi I3 N5 -","- C52 H52 Bi4 I12 N20 -","4","1","","Reger, Daniel L.; Semeniuc, Radu F.; Smith, Mark D.","Metal Complexes of 2,6-Bis[(pyrazol-1-yl)methyl]pyridine: The Search for Aryl−Pyrazolyl Embrace Interactions as a Synthon for Crystal Engineering","Crystal Growth & Design","2005","5","3","1181","","10.1021/cg049609s","","","0.71073","MoKα","","0.0202","0.0191","","","0.0427","0.043","","","","","","1.09","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504892","13.6491","0.0009","13.3388","0.0009","11.2567","0.0007","90","","95.94","0.001","90","","2038.4","0.2","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Ag F3 N6 O3 S -","- C16 H16 Ag F3 N6 O3 S -","- C64 H64 Ag4 F12 N24 O12 S4 -","4","1","","Reger, Daniel L.; Semeniuc, Radu F.; Smith, Mark D.","Metal Complexes of 2,6-Bis[(pyrazol-1-yl)methyl]pyridine: The Search for Aryl−Pyrazolyl Embrace Interactions as a Synthon for Crystal Engineering","Crystal Growth & Design","2005","5","3","1181","","10.1021/cg049609s","","","0.71073","MoKα","","0.039","0.0356","","","0.0872","0.0894","","","","","","1.063","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504893","16.4622","0.001","10.5959","0.0006","20.3165","0.0012","90","","112.134","0.001","90","","3282.7","0.3","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C13 H13 B Cl F4 N5 Pt -","- C13 H13 B Cl F4 N5 Pt -","- C104 H104 B8 Cl8 F32 N40 Pt8 -","8","1","","Reger, Daniel L.; Semeniuc, Radu F.; Smith, Mark D.","Metal Complexes of 2,6-Bis[(pyrazol-1-yl)methyl]pyridine: The Search for Aryl−Pyrazolyl Embrace Interactions as a Synthon for Crystal Engineering","Crystal Growth & Design","2005","5","3","1181","","10.1021/cg049609s","","","0.71073","MoKα","","0.0237","0.0224","","","0.0547","0.0553","","","","","","1.156","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504894","19.144","0.0013","18.8439","0.0013","10.6967","0.0007","90","","90.257","0.001","90","","3858.8","0.5","150","2","150","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C36 H35 B2 Cd F8 N12 O0.5 -","- C36 H34 B2 Cd F8 N12 O0.49 -","- C144 H136 B8 Cd4 F32 N48 O1.96 -","4","0.5","","Reger, Daniel L.; Semeniuc, Radu F.; Smith, Mark D.","Metal Complexes of 2,6-Bis[(pyrazol-1-yl)methyl]pyridine: The Search for Aryl−Pyrazolyl Embrace Interactions as a Synthon for Crystal Engineering","Crystal Growth & Design","2005","5","3","1181","","10.1021/cg049609s","","","0.71073","MoKα","","0.0348","0.0339","","","0.0849","0.0855","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504895","13.0114","0.0007","17.3285","0.0009","18.8523","0.001","90","","102.816","0.001","90","","4144.7","0.4","150","2","150","2","","","","","","","","7","P 1 c 1","P -2yc","7","","","","- C85 H71 B4 Cd2 F16 N17 O5 -","- C85 H71 B4 Cd2 F16 N17 O5 -","- C170 H142 B8 Cd4 F32 N34 O10 -","2","1","","Reger, Daniel L.; Semeniuc, Radu F.; Smith, Mark D.","Metal Complexes of 2,6-Bis[(pyrazol-1-yl)methyl]pyridine: The Search for Aryl−Pyrazolyl Embrace Interactions as a Synthon for Crystal Engineering","Crystal Growth & Design","2005","5","3","1181","","10.1021/cg049609s","","","0.71073","MoKα","","0.0347","0.0331","","","0.0742","0.075","","","","","","1.052","","","","has coordinates,has disorder","179583","2020-10-21","18:00:00",""
"4504896","12.137","0.007","7.742","0.005","18.618","0.009","90","","90","","90","","1749.4","1.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H7 Cd N O6 -","- C7 H7 Cd N O6 -","- C56 H56 Cd8 N8 O48 -","8","1","","Tong, Ming-Liang; Hu, Sheng; Wang, Jing; Kitagawa, Susumu; Ng, Seik Weng","Supramolecular Isomerism in Cadmium Hydroxide Phases. Temperature-Dependent Synthesis and Structure of Photoluminescent Coordination Polymers of α- and β-Cd2(OH)2(2,4-pyda)","Crystal Growth & Design","2005","5","3","837","","10.1021/cg049610r","","","0.71073","MoKα","","0.0465","0.0391","","","0.0906","0.0939","","","","","","1.133","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504897","10.4291","0.0009","6.0983","0.0005","15.2762","0.0013","90","","106.992","0.002","90","","929.15","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 Cd2 N O6 -","- C7 H5 Cd2 N O6 -","- C28 H20 Cd8 N4 O24 -","4","1","","Tong, Ming-Liang; Hu, Sheng; Wang, Jing; Kitagawa, Susumu; Ng, Seik Weng","Supramolecular Isomerism in Cadmium Hydroxide Phases. Temperature-Dependent Synthesis and Structure of Photoluminescent Coordination Polymers of α- and β-Cd2(OH)2(2,4-pyda)","Crystal Growth & Design","2005","5","3","837","","10.1021/cg049610r","","","0.71073","MoKα","","0.0244","0.022","","","0.0498","0.0508","","","","","","1.089","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504898","10.523","0.006","11.065","0.008","8.061","0.004","90","","94.643","0.012","90","","935.5","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 Cd2 N O6 -","- C7 H5 Cd2 N O6 -","- C28 H20 Cd8 N4 O24 -","4","1","","Tong, Ming-Liang; Hu, Sheng; Wang, Jing; Kitagawa, Susumu; Ng, Seik Weng","Supramolecular Isomerism in Cadmium Hydroxide Phases. Temperature-Dependent Synthesis and Structure of Photoluminescent Coordination Polymers of α- and β-Cd2(OH)2(2,4-pyda)","Crystal Growth & Design","2005","5","3","837","","10.1021/cg049610r","","","0.71073","MoKα","","0.0245","0.0211","","","0.0612","0.0725","","","","","","1.261","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504899","9.6735","0.0003","19.5436","0.0005","7.0889","0.0002","90","","94.4613","0.0011","90","","1336.13","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Cu N8 -","- C12 H10 Cu N8 -","- C48 H40 Cu4 N32 -","4","1","","Gao, En-Qing; Yue, Yan-Feng; Bai, Shi-Qiang; He, Zheng; Yan, Chun-Hua","One-Dimensional Copper(II) Complexes Containing Only Single End-On Azido Bridges: Crystal Structures and Magnetic Properties","Crystal Growth & Design","2005","5","3","1119","","10.1021/cg0496181","","","0.71073","MoKα","","0.1058","0.0385","","","0.0647","0.0782","","","","","","0.957","","","","has coordinates","179583","2020-10-21","18:00:00",""
"4504900","18.4371","0.0003","21.3954","0.0004","7.2088","0.0001","90","","90","","90","","2843.65","0.08","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C12 H9 Cl Cu N8 -","- C12 H9 Cl Cu N8 -","- C96 H72 Cl8 Cu8 N64 -","8","1","","Gao, En-Qing; Yue, Yan-Feng; Bai, Shi-Qiang; He, Zheng; Yan, Chun-Hua","One-Dimensional Copper(II) Complexes Containing Only Single End-On Azido Bridges: Crystal Structures and Magnetic Properties","Crystal Growth & Design","2005","5","3","1119","","10.1021/cg0496181","","","0.71073","MoKα","","0.081","0.0358","","","0.0732","0.0856","","","","","","1.017","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504901","14.115","0.003","11.592","0.003","17.743","0.004","90","","92.529","0.004","90","","2900.3","1.2","133","2","133","2","","","","","","","","4","P 1 21 1","P 2yb","4","","6(4)-O-CAMPHORSULFONYL 2,4(6)DIBENZOYL MYO-INOSITOL 1,3,5 ORTHOFORMATE","","- C31 H32 O11 S -","- C31 H32 O11 S -","- C124 H128 O44 S4 -","4","2","","Manoj, K.; Sureshan, Kana M.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.","Short SO···CO Contacts Associate Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate in Their Inclusion Complexes","Crystal Growth & Design","2005","5","3","833","","10.1021/cg049621k","","","0.71073","MoKα","","0.0532","0.0484","","","0.123","0.1269","","","","","","1.024","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504902","31.182","0.004","11.2219","0.0013","22.715","0.003","90","","109.948","0.002","90","","7471.6","1.6","133","2","133","2","","","","","","","","4","C 1 2 1","C 2y","5","","6(4)-O-CAMPHORSULPHONYL 2,4(6)DIBENZOYL MYO-INOSITOL 1,3,5 ORTHOFORMATE","","- C35.5 H35 O11 S -","- C35.5 H35 O11 S -","- C284 H280 O88 S8 -","8","2","","Manoj, K.; Sureshan, Kana M.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.","Short SO···CO Contacts Associate Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate in Their Inclusion Complexes","Crystal Growth & Design","2005","5","3","833","","10.1021/cg049621k","","","0.71073","MoKα","","0.0908","0.067","","","0.1727","0.1853","","","","","","0.944","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504903","30.561","0.017","10.925","0.006","22.255","0.012","90","","114.922","0.01","90","","6739","6","133","2","133","2","","","","","","","","5","C 1 2 1","C 2y","5","","6(4)-O-CAMPHORSULPHONYL 2,4(6)DIBENZOYL MYO-INOSITOL 1,3,5 ORTHOFORMATE","","- C32.38 H34.75 Cl2.75 O11 S -","- C32.375 H34.75 Cl2.75 O11 S -","- C259 H278 Cl22 O88 S8 -","8","2","","Manoj, K.; Sureshan, Kana M.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.","Short SO···CO Contacts Associate Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate in Their Inclusion Complexes","Crystal Growth & Design","2005","5","3","833","","10.1021/cg049621k","","","0.71073","MoKα","","0.1248","0.0905","","","0.199","0.2186","","","","","","1.072","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504904","31.047","0.006","11.2665","0.0018","22.631","0.004","90","","109.88","0.004","90","","7444","2","133","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","6(4)-O-CAMPHORSULPHONYL 2,4(6)DIBENZOYL MYO-INOSITOL 1,3,5 ORTHOFORMATE","","- C35.5 H40 O11.25 S -","- C35.5 H40 O11.25 S -","- C284 H320 O90 S8 -","8","2","","Manoj, K.; Sureshan, Kana M.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.","Short SO···CO Contacts Associate Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate in Their Inclusion Complexes","Crystal Growth & Design","2005","5","3","833","","10.1021/cg049621k","","","0.71073","MoKα","","0.0818","0.071","","","0.1969","0.2095","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504905","30.623","0.009","11.129","0.004","22.529","0.007","90","","111.05","0.005","90","","7166","4","133","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","6(4)-O-CAMPHORSULPHONYL 2,4(6)DIBENZOYL MYO-INOSITOL 1,3,5 ORTHOFORMATE","","- C37.75 H39.25 N1.5 O11.38 S -","- C37.75 H39.25 N1.5 O11.375 S -","- C302 H314 N12 O91 S8 -","8","2","","Manoj, K.; Sureshan, Kana M.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.","Short SO···CO Contacts Associate Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate in Their Inclusion Complexes","Crystal Growth & Design","2005","5","3","833","","10.1021/cg049621k","","","0.71073","MoKα","","0.0532","0.05","","","0.1452","0.1489","","","","","","1.051","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504906","15.937","0.004","11.054","0.003","22.206","0.006","90","","108.432","0.004","90","","3711.3","1.7","133","2","133","2","","","","","","","","4","P 1 21 1","P 2yb","4","","6(4)-O-CAMPHORSULPHONYL 2,4(6)DIBENZOYL MYO-INOSITOL 1,3,5 ORTHOFORMATE","","- C36.5 H43 O13.75 S -","- C36.5 H43 O13.75 S -","- C146 H172 O55 S4 -","4","2","","Manoj, K.; Sureshan, Kana M.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S.","Short SO···CO Contacts Associate Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate in Their Inclusion Complexes","Crystal Growth & Design","2005","5","3","833","","10.1021/cg049621k","","","0.71073","MoKα","","0.1149","0.0911","","","0.247","0.2697","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504907","18.932","0.002","5.6894","0.0007","10.4151","0.0013","90","","90","","90","","1121.8","0.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","2-aminopyridinium 4-aminobenzoate 1:1","2-aminopyridinium 4-aminobenzoate 1:1","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0287","0.0284","","","0.0718","0.0721","","","","","","1.087","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504908","12.5619","0.0013","8.0768","0.0009","12.2356","0.0013","90","","109.831","0.002","90","","1167.8","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-aminopyridinium isophthalate 1:1","2-aminopyridinium isophthalate 1:1","","- C13 H12 N2 O4 -","- C13 H12 N2 O4 -","- C52 H48 N8 O16 -","4","1","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0362","0.0331","","","0.0931","0.0959","","","","","","0.966","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504909","5.1991","0.0008","14.606","0.002","11.1897","0.0017","90","","95.094","0.003","90","","846.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-aminopyridinium terephthalate 2:1","2-aminopyridinium terephthalate 2:1","","- C18 H18 N4 O4 -","- C18 H18 N4 O4 -","- C36 H36 N8 O8 -","2","0.5","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0545","0.0434","","","0.1037","0.1091","","","","","","1.029","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504910","9.678","0.003","10.838","0.004","11.836","0.004","90","","111.21","0.006","90","","1157.4","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-amino-5-picolinium benzoate 1:1","2-amino-5-picolinium benzoate 1:1","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C52 H56 N8 O8 -","4","1","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0682","0.0553","","","0.1518","0.1625","","","","","","1.058","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504911","8.542","0.0012","11.0504","0.0016","13.0956","0.0019","101.086","0.002","103.007","0.002","98.983","0.002","1155.9","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","2-amino-5-picolinium 5-t-butylisophthalate","2-amino-5-picolinium 5-t-butylisophthalate 2:1","","- C24 H30 N4 O4 -","- C24 H30 N4 O4 -","- C48 H60 N8 O8 -","2","1","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0689","0.0582","","","0.1592","0.1681","","","","","","1.056","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504912","5.627","0.002","14.48","0.006","11.351","0.004","90","","99.622","0.007","90","","911.9","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-amino-5-picolinium terephthalate 2:1","2-amino-5-picolinium terephthalate 2:1","","- C10 H11 N2 O2 -","- C10 H11 N2 O2 -","- C40 H44 N8 O8 -","4","1","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.1014","0.0744","","","0.183","0.2023","","","","","","0.907","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504913","5.834","0.002","16.26","0.007","10.985","0.004","90","","92.141","0.007","90","","1041.3","0.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-amino-5-methylpyridinium 2,6-naphthalenedicarboxylate 2:1","2-amino-5-methylpyridinium 2,6-naphthalenedicarboxylate 2:1","","- C24 H24 N4 O4 -","- C24 H24 N4 O4 -","- C48 H48 N8 O8 -","2","0.5","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.066","0.0536","","","0.1353","0.1424","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504914","5.07","0.0007","7.2081","0.001","18.388","0.003","88.468","0.002","85.015","0.002","72.373","0.002","638.02","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","2-amino-5-picolinium adipate adipic acid 2:1:1","2-amino-5-picolinium adipate adipic acid 2:1:1","","- C24 H36 N4 O8 -","- C24 H36 N4 O8 -","- C24 H36 N4 O8 -","1","0.5","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0485","0.0433","","","0.1208","0.1324","","","","","","1.121","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504915","14.7349","0.001","18.7523","0.0012","9.074","0.0006","90","","90","","90","","2507.3","0.3","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","2-amino-5-picolinium 2,5-thiophenedicarboxylate 2,5-thiophenedicarboxylic acid","2-amino-5-picolinium 2,5-thiophenedicarboxylate 2,5-thiophenedicarboxylic acid","","- C24 H24 N4 O8 S2 -","- C24 H24 N4 O8 S2 -","- C96 H96 N16 O32 S8 -","4","0.5","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0372","0.0339","","","0.0887","0.0907","","","","","","1.064","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504916","12.564","0.0016","11.3377","0.0014","30.501","0.004","90","","90","","90","","4344.8","1","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","2-amino-5-picolinium Indomethacine 1:1","2-amino-5-picolinium Indomethacine 1:1","","- C25 H24 Cl N3 O4 -","- C25 H24 Cl N3 O4 -","- C200 H192 Cl8 N24 O32 -","8","2","","Bis, Joanna A.; Zaworotko, Michael J.","The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals","Crystal Growth & Design","2005","5","3","1169","","10.1021/cg049622c","","","0.71073","MoKα","","0.0929","0.0718","","","0.1693","0.1837","","","","","","1.038","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504917","5.9131","0.0004","10.4071","0.0009","13.4411","0.0007","90","","90","","90","","827.14","0.1","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Cobalt citrate monohydrate","","","- C6 H8 Co O8 -","- C6 H8 Co O8 -","- C24 H32 Co4 O32 -","4","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Wan, Hui-Lin","Structural Diversities of Cobalt(II) Coordination Polymers with Citric Acid","Crystal Growth & Design","2005","5","3","1109","","10.1021/cg0496282","","","0.71073","MoKα","","0.0427","0.0383","","","0.071","0.0723","","","","","","0.997","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504918","11.204","0.0012","11.91","0.0012","12.0139","0.0013","90","","116.254","0.002","90","","1437.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","tri-cobalt citrate","","","- C12 H38 Co3 O28 -","- C12 H38 Co3 O28 -","- C24 H76 Co6 O56 -","2","0.5","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Wan, Hui-Lin","Structural Diversities of Cobalt(II) Coordination Polymers with Citric Acid","Crystal Growth & Design","2005","5","3","1109","","10.1021/cg0496282","","","0.71073","MoKα","","0.0798","0.04","","","0.052","0.0568","","","","","","0.683","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504919","9.054","0.0007","6.6468","0.0005","20.277","0.0015","90","","96.871","0.001","90","","1211.51","0.16","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Trinuclear cobalt citrate","","","- C12 H30 Co3 O24 -","- C12 H30 Co3 O24 -","- C24 H60 Co6 O48 -","2","0.5","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Wan, Hui-Lin","Structural Diversities of Cobalt(II) Coordination Polymers with Citric Acid","Crystal Growth & Design","2005","5","3","1109","","10.1021/cg0496282","","","0.71073","MoKα","","0.0894","0.0575","","","0.1188","0.134","","","","","","1.024","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504920","11.8034","0.0009","8.3749","0.0006","9.5543","0.0007","90","","96.213","0.001","90","","938.92","0.12","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ammonium cobalt citrate monohydrate","","","- C6 H11 Co N O8 -","- C6 H11 Co N O8 -","- C24 H44 Co4 N4 O32 -","4","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Wan, Hui-Lin","Structural Diversities of Cobalt(II) Coordination Polymers with Citric Acid","Crystal Growth & Design","2005","5","3","1109","","10.1021/cg0496282","","","0.71073","MoKα","","0.0772","0.0549","","","0.1217","0.1307","","","","","","1.044","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504921","7.5842","0.0008","7.771","0.0008","13.812","0.001","102.67","0.002","95.096","0.002","94.973","0.002","786.34","0.13","124.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H17 N6 O6 S2 -","- C12.25 H17 N3 O5 S -","- C24.5 H34 N6 O10 S2 -","2","1","","Voogt, Jason N.; Blanch, Harvey W.","Temperature-Dependent Solvent Disruption of Guanidinium-1,5-Naphthalenedisulfonate Networks Yields a One-Dimensional Pore Structure","Crystal Growth & Design","2005","5","3","1135","","10.1021/cg049636i","","","0.7107","MoKα","","","0.0537","","","","0.0634","","","","","","2.117","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504922","7.8217","0.0008","19.228","0.002","7.438","0.0008","90","","90","","90","","1118.6","0.2","123.2","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C14 H26 N3 O8 S2 -","- C15.4 H18 N6 O8 S2 -","- C30.8 H36 N12 O16 S4 -","2","0.25","","Voogt, Jason N.; Blanch, Harvey W.","Temperature-Dependent Solvent Disruption of Guanidinium-1,5-Naphthalenedisulfonate Networks Yields a One-Dimensional Pore Structure","Crystal Growth & Design","2005","5","3","1135","","10.1021/cg049636i","","","0.7107","MoKα","","","0.0698","","","","0.1067","","","","","","4.495","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504923","8.4292","0.0006","9.4026","0.0007","8.276","0.0006","90","","93.156","0.001","90","","654.93","0.08","298","2","571","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H4 N2 O4 Zn -","- C5 H4 N2 O4 Zn -","- C20 H16 N8 O16 Zn4 -","4","1","","Lu, Jing; Zhao, Kui; Fang, Qian-Rong; Xu, Ji-Qing; Yu, Jie-Hui; Zhang, Xiao; Bie, Hai-Ying; Wang, Tie-Gang","Synthesis and Characterization of Four Novel Supramolecular Compounds Based on Metal Zinc and Cadmium","Crystal Growth & Design","2005","5","3","1091","","10.1021/cg049637a","","","0.71073","MoKα","","0.031","0.0285","","","0.0707","0.0722","","","","","","1.057","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504924","10.3405","0.0009","10.0948","0.0006","12.1549","0.0006","90","","109.317","0.004","90","","1197.36","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 N6 Zn -","- C12 H8 N6 Zn -","- C48 H32 N24 Zn4 -","4","1","","Lu, Jing; Zhao, Kui; Fang, Qian-Rong; Xu, Ji-Qing; Yu, Jie-Hui; Zhang, Xiao; Bie, Hai-Ying; Wang, Tie-Gang","Synthesis and Characterization of Four Novel Supramolecular Compounds Based on Metal Zinc and Cadmium","Crystal Growth & Design","2005","5","3","1091","","10.1021/cg049637a","","","0.71073","MoKα","","0.0839","0.0395","","","0.0593","0.0687","","","","","","0.859","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504925","7.3915","0.0006","5.9789","0.0005","12.3309","0.0006","90","","92.885","0.002","90","","544.25","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H2 Cd2 O6 -","- C2 Cd2 O6 -","- C8 Cd8 O24 -","4","1","","Lu, Jing; Zhao, Kui; Fang, Qian-Rong; Xu, Ji-Qing; Yu, Jie-Hui; Zhang, Xiao; Bie, Hai-Ying; Wang, Tie-Gang","Synthesis and Characterization of Four Novel Supramolecular Compounds Based on Metal Zinc and Cadmium","Crystal Growth & Design","2005","5","3","1091","","10.1021/cg049637a","","","0.71073","MoKα","","0.0287","0.0262","","","0.0572","0.0585","","","","","","1.189","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504926","12.1631","0.0012","12.433","0.0012","14.9601","0.0014","83.957","0.002","89.001","0.002","83.13","0.002","2233.6","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H49 N6 O10 -","- C48 H49 N6 O10 -","- C96 H98 N12 O20 -","2","1","","Barnes, Charles L.; Bosch, Eric","The Quest for Chain-Link Hydrogen-Bonded Capsules: Self-Assembly of C-Methyl Calix[4]resorcinarene with 5,5‘-Bipyrimidine","Crystal Growth & Design","2005","5","3","1049","","10.1021/cg049639v","","","0.71073","MoKα","","0.0856","0.0624","","","0.1688","0.1886","","","","","","1.028","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504927","15.5432","0.0011","15.8676","0.0011","15.917","0.0011","94.926","0.001","117.339","0.001","115.926","0.001","2927.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C63 H65 N9 O8 -","- C63 H65 N9 O8 -","- C126 H130 N18 O16 -","2","1","","Barnes, Charles L.; Bosch, Eric","The Quest for Chain-Link Hydrogen-Bonded Capsules: Self-Assembly of C-Methyl Calix[4]resorcinarene with 5,5‘-Bipyrimidine","Crystal Growth & Design","2005","5","3","1049","","10.1021/cg049639v","","","0.71073","MoKα","","0.1632","0.0652","","","0.1562","0.1976","","","","","","1","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504928","10.2272","0.0008","10.543","0.0008","17.2047","0.0014","92.397","0.001","91.766","0.001","110.519","0.001","1733.8","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H43 N4 O9 -","- C40 H43 N4 O9 -","- C80 H86 N8 O18 -","2","1","","Barnes, Charles L.; Bosch, Eric","The Quest for Chain-Link Hydrogen-Bonded Capsules: Self-Assembly of C-Methyl Calix[4]resorcinarene with 5,5‘-Bipyrimidine","Crystal Growth & Design","2005","5","3","1049","","10.1021/cg049639v","","","0.71073","MoKα","","0.0778","0.0442","","","0.1021","0.1197","","","","","","1.016","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504929","12.511","0.003","27.82","0.006","23.127","0.005","90","","92.6","0.03","90","","8041","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H26 N2 O2 -","- C35 H26 N2 O2 -","- C420 H312 N24 O24 -","12","3","","Zeng, Qingdao; Wu, Dongxia; Liu, Caiming; Ma, Hongwei; Lu, Jun; Xu, Shandong; Li, Yan; Wang, Chen; Bai, Chunli","Crystal Engineering Based on Polymeric Hydrogen-Bonded Supramolecules by Self-Assembling of 4,4‘-(9-Fluorenylidene)diphenol and 4,4‘-Cyclohexylidenebisphenol with Bipyridines","Crystal Growth & Design","2005","5","3","1041","","10.1021/cg049650v","","","0.71073","MoKα","","0.1305","0.0534","","","0.1134","0.1354","","","","","","0.969","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504930","14.424","0.003","10.901","0.002","14.962","0.003","90","","95.24","0.03","90","","2342.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H24 N O2 -","- C31 H24 N O2 -","- C124 H96 N4 O8 -","4","1","","Zeng, Qingdao; Wu, Dongxia; Liu, Caiming; Ma, Hongwei; Lu, Jun; Xu, Shandong; Li, Yan; Wang, Chen; Bai, Chunli","Crystal Engineering Based on Polymeric Hydrogen-Bonded Supramolecules by Self-Assembling of 4,4‘-(9-Fluorenylidene)diphenol and 4,4‘-Cyclohexylidenebisphenol with Bipyridines","Crystal Growth & Design","2005","5","3","1041","","10.1021/cg049650v","","","0.71073","MoKα","","0.161","0.0536","","","0.1201","0.1369","","","","","","0.88","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504931","19.971","0.004","10.782","0.002","20.781","0.004","90","","90","","90","","4474.7","1.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C62 H46 N2 O4 -","- C62 H46 N2 O4 -","- C248 H184 N8 O16 -","4","0.5","","Zeng, Qingdao; Wu, Dongxia; Liu, Caiming; Ma, Hongwei; Lu, Jun; Xu, Shandong; Li, Yan; Wang, Chen; Bai, Chunli","Crystal Engineering Based on Polymeric Hydrogen-Bonded Supramolecules by Self-Assembling of 4,4‘-(9-Fluorenylidene)diphenol and 4,4‘-Cyclohexylidenebisphenol with Bipyridines","Crystal Growth & Design","2005","5","3","1041","","10.1021/cg049650v","","","0.71073","MoKα","","0.0518","0.034","","","0.0722","0.0753","","","","","","0.829","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504932","18.988","0.004","13.295","0.003","11.009","0.002","90","","105.97","0.03","90","","2671.9","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H26 N2 O4 -","- C35 H26 N2 O4 -","- C140 H104 N8 O16 -","4","0.5","","Zeng, Qingdao; Wu, Dongxia; Liu, Caiming; Ma, Hongwei; Lu, Jun; Xu, Shandong; Li, Yan; Wang, Chen; Bai, Chunli","Crystal Engineering Based on Polymeric Hydrogen-Bonded Supramolecules by Self-Assembling of 4,4‘-(9-Fluorenylidene)diphenol and 4,4‘-Cyclohexylidenebisphenol with Bipyridines","Crystal Growth & Design","2005","5","3","1041","","10.1021/cg049650v","","","0.71073","MoKα","","0.0765","0.0442","","","0.1018","0.1112","","","","","","1.03","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504933","6.2951","0.0013","7.6354","0.0015","25.366","0.005","82.75","0.03","87.55","0.03","66.96","0.03","1113","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","- C56 H56 N4 O4 -","2","1","","Zeng, Qingdao; Wu, Dongxia; Liu, Caiming; Ma, Hongwei; Lu, Jun; Xu, Shandong; Li, Yan; Wang, Chen; Bai, Chunli","Crystal Engineering Based on Polymeric Hydrogen-Bonded Supramolecules by Self-Assembling of 4,4‘-(9-Fluorenylidene)diphenol and 4,4‘-Cyclohexylidenebisphenol with Bipyridines","Crystal Growth & Design","2005","5","3","1041","","10.1021/cg049650v","","","0.71073","MoKα","","0.0919","0.0608","","","0.176","0.1992","","","","","","1.051","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504934","16.041","0.002","16.041","0.002","17.659","0.004","90","","90","","90","","4543.9","1.3","293","2","293","2","","","","","","","","7","I 4/m","-I 4","87","","","","- C30 H42 Cl2 Co N4 O13 S4 -","- C30 H36 Cl2 Co N4 O13 S4 -","- C120 H144 Cl8 Co4 N16 O52 S16 -","4","0.25","","Xie, Ya-Bo; Li, Jian-Rong; Zhang, Chong; Bu, Xian-He","Syntheses and Crystal Structures of Manganese(II), Cadmium(II), Cobalt(II), and Zinc(II) Complexes with 4-Pyridyl Dithioether Ligands","Crystal Growth & Design","2005","5","5","1743","","10.1021/cg0496538","","","0.71073","MoKα","","0.1441","0.0976","","","0.2574","0.2848","","","","","","0.857","","","","has coordinates,has disorder","179584","2020-10-21","18:00:00",""
"4504935","15.97","0.003","15.97","0.003","17.523","0.006","90","","90","","90","","4469.1","1.9","293","2","293","2","","","","","","","","7","I 4/m","-I 4","87","","","","- C30 H42 Cl2 N4 O13 S4 Zn -","- C30 H36 Cl2 N4 O13 S4 Zn -","- C120 H144 Cl8 N16 O52 S16 Zn4 -","4","0.25","","Xie, Ya-Bo; Li, Jian-Rong; Zhang, Chong; Bu, Xian-He","Syntheses and Crystal Structures of Manganese(II), Cadmium(II), Cobalt(II), and Zinc(II) Complexes with 4-Pyridyl Dithioether Ligands","Crystal Growth & Design","2005","5","5","1743","","10.1021/cg0496538","","","0.71073","MoKα","","0.1876","0.0899","","","0.2283","0.2748","","","","","","0.844","","","","has coordinates,has disorder","179584","2020-10-21","18:00:00",""
"4504936","4.4143","0.0001","14.7701","0.0005","15.9119","0.0006","90","","96.485","0.001","90","","1030.81","0.06","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N8 O8 -","- C18 H22 N8 O8 -","- C36 H44 N16 O16 -","2","0.5","","Trask, Andrew V.; Motherwell, W. D. Samuel; Jones, William","Pharmaceutical Cocrystallization: Engineering a Remedy for Caffeine Hydration","Crystal Growth & Design","2005","5","3","1013","","10.1021/cg0496540","","","0.71073","MoKα","","0.0587","0.0462","","","0.1162","0.1235","","","","","","1.126","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504937","30.3992","0.0012","31.2845","0.0016","4.6739","0.0002","90","","90","","90","","4445","0.3","180","2","180","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C19 H24 N8 O8 -","- C19 H24 N8 O8 -","- C152 H192 N64 O64 -","8","0.5","","Trask, Andrew V.; Motherwell, W. D. Samuel; Jones, William","Pharmaceutical Cocrystallization: Engineering a Remedy for Caffeine Hydration","Crystal Growth & Design","2005","5","3","1013","","10.1021/cg0496540","","","0.71073","MoKα","","0.0702","0.0425","","","0.0855","0.0954","","","","","","1.079","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504938","6.8565","0.0002","12.5051","0.0004","15.8362","0.0005","90","","93.61","0.001","90","","1355.12","0.07","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N4 O6 -","- C12 H14 N4 O6 -","- C48 H56 N16 O24 -","4","1","","Trask, Andrew V.; Motherwell, W. D. Samuel; Jones, William","Pharmaceutical Cocrystallization: Engineering a Remedy for Caffeine Hydration","Crystal Growth & Design","2005","5","3","1013","","10.1021/cg0496540","","","0.71073","MoKα","","0.0763","0.0437","","","0.0962","0.11","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504939","13.0129","0.0005","6.6017","0.0002","17.1427","0.0008","90","","97.836","0.001","90","","1458.93","0.1","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 N4 O6 -","- C13 H18 N4 O6 -","- C52 H72 N16 O24 -","4","1","","Trask, Andrew V.; Motherwell, W. D. Samuel; Jones, William","Pharmaceutical Cocrystallization: Engineering a Remedy for Caffeine Hydration","Crystal Growth & Design","2005","5","3","1013","","10.1021/cg0496540","","","0.71073","MoKα","","0.1061","0.0645","","","0.187","0.2271","","","","","","1.082","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504940","8.3212","0.0008","8.6667","0.0008","11.3636","0.0012","68.955","0.004","78.559","0.004","74.236","0.004","731.43","0.13","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H18 N4 O6 -","- C13 H18 N4 O6 -","- C26 H36 N8 O12 -","2","1","","Trask, Andrew V.; Motherwell, W. D. Samuel; Jones, William","Pharmaceutical Cocrystallization: Engineering a Remedy for Caffeine Hydration","Crystal Growth & Design","2005","5","3","1013","","10.1021/cg0496540","","","0.71073","MoKα","","0.0815","0.0572","","","0.1569","0.1771","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504941","8.9231","0.0002","11.2023","0.0002","12.7643","0.0002","101.477","0.0011","97.0069","0.0009","98.7719","0.0009","1220.39","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H50 Cl2 Mn N12 O12 -","- C42 H50 Cl2 Mn N12 O12 -","- C42 H50 Cl2 Mn N12 O12 -","1","0.5","","Gao, En-Qing; Cheng, Ai-Ling; Xu, Yan-Xia; Yan, Chun-Hua; He, Ming-Yuan","New Inorganic−Organic Hybrid Supramolecular Architectures Generated from 2,5-Bis(3-pyridyl)-3,4-diaza-2,4-hexadiene","Crystal Growth & Design","2005","5","3","1005","","10.1021/cg049659x","","","0.71073","MoKα","","0.0693","0.0474","","","0.1241","0.1371","","","","","","1.027","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504942","6.2477","0.0001","8.4165","0.0002","15.0632","0.0004","90","","101.78","0.0011","90","","775.4","0.03","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H14 Ag N5 O3 -","- C14 H14 Ag N5 O3 -","- C28 H28 Ag2 N10 O6 -","2","0.5","","Gao, En-Qing; Cheng, Ai-Ling; Xu, Yan-Xia; Yan, Chun-Hua; He, Ming-Yuan","New Inorganic−Organic Hybrid Supramolecular Architectures Generated from 2,5-Bis(3-pyridyl)-3,4-diaza-2,4-hexadiene","Crystal Growth & Design","2005","5","3","1005","","10.1021/cg049659x","","","0.71073","MoKα","","0.0327","0.0277","","","0.0685","0.0715","","","","","","1.097","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504943","12.1332","0.0015","16.798","0.002","46.658","0.006","90","","90","","90","","9510","2","173","2","173","2","","","","","","","","3","F d d 2","F 2 -2d","43","1R (1PBA)(C6(CN)6)","","","- C26 H20 N10 -","- C26 H20 N10 -","- C416 H320 N160 -","16","1","","Lee, Sang-Ok; Shacklady, Danielle M.; Horner, Matthew J.; Ferlay, Sylvie; Hosseini, Mir W.; Ward, Michael D.","Structural Transference and Regulation of Bimodal Assembly of Charge-Assisted Hydrogen-Bonded Networks","Crystal Growth & Design","2005","5","3","995","","10.1021/cg049660w","","","0.71073","MoKα","","0.0804","0.0747","","","0.1992","0.2068","","","","","","1.049","","","","has coordinates,has disorder","179584","2020-10-21","18:00:00",""
"4504944","6.6656","0.0006","8.2082","0.0007","22.476","0.002","83.327","0.001","82.168","0.002","84.308","0.002","1205.65","0.18","173","2","173","2","","","","","","","","3","P -1","-P 1","2","1G (PBA)(C6(CN)6)","","","- C26 H20 N10 -","- C26 H20 N10 -","- C52 H40 N20 -","2","1","","Lee, Sang-Ok; Shacklady, Danielle M.; Horner, Matthew J.; Ferlay, Sylvie; Hosseini, Mir W.; Ward, Michael D.","Structural Transference and Regulation of Bimodal Assembly of Charge-Assisted Hydrogen-Bonded Networks","Crystal Growth & Design","2005","5","3","995","","10.1021/cg049660w","","","0.71073","MoKα","","0.0612","0.0512","","","0.1304","0.1367","","","","","","1.018","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504945","5.746","0.002","11.867","0.005","16.084","0.006","90","","90.473","0.005","90","","1096.7","0.7","173","2","173","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","2Y (EBA)(C6(CN)6)","","","- C22 H20 N10 -","- C22 H20 N10 -","- C44 H40 N20 -","2","0.5","","Lee, Sang-Ok; Shacklady, Danielle M.; Horner, Matthew J.; Ferlay, Sylvie; Hosseini, Mir W.; Ward, Michael D.","Structural Transference and Regulation of Bimodal Assembly of Charge-Assisted Hydrogen-Bonded Networks","Crystal Growth & Design","2005","5","3","995","","10.1021/cg049660w","","","0.71073","MoKα","","0.1256","0.0741","","","0.177","0.1928","","","","","","1.18","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504946","12.278","0.002","6.6757","0.0011","8.6678","0.0014","90","","115.239","0.002","90","","642.63","0.18","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","cyanuric acid dihydrate","","","- C3 H7 N3 O5 -","- C3 H7 N3 O5 -","- C12 H28 N12 O20 -","4","0.5","","Lewis, Thomas C.; Tocher, Derek A.; Price, Sarah L.","Investigating Unused Hydrogen Bond Acceptors Using Known and Hypothetical Crystal Polymorphism","Crystal Growth & Design","2005","5","3","983","","10.1021/cg049661o","","","0.71073","MoKα","","0.0307","0.03","","","0.088","0.0885","","","","","","1.11","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504947","6.297","0.004","7.674","0.004","10.557","0.006","74.94","0.008","87.597","0.009","67.677","0.008","454.8","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Cyanuric acid DMF solvate","","","- C6 H10 N4 O4 -","- C6 H10 N4 O4 -","- C12 H20 N8 O8 -","2","1","","Lewis, Thomas C.; Tocher, Derek A.; Price, Sarah L.","Investigating Unused Hydrogen Bond Acceptors Using Known and Hypothetical Crystal Polymorphism","Crystal Growth & Design","2005","5","3","983","","10.1021/cg049661o","","","0.71073","MoKα","","0.0443","0.0421","","","0.1169","0.1191","","","","","","1.066","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504948","9.5205","0.0016","13.338","0.002","7.4575","0.0012","90","","107.993","0.004","90","","900.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 Mn N8 -","- C16 H14 Mn N8 -","- C32 H28 Mn2 N16 -","2","0.5","","Ghoshal, D.; Ghosh, A. K.; Ribas, J.; Zangrando, E.; Mostafa, G.; Maji, T. K.; Ray Chaudhuri, N.","Synthesis, Crystal Structure, and Magnetic Behavior of Two Dicyanamido-Bridged Complexes of Manganese(II): Effect of Weak Interaction in Carving Regular Geometry","Crystal Growth & Design","2005","5","3","941","","10.1021/cg049669y","","","0.71073","MoKα","","0.146","0.0486","","","0.0767","0.0933","","","","","","0.85","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504949","7.549","0.003","12.059","0.004","14.631","0.005","90","","90","","90","","1331.9","0.8","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","bis(dicyanamide)-(2,2'-bi-imidazole)-manganese(II)","","- C10 H6 Mn N10 -","- C10 H6 Mn N10 -","- C40 H24 Mn4 N40 -","4","1","","Ghoshal, D.; Ghosh, A. K.; Ribas, J.; Zangrando, E.; Mostafa, G.; Maji, T. K.; Ray Chaudhuri, N.","Synthesis, Crystal Structure, and Magnetic Behavior of Two Dicyanamido-Bridged Complexes of Manganese(II): Effect of Weak Interaction in Carving Regular Geometry","Crystal Growth & Design","2005","5","3","941","","10.1021/cg049669y","","","0.71073","Mokα","","0.054","0.0349","","","0.0885","0.0974","","","","","","1.028","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504950","32.066","0.0003","32.066","0.0003","32.066","0.0003","90","","90","","90","","32971.2","0.5","100","2","100","2","","","","","","","","5","P n -3 n :2","-P 4a 2bc 3","222","Cu_cube","","","- C480 H408 Cu6 N48 O192.08 -","- C480 H408 Cu6 N48 O192 -","- C960 H816 Cu12 N96 O384 -","2","0.0416667","","Natarajan, Ramalingam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Self-Assembly of a Unique Extended-Tetrahedral 3,3‘,5,5‘-Tetrakis(4-pyridyl)bimesityl Ligand into Discrete Supramolecular Cubes by Face-Directed Metal Coordination","Crystal Growth & Design","2005","5","1","69","","10.1021/cg049683a","","","0.71073","MoKα","","0.1844","0.1472","","","0.394","0.4173","","","","","","1.394","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504951","32.2839","0.001","32.2839","0.001","32.2839","0.001","90","","90","","90","","33647.9","1.8","100","2","100","2","","","","","","","","5","P n -3 n :2","-P 4a 2bc 3","222","Ni_cube","","","- C456 H408 N48 Ni6 O12 -","- C456 H408 N48 Ni6 O12 -","- C912 H816 N96 Ni12 O24 -","2","0.0416667","","Natarajan, Ramalingam; Savitha, Govardhan; Moorthy, Jarugu Narasimha","Self-Assembly of a Unique Extended-Tetrahedral 3,3‘,5,5‘-Tetrakis(4-pyridyl)bimesityl Ligand into Discrete Supramolecular Cubes by Face-Directed Metal Coordination","Crystal Growth & Design","2005","5","1","69","","10.1021/cg049683a","","","0.71073","MoKα","","0.144","0.0622","","","0.1191","0.1301","","","","","","0.682","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504952","15.107","0.0009","15.107","0.0009","18.019","0.002","90","","90","","120","","3561.4","0.5","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","2,4,6-tris(4-bromophenoxy)-1,3,5-triazine, hexafluorobenzene","2,4,6-tris(4-bromophenoxy)-1,3,5-triazine, hexafluorobenzene","","- C48 H24 Br6 F6 N6 O6 -","- C48 H24 Br6 F6 N6 O6 -","- C144 H72 Br18 F18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0269","0.0246","","","0.0621","0.0632","","","","","","1.035","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504953","15.619","0.002","15.619","0.002","18.361","0.004","90","","90","","120","","3879.1","1.1","123","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, collidine","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, collidine","","- C50 H35 I6 N7 O6 -","- C49.98 H24 I6 N7.02 O6 -","- C149.94 H72 I18 N21.06 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0409","0.0377","","","0.0928","0.0945","","","","","","1.109","","","","has coordinates","288183","2023-12-08","14:42:59",""
"4504954","15.6595","0.0013","15.6595","0.0013","18.681","0.002","90","","90","","120","","3967.2","0.6","203","2","203","2","","","","","","","","6","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, dibromomethane","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, dibromomethane","","- C45 H30 Br3 I6 N6 O6 -","- C45 H24 Br3 I6 N6 O6 -","- C135 H72 Br9 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0843","0.0682","","","0.1871","0.2017","","","","","","1.056","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504955","15.7177","0.0005","15.7177","0.0005","18.9157","0.0009","90","","90","","120","","4047","0.3","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, dichloromethane","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, dichloromethane","","- C43 H26 Cl2 I6 N6 O6 -","- C43.02 H26.04 Cl1.98 I6 N6 O6 -","- C129.06 H78.12 Cl5.94 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0612","0.0527","","","0.1728","0.1803","","","","","","1.109","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504956","15.6962","0.001","15.6962","0.001","18.9478","0.0018","90","","90","","120","","4042.8","0.5","145","2","145","2","","","","","","","","5","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, diiodomethane","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, diiodomethane","","- C22 H14 I5 N3 O3 -","- C21.99 H13.98 I4.98 N3 O3 -","- C131.94 H83.88 I29.88 N18 O18 -","6","0.333333","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0667","0.0623","","","0.1462","0.1505","","","","","","1.094","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504957","15.686","0.004","15.686","0.004","18.583","0.007","90","","90","","120","","3960","2","223","2","223","2","","","","","","","","6","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, hexachlorobenzene","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, hexachlorobenzene","","- C48 H24 Cl6 I6 N6 O6 -","- C48 H24 Cl6 I6 N6 O6 -","- C144 H72 Cl18 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0347","0.0307","","","0.0828","0.0847","","","","","","1.064","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504958","15.668","0.003","15.668","0.003","18.475","0.005","90","","90","","120","","3927.7","1.5","183","2","183","2","","","","","","","","5","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, mesitylene","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, mesitylene","","- C51 H36 I6 N6 O6 -","- C51 H24 I6 N6 O6 -","- C153 H72 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.059","0.0489","","","0.1167","0.1237","","","","","","1.057","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504959","15.583","0.0006","15.583","0.0006","18.3563","0.0014","90","","90","","120","","3860.3","0.4","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, 1-methylnapthalene","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, 1-methylnapthalene","","- C53 H34 I6 N6 O6 -","- C53.02 H24 I6 N6 O6 -","- C159.06 H72 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0223","0.021","","","0.0546","0.0553","","","","","","1.149","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504960","15.7356","0.0008","15.7356","0.0008","18.3863","0.0013","90","","90","","120","","3942.7","0.4","145","2","145","2","","","","","","","","6","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, tribromomesitylene","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, tribromomesitylene","","- C51 H33 Br3 I6 N6 O6 -","- C51 H33 Br3 I6 N6 O6 -","- C153 H99 Br9 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0501","0.0482","","","0.1144","0.116","","","","","","1.08","","","","has coordinates,has disorder","179584","2020-10-21","18:00:00",""
"4504961","15.9236","0.0009","15.9236","0.0009","18.425","0.002","90","","90","","120","","4046","0.5","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, 1,3,5-triiodomesitylene","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, 1,3,5-triiodomesitylene","","- C51 H33 I9 N6 O6 -","- C51 H24 I9 N6 O6 -","- C153 H72 I27 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.0275","0.0239","","","0.0609","0.0629","","","","","","1.092","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504962","15.5466","0.0004","15.5466","0.0004","18.1511","0.0011","90","","90","","120","","3799.3","0.3","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, hexafluorobenzene","2,4,6-tris(4-iodophenoxy)-1,3,5-triazine, hexafluorobenzene","","- C48 H24 F6 I6 N6 O6 -","- C48 H24 F6 I6 N6 O6 -","- C144 H72 F18 I18 N18 O18 -","3","0.166667","","Saha, Binoy K.; Jetti, Ram K. R.; Reddy, L. Sreenivas; Aitipamula, Srinivasulu; Nangia, Ashwini","Halogen Trimer-Mediated Hexagonal Host Framework of 2,4,6-Tris(4-halophenoxy)-1,3,5-triazine. Supramolecular Isomerism from Hexagonal Channel (X = Cl, Br) to Cage Structure (X = I)","Crystal Growth & Design","2005","5","3","887","","10.1021/cg049691r","","","0.71073","MoKα","","0.022","0.0212","","","0.0584","0.0589","","","","","","1.106","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504963","11.917","0.004","26.67","0.009","15.241","0.005","90","","112.694","0.006","90","","4469","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H28 Cd Cl3 N8 O12 -","- C43 H28 Cd Cl3 N8 O12 -","- C172 H112 Cd4 Cl12 N32 O48 -","4","1","","Lü, Xing-Qiang; Jiang, Ji-Jun; Zhang, Li; Chen, Chun-Long; Su, Cheng-Yong; Kang, Bei-Sheng","Nonpenetrating Architectures of Cd(II) Complexes Constructed by Bispyridyl-Substituted Diphthalic Diimide Ligands of Varied Geometry","Crystal Growth & Design","2005","5","2","419","","10.1021/cg049693b","","","0.71073","MoKα","","0.0928","0.0556","","","0.1596","0.1882","","","","","","1.026","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504964","9.491","0.004","10.759","0.004","15.026","0.006","74.52","0.006","83.059","0.006","84.896","0.006","1465.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H48 Cd N10 O18 -","- C60 H42 Cd N10 O18 -","- C60 H42 Cd N10 O18 -","1","0.5","","Lü, Xing-Qiang; Jiang, Ji-Jun; Zhang, Li; Chen, Chun-Long; Su, Cheng-Yong; Kang, Bei-Sheng","Nonpenetrating Architectures of Cd(II) Complexes Constructed by Bispyridyl-Substituted Diphthalic Diimide Ligands of Varied Geometry","Crystal Growth & Design","2005","5","2","419","","10.1021/cg049693b","","","0.71073","MoKα","","0.0658","0.0507","","","0.1378","0.1515","","","","","","1.061","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504965","14.193","0.005","14.369","0.005","23.138","0.008","79.651","0.006","88.557","0.006","75.189","0.006","4487","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H88 Cd4 N4 S10 -","- C92 H85.5 Cd4 N4 S10 -","- C184 H171 Cd8 N8 S20 -","2","1","","Zhang, Xuanjun; Tian, Yupeng; Jin, Feng; Wu, Jieying; Xie, Yi; Tao, Xutang; Jiang, Minhua","Self-Assembly of an Organic Chromophore with Cd−S Nanoclusters: Supramolecular Structures and Enhanced Emissions","Crystal Growth & Design","2005","5","2","565","","10.1021/cg049695w","","","0.71073","MoKα","","0.2263","0.0534","","","0.0678","0.096","","","","","","0.653","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504966","14.839","0.004","15.428","0.004","18.335","0.005","98.09","0.005","97.543","0.005","106.76","0.005","3913.3","1.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C68 H72 Cd4 I4 N4 O2 S6 -","- C68 H72 Cd4 I4 N4 O2 S6 -","- C136 H144 Cd8 I8 N8 O4 S12 -","2","1","","Zhang, Xuanjun; Tian, Yupeng; Jin, Feng; Wu, Jieying; Xie, Yi; Tao, Xutang; Jiang, Minhua","Self-Assembly of an Organic Chromophore with Cd−S Nanoclusters: Supramolecular Structures and Enhanced Emissions","Crystal Growth & Design","2005","5","2","565","","10.1021/cg049695w","","","0.71073","MoKα","","0.1864","0.05","","","0.0658","0.0808","","","","","","0.691","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504967","14.617","0.006","12.448","0.005","16.846","0.007","90","","95.14","0.04","90","","3053","2","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H42 N3 O6 -","- C30 H42 N3 O6 -","- C120 H168 N12 O24 -","4","1","","Cannon, Amy S.; Foxman, Bruce M.; Guarrera, Donna J.; Warner, John C.","Noncovalent Derivatives of Hydroquinone: Complexes with Trigonal Planar Tris(N,N-dialkyl)trimesamides","Crystal Growth & Design","2005","5","2","407","","10.1021/cg049702g","","","0.71073","MoKα","","0.0988","0.0618","","0.0749","0.0653","0.0653","","","","","","1.1158","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504968","10.142","0.006","14.859","0.009","17.662","0.011","90","","98.01","0.06","90","","2636","3","294","","294","","","","1","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 N3 O7 -","- C27 H33 N3 O7 -","- C108 H132 N12 O28 -","4","1","","Cannon, Amy S.; Foxman, Bruce M.; Guarrera, Donna J.; Warner, John C.","Noncovalent Derivatives of Hydroquinone: Complexes with Trigonal Planar Tris(N,N-dialkyl)trimesamides","Crystal Growth & Design","2005","5","2","407","","10.1021/cg049702g","","","0.71073","MoKα","","0.0493","0.0493","","0.048","0.048","0.048","","","","","","1.1824","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504969","4.9669","0.0009","11.459","0.004","5.4231","0.0012","90","","114.916","0.015","90","","279.93","0.13","293","","293","","","","2","","","","","4","P 1 21/n 1","-P 2yn","14","","Alpha glycine","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C8 H20 N4 O8 -","4","1","","Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine","Crystal Growth & Design","2005","5","4","1415","","10.1021/cg049716m","","","0.6843","synchrotron","","0.0875","0.0771","","0.1906","0.1845","0.1906","","","","","","1.1837","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504970","4.869","0.0007","11.139","0.003","5.3777","0.001","90","","116.888","0.011","90","","260.13","0.1","293","","293","","","","62","","","","","4","P 1 21/n 1","-P 2yn","14","","alpha glycine","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C8 H20 N4 O8 -","4","1","","Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine","Crystal Growth & Design","2005","5","4","1415","","10.1021/cg049716m","","","0.6843","synchrotron","","0.0852","0.0685","","0.1897","0.1779","0.1897","","","","","","1.0905","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504971","6.9332","0.0006","6.9332","0.0006","5.4552","0.0008","90","","90","","120","","227.1","0.04","293","","293","","","","1","","","","","4","P 31","P 31","144","","Gamma glycine","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C6 H15 N3 O6 -","3","1","","Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine","Crystal Growth & Design","2005","5","4","1415","","10.1021/cg049716m","","","0.71073","MoKα","","0.1053","0.0866","","0.1935","0.1723","0.1935","","","","","","1.174","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504972","6.8617","0.0004","6.8617","0.0004","5.4282","0.0006","90","","90","","120","","221.33","0.03","293","","293","","","","0","","","","","4","P 31","P 31","144","","Gamma Glycine","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C6 H15 N3 O6 -","3","1","","Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine","Crystal Growth & Design","2005","5","4","1415","","10.1021/cg049716m","","","0.71073","MoKα","","0.0993","0.0895","","0.182","0.1733","0.182","","","","","","1.151","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504973","11.156","0.004","5.8644","0.0011","5.3417","0.0017","90","","125.83","0.04","90","","283.3","0.2","293","","293","","","","2","","","","","4","P 1 21/a 1","-P 2yab","14","","delta glycine","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C8 H20 N4 O8 -","4","1","","Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine","Crystal Growth & Design","2005","5","4","1415","","10.1021/cg049716m","","","0.71073","MoKα","","0.0976","0.0759","","0.1969","0.1802","0.1969","","","","","","1.0458","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504974","4.8887","0.001","5.7541","0.0011","5.4419","0.0011","90","","116.682","0.01","90","","136.78","0.05","","","293","","","","4.3","","","","","4","P 1 n 1","P -2yac","7","","Epsilon glycine","","- C2 H5 N O2 -","- C2 H5 N O2 -","- C4 H10 N2 O4 -","2","1","","Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine","Crystal Growth & Design","2005","5","4","1415","","10.1021/cg049716m","powder diffraction","","0.4654","","","","","","","","","","","0.514","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504975","6.947","0.002","6.246","0.002","10.76","0.003","90","","104.23","0.02","90","","452.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","4,4'-dimethylazoxyfurazan","3-methyl-4-[(E)-(4-methyl-1,2,5-oxadiazol-3-yl)diazenyl]-1,2,5-oxadiazole","","- C6 H6 N6 O3 -","- C6 H6 N6 O3 -","- C12 H12 N12 O6 -","2","0.5","","Averkiev, Boris B.; Antipin, Mikhail Yu.; Sheremetev, Aleksey B.; Timofeeva, Tatiana V.","Computer Simulation of Crystal Structure for Three Furazan Derivatives","Crystal Growth & Design","2005","5","2","631","","10.1021/cg049717e","","","0.71073","MoKα","","0.0748","0.0442","","","0.1261","0.1328","","","","","","0.984","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504976","6.977","0.0014","6.154","0.0012","10.515","0.002","90","","108.49","0.03","90","","428.17","0.16","160","2","160","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","4,4'-Dichloroazoxyfurazan","3-chloro-4-[(E)-(4-chloro-1,2,5-oxadiazol-3-yl)diazenyl]-1,2,5-oxadiazole","","- C4 Cl2 N6 O3 -","- C4 Cl2 N6 O3 -","- C8 Cl4 N12 O6 -","2","0.5","","Averkiev, Boris B.; Antipin, Mikhail Yu.; Sheremetev, Aleksey B.; Timofeeva, Tatiana V.","Computer Simulation of Crystal Structure for Three Furazan Derivatives","Crystal Growth & Design","2005","5","2","631","","10.1021/cg049717e","","","0.71073","MoKα","","0.0561","0.0416","","","0.1204","0.1237","","","","","","1.029","","","","has coordinates,has disorder","179584","2020-10-21","18:00:00",""
"4504977","6.7202","0.0014","8.4002","0.0017","13.938","0.003","94.599","0.017","101.385","0.016","94.682","0.016","765","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","4,4'-di(morpholin-1-yl)azoxyfurazan","4-{4-[(E)-(4-morpholin-4-yl-1,2,5-oxadiazol-3-yl)diazenyl]- 1,2,5-oxadiazol-3-yl}morpholine","","- C12 H16 N8 O5 -","- C12 H16 N8 O5 -","- C24 H32 N16 O10 -","2","1","","Averkiev, Boris B.; Antipin, Mikhail Yu.; Sheremetev, Aleksey B.; Timofeeva, Tatiana V.","Computer Simulation of Crystal Structure for Three Furazan Derivatives","Crystal Growth & Design","2005","5","2","631","","10.1021/cg049717e","","","0.71073","MoKα","","0.0763","0.0428","","","0.098","0.1052","","","","","","0.929","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504978","7.4894","0.0015","16.237","0.003","8.2217","0.0016","90","","92.9","0.03","90","","998.5","0.3","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C7 H6 Ag2 O7 S -","- C7 H3 Ag2 O7 S -","- C28 H12 Ag8 O28 S4 -","4","1","","Ma, Jian-Fang; Yang, Jin; Li,; Song, Shu-Yan; Zhang, Hong-Jie; Wang, Hai-Shui; Yang, Kui-Yue","Two Coordination Polymers of Ag(I) with 5-Sulfosalicylic Acid","Crystal Growth & Design","2005","5","2","807","","10.1021/cg049723a","","","0.71073","MoKα","","0.0455","0.0372","","","0.1228","0.1252","","","","","","1.119","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504979","8.3069","0.0017","11.246","0.002","12.59","0.003","112.68","0.03","97.66","0.03","95.51","0.03","1061.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Ag2 O16 S2 -","- C14 H18 Ag2 O16 S2 -","- C28 H36 Ag4 O32 S4 -","2","1","","Ma, Jian-Fang; Yang, Jin; Li,; Song, Shu-Yan; Zhang, Hong-Jie; Wang, Hai-Shui; Yang, Kui-Yue","Two Coordination Polymers of Ag(I) with 5-Sulfosalicylic Acid","Crystal Growth & Design","2005","5","2","807","","10.1021/cg049723a","","","0.71073","MoKα","","0.0339","0.0257","","","0.0745","0.0855","","","","","","1.13","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504980","7.4589","0.0015","8.1654","0.0016","13.538","0.003","90","","90","","90","","824.5","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C2 H11 N O7 P2 -","- C2 H11 N O7 P2 -","- C8 H44 N4 O28 P8 -","4","1","","Kong, Deyuan; McBee, Jennifer L.; Clearfield, Abraham","Crystal Engineered Acid‒Base Complexes with 2D and 3D Hydrogen Bonding Systems Using a Bisphosphonic Acid as the Building Block","Crystal Growth & Design","2005","5","2","643","649","10.1021/cg0497243","","","0.71073","MoKα","","0.0317","0.0317","","","0.0847","0.0848","","","","","","1.141","","","","has coordinates","210354","2020-10-21","18:00:00",""
"4504981","9.447","0.006","18.891","0.011","13.612","0.008","90","","90.388","0.009","90","","2429","3","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H42 N4 O13 P2 -","- C14 H42 N4 O13 P2 -","- C56 H168 N16 O52 P8 -","4","1","","Kong, Deyuan; McBee, Jennifer L.; Clearfield, Abraham","Crystal Engineered Acid‒Base Complexes with 2D and 3D Hydrogen Bonding Systems Using a Bisphosphonic Acid as the Building Block","Crystal Growth & Design","2005","5","2","643","649","10.1021/cg0497243","","","0.71073","MoKα","","0.033","0.0309","","","0.0816","0.0832","","","","","","1.039","","","","has coordinates","210354","2020-10-21","18:00:00",""
"4504982","10.8497","0.0008","12.8209","0.001","17.2248","0.0014","105.195","0.001","90.871","0.001","98.22","0.001","2285","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H26 N4 O12 P4 -","- C14 H26 N4 O12 P4 -","- C56 H104 N16 O48 P16 -","4","2","","Kong, Deyuan; McBee, Jennifer L.; Clearfield, Abraham","Crystal Engineered Acid‒Base Complexes with 2D and 3D Hydrogen Bonding Systems Using a Bisphosphonic Acid as the Building Block","Crystal Growth & Design","2005","5","2","643","649","10.1021/cg0497243","","","0.71073","MoKα","","0.0482","0.0338","","","0.0968","0.1066","","","","","","1.054","","","","has coordinates","210354","2020-10-21","18:00:00",""
"4504983","29.267","0.005","5.4416","0.001","18.067","0.003","90","","120.093","0.003","90","","2489.5","0.8","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H32 N4 O12 P4 -","- C17 H31 N4 O12 P4 -","- C68 H124 N16 O48 P16 -","4","0.5","","Kong, Deyuan; McBee, Jennifer L.; Clearfield, Abraham","Crystal Engineered Acid‒Base Complexes with 2D and 3D Hydrogen Bonding Systems Using a Bisphosphonic Acid as the Building Block","Crystal Growth & Design","2005","5","2","643","649","10.1021/cg0497243","","","0.71073","MoKα","","0.0686","0.042","","","0.0951","0.1076","","","","","","1.021","","","","has coordinates","210354","2020-10-21","18:00:00",""
"4504984","8.307","0.001","8.769","0.001","9.204","0.001","95.63","0.01","115.61","0.01","110.26","0.01","542.31","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 La2 O20 -","- C6 H6 La O10 -","- C12 H12 La2 O20 -","2","1","","Michaelides, Adonis; Skoulika, Stavroula","Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration","Crystal Growth & Design","2005","5","2","529","","10.1021/cg049725v","","","0.71073","MoKα","","0.0212","0.0203","","","0.0532","0.0537","","","","","","1.131","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504985","8.304","0.001","8.728","0.001","9.177","0.001","95.59","0.01","115.7","0.01","110.26","0.01","537.59","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 Ce2 O20 -","- C6 H6 Ce O10 -","- C12 H12 Ce2 O20 -","2","1","","Michaelides, Adonis; Skoulika, Stavroula","Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration","Crystal Growth & Design","2005","5","2","529","","10.1021/cg049725v","","","0.71073","MoKα","","0.0279","0.0254","","","0.0636","0.066","","","","","","0.924","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504986","8.279","0.002","8.731","0.003","9.098","0.003","94.83","0.04","115.54","0.01","111.93","0.02","526.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 Ce2 O18 -","- C6 H2 Ce O9 -","- C12 H4 Ce2 O18 -","2","1","","Michaelides, Adonis; Skoulika, Stavroula","Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration","Crystal Growth & Design","2005","5","2","529","","10.1021/cg049725v","","","0.71073","MoKα","","0.0454","0.0432","","","0.1096","0.1111","","","","","","1.08","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504987","11.0741","0.0011","11.6272","0.0013","15.2196","0.0013","90","","90","","90","","1959.7","0.3","293","2","295","2","","","","","","","","4","P n n n :2","-P 2ab 2bc","48","","","","- C24 H18 I10 N6 -","- C24 H18 I10 N6 -","- C48 H36 I20 N12 -","2","0.25","","Padgett, Clifford W.; Walsh, Rosa D.; Drake, Gregory W.; Hanks, Timothy W.; Pennington, William T.","New Conformations and Binding Modes in Halogen-Bonded and Ionic Complexes of 2,3,5,6-Tetra(2‘-pyridyl)pyrazine","Crystal Growth & Design","2005","5","2","745","","10.1021/cg049730z","","","0.71073","MoKα","","0.0361","0.0243","","","0.0451","0.0465","","","","","","0.985","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504988","11.895","0.002","11.682","0.002","12.957","0.002","90","","94.23","0.01","90","","1795.6","0.5","293","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 I8 N6 -","- C24 H20 I8 N6 -","- C48 H40 I16 N12 -","2","0.5","","Padgett, Clifford W.; Walsh, Rosa D.; Drake, Gregory W.; Hanks, Timothy W.; Pennington, William T.","New Conformations and Binding Modes in Halogen-Bonded and Ionic Complexes of 2,3,5,6-Tetra(2‘-pyridyl)pyrazine","Crystal Growth & Design","2005","5","2","745","","10.1021/cg049730z","","","0.71073","MoKα","","0.0368","0.0233","","","0.0397","0.0406","","","","","","1.019","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504989","11.607","0.004","13.987","0.006","17.854","0.005","90","","92.41","0.02","90","","2896","1.8","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 I4 N6 -","- C26 H16 I4 N6 -","- C104 H64 I16 N24 -","4","0.5","","Padgett, Clifford W.; Walsh, Rosa D.; Drake, Gregory W.; Hanks, Timothy W.; Pennington, William T.","New Conformations and Binding Modes in Halogen-Bonded and Ionic Complexes of 2,3,5,6-Tetra(2‘-pyridyl)pyrazine","Crystal Growth & Design","2005","5","2","745","","10.1021/cg049730z","","","0.71073","MoKα","","0.0301","0.0261","","","0.0609","0.0618","","","","","","1.075","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504990","11.552","0.002","12.742","0.003","14.589","0.003","94.22","0.03","109.01","0.03","115.57","0.03","1772.8","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H56 La4 Mo8 N4 O64 -","- C28 H56 La4 Mo8 N4 O64 -","- C28 H56 La4 Mo8 N4 O64 -","1","0.5","","Lü, Jian; Shen, Enhong; Li, Yangguang; Xiao, Dongrong; Wang, Enbo; Xu, Lin","A Novel Pillar-Layered Organic−Inorganic Hybrid Based on Lanthanide Polymer and Polyomolybdate Clusters: New Opportunity toward the Design and Synthesis of Porous Framework","Crystal Growth & Design","2005","5","1","65","","10.1021/cg049732j","","","0.71073","MoKα","","0.0355","0.0285","","","0.08","0.0832","","","","","","1.066","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504991","9.2332","0.0012","6.1926","0.0008","23.143","0.003","90","","90.548","0.002","90","","1323.2","0.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Aminobenzoic acid 4-nitrobenzoic acid","","- C14 H12 N2 O6 -","- C14 H12 N2 O6 -","- C56 H48 N8 O24 -","4","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.0708","0.0636","","","0.1542","0.1589","","","","","","1.182","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504992","15.8195","0.0009","4.3087","0.0004","16.466","0.0008","90","","107.173","0.005","90","","1072.31","0.13","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Aminobenzoic acid 2,2'-bipyridine","4-Aminobenzoic acid 2,2'-bipyridine","","- C12 H11 N2 O2 -","- C12 H11 N2 O2 -","- C48 H44 N8 O8 -","4","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.1417","0.0573","","","0.1138","0.1442","","","","","","1.002","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504993","8.2212","0.0011","16.0895","0.0014","17.7649","0.0016","90","","101.629","0.01","90","","2301.6","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Aminobenzoic acid 2,2'-bipyridine-n-oxide","","- C24 H22 N4 O5 -","- C24 H22 N4 O5 -","- C96 H88 N16 O20 -","4","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.1307","0.0634","","","0.1687","0.2065","","","","","","1.047","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504994","29.21","0.003","3.8089","0.0005","23.2503","0.0015","90","","118.029","0.004","90","","2283.4","0.4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","4-Aminobenzoic acid 2,2'-bipyridine","4-Aminobenzoic acid 2,2'-bipyridine","","- C12 H9 N2 O4 -","- C12 H9 N2 O4 -","- C96 H72 N16 O32 -","8","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.1145","0.0547","","","0.1125","0.1374","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504995","7.8386","0.0004","6.8499","0.0004","20.7925","0.001","90","","92.559","0.004","90","","1115.31","0.1","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Nitrobenzoic acid 4,4'-bipyridine","","- C12 H9 N2 O4 -","- C12 H9 N2 O4 -","- C48 H36 N8 O16 -","4","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.1139","0.0554","","","0.1236","0.1519","","","","","","1.011","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504996","13.105","0.003","7.1812","0.0017","23.756","0.006","90","","92.742","0.004","90","","2233.1","0.9","135","2","135","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-nitrobenzoic acid 2,2'-bipyridine-N,N'-dioxide","","- C24 H18 N4 O10 -","- C24 H18 N4 O10 -","- C96 H72 N16 O40 -","4","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.0837","0.0528","","","0.1089","0.122","","","","","","1.022","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504997","9.2934","0.0006","11.6146","0.0006","12.2041","0.001","65.308","0.006","74.856","0.005","75.299","0.004","1139.47","0.14","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4-Nitrobenzoic acid 4,4'-bipyridine-N,N'-dioxide","","- C24 H18 N4 O10 -","- C24 H18 N4 O10 -","- C48 H36 N8 O20 -","2","1","","Bowers, Jeffrey R.; Hopkins, Gregory W.; Yap, Glenn P. A.; Wheeler, Kraig A.","Structural Consequences of Strong and Weak Interactions to Binary Benzoic Acid/Bipyridine Supramolecular Assemblies","Crystal Growth & Design","2005","5","2","727","","10.1021/cg0497391","","","0.71073","MoKα","","0.1117","0.0527","","","0.1191","0.1438","","","","","","1.022","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504998","29.95","0.006","9.809","0.002","19.848","0.004","90","","93.59","0.03","90","","5819","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C37 H30 N2 O2 -","- C37 H22 N2 O2 -","- C296 H176 N16 O16 -","8","1","","Biradha, Kumar; Mahata, Goutam","Enclathration of Aromatic Molecules by the O−H···N Supramolecular Adducts of Racemic-bis-β-naphthol and 4,4‘-Bipyridine","Crystal Growth & Design","2005","5","1","61","","10.1021/cg049761u","","","0.71073","MoKα","","0.1411","0.0636","","","0.1617","0.2257","","","","","","1.037","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4504999","16.218","0.003","9.536","0.0019","17.675","0.004","90","","93.33","0.03","90","","2728.9","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H27 N2 O2 -","- C36 H27 N2 O2 -","- C144 H108 N8 O8 -","4","1","","Biradha, Kumar; Mahata, Goutam","Enclathration of Aromatic Molecules by the O−H···N Supramolecular Adducts of Racemic-bis-β-naphthol and 4,4‘-Bipyridine","Crystal Growth & Design","2005","5","1","61","","10.1021/cg049761u","","","0.71073","MoKα","","0.1267","0.0575","","","0.1283","0.1862","","","","","","1.076","","","","has coordinates","179584","2020-10-21","18:00:00",""
"4505000","9.894","0.002","18.022","0.004","18.045","0.004","90","","101.07","0.03","90","","3157.7","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H30 N4 O2 -","- C40 H30 N4 O2 -","- C160 H120 N16 O8 -","4","1","","Biradha, Kumar; Mahata, Goutam","Enclathration of Aromatic Molecules by the O−H···N Supramolecular Adducts of Racemic-bis-β-naphthol and 4,4‘-Bipyridine","Crystal Growth & Design","2005","5","1","61","","10.1021/cg049761u","","","0.71073","MoKα","","0.1995","0.0764","","","0.1503","0.2292","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505001","13.1347","0.0016","10.912","0.002","12.203","0.002","90","","90","","90","","1749","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-aminopyridinium 4-nitrophenolate . 4-nitrophenol ?","","- C17 H16 N4 O6 -","- C17 H16 N4 O6 -","- C68 H64 N16 O24 -","4","1","","Prakash, M. Jaya; Radhakrishnan, T. P.","SHG Active Salts of 4-Nitrophenolate with H-Bonded Helical Formations: Structure-Directing Role ofortho-Aminopyridines","Crystal Growth & Design","2005","5","2","721","","10.1021/cg049763e","","","0.71073","MoKα","","0.1222","0.0447","","","0.1153","0.1154","","","","","","0.961","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505002","13.6129","0.0014","10.9042","0.0011","12.0323","0.0012","90","","90","","90","","1786","0.3","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2,6-diaminopyridinium 4-nitrophenolate . 4-nitrophenol ?","","- C17 H17 N5 O6 -","- C17 H17 N5 O6 -","- C68 H68 N20 O24 -","4","1","","Prakash, M. Jaya; Radhakrishnan, T. P.","SHG Active Salts of 4-Nitrophenolate with H-Bonded Helical Formations: Structure-Directing Role ofortho-Aminopyridines","Crystal Growth & Design","2005","5","2","721","","10.1021/cg049763e","","","0.71073","MoKα","","0.0694","0.0415","","","0.1247","0.1247","","","","","","0.857","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505003","14.6255","0.0015","14.6255","0.0015","18.848","0.003","90","","90","","120","","3491.5","0.8","173","2","173","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C18 H15 Cl6 N6 Sb -","- C18 H15 Cl6 N6 Sb -","- C108 H90 Cl36 N36 Sb6 -","6","0.333333","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0322","0.0254","","","0.0489","0.0506","","","","","","0.991","","","","has coordinates","271475","2021-12-16","11:44:44",""
"4505004","14.5986","0.0011","14.5986","0.0011","19.062","0.002","90","","90","","120","","3518.2","0.5","173","2","173","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C18 H15 Bi Cl6 N6 -","- C18 H15 Bi Cl6 N6 -","- C108 H90 Bi6 Cl36 N36 -","6","0.166667","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0223","0.0163","","","0.0381","0.0397","","","","","","1.048","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505005","13.8577","0.0019","15.899","0.002","25.332","0.003","90","","95.302","0.002","90","","5557.4","1.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Cl18 Fe4 N12 -","- C36 H30 Cl18 Fe4 N12 -","- C144 H120 Cl72 Fe16 N48 -","4","1","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0907","0.0391","","","0.0716","0.0828","","","","","","0.905","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505006","7.5722","0.001","14.332","0.0019","14.787","0.0019","63.068","0.002","86.965","0.002","87.724","0.002","1428.5","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H27 Cl6 Fe N6 O6 -","- C18 H27 Cl6 Fe N6 O6 -","- C36 H54 Cl12 Fe2 N12 O12 -","2","1","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0412","0.029","","","0.0706","0.075","","","","","","1.006","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505007","14.6781","0.0006","14.6781","0.0006","19.0874","0.001","90","","90","","120","","3561.4","0.3","173","2","173","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C18 H15 Cl6 N6 Sb -","- C18 H15 Cl6 N6 Sb -","- C108 H90 Cl36 N36 Sb6 -","6","0.166667","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0203","0.017","","","0.0453","0.0466","","","","","","1.259","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505008","14.7004","0.0012","14.7004","0.0012","19.228","0.002","90","","90","","120","","3598.5","0.6","173","2","173","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C18 H15 Bi Cl6 N6 -","- C18 H15 Bi Cl6 N6 -","- C108 H90 Bi6 Cl36 N36 -","6","0.166667","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0246","0.0183","","","0.0429","0.0451","","","","","","1.069","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505009","14.6022","0.0009","14.6022","0.0009","18.5768","0.0016","90","","90","","120","","3430.3","0.4","100","2","100","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C18 H15 Cl6 Fe N6 -","- C18 H15 Cl6 Fe N6 -","- C108 H90 Cl36 Fe6 N36 -","6","0.166667","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0386","0.037","","","0.1388","0.1391","","","","","","2.667","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505010","9.5743","0.0009","15.4364","0.0016","17.857","0.0017","90","","96.185","0.002","90","","2623.8","0.4","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Cl6 N6 O3 Sb -","- C18 H15 Cl6 N6 O3 Sb -","- C72 H60 Cl24 N24 O12 Sb4 -","4","1","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0707","0.0404","","","0.0743","0.08","","","","","","0.878","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505011","15.1595","0.0002","15.1595","0.0002","19.2129","0.0003","90","","90","","120","","3823.78","0.09","153","2","123","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C36 H30 Bi2 Cl12 N12 O6 -","- C36 H30 Bi2 Cl12 N12 O6 -","- C108 H90 Bi6 Cl36 N36 O18 -","3","0.0833333","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","1.5418","CuKα","","0.0349","0.0261","","","0.0608","0.0637","","","","","","0.944","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505012","6.6316","0.0013","28.981","0.006","12.145","0.002","90","","98.24","0.03","90","","2310.1","0.8","100","2","100","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C18 H15 Cl6 Fe N6 -","- C18 H15 Cl6 Fe N6 -","- C72 H60 Cl24 Fe4 N24 -","4","2","","Podesta, Thomas J.; Orpen, A. Guy","Tris(Pyridinium)Triazine in Crystal Synthesis of 3-Fold Symmetric Structures","Crystal Growth & Design","2005","5","2","681","","10.1021/cg049783g","","","0.71073","MoKα","","0.0592","0.0468","","","0.0879","0.0927","","","","","","1.013","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505013","13.8503","0.0016","12.4517","0.0014","14.106","0.0017","90","","119.247","0.002","90","","2122.6","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H52 Cl2 Cu2 N10 O16 -","- C32 H52 Cl2 Cu2 N10 O16 -","- C64 H104 Cl4 Cu4 N20 O32 -","2","0.5","","Liu, Zhi-Liang; Li,; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping","Oxamido-Bridged Bimetallic Complexes Involving Nitronyl Nitroxide Radical Ligands: Crystal Structure and Magnetic Behavior","Crystal Growth & Design","2005","5","2","783","","10.1021/cg0497851","","","0.71073","MoKα","","0.0472","0.0335","","","0.0826","0.0901","","","","","","1.02","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505014","7.6994","0.0001","12.4931","0.0003","22.1419","0.0004","90","","95.821","0.001","90","","2118.83","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 Cl2 Cu2 N10 O14 -","- C32 H44 Cl2 Cu2 N10 O14 -","- C64 H88 Cl4 Cu4 N20 O28 -","2","0.5","","Liu, Zhi-Liang; Li,; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping","Oxamido-Bridged Bimetallic Complexes Involving Nitronyl Nitroxide Radical Ligands: Crystal Structure and Magnetic Behavior","Crystal Growth & Design","2005","5","2","783","","10.1021/cg0497851","","","0.71073","MoKα","","0.0861","0.0568","","","0.1465","0.172","","","","","","1.164","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505015","23.6774","0.0004","23.6774","0.0004","9.617","0.0002","90","","90","","90","","5391.48","0.17","150","2","150","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C47 H58 Cl2 Cu2 N6 O18 -","- C47 H44 Cl2 Cu2 N6 O17.38 -","- C188 H176 Cl8 Cu8 N24 O69.52 -","4","0.5","","Madalan, Augustin M.; Kravtsov, Victor Ch.; Simonov, Yurii A.; Voronkova, Violeta; Korobchenko, Ludmila; Avarvari, Narcis; Andruh, Marius","A Unique Diamondoid Network Resulting from the Convolution of π−π Stacking and Lipophilic Interactions","Crystal Growth & Design","2005","5","1","45","","10.1021/cg049793h","","","0.71073","MoKα","","0.0891","0.0652","","","0.161","0.1732","","","","","","1.053","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505016","5.123","0.002","6.374","0.001","10.931","0.002","97.9","0.01","99.08","0.02","110.49","0.02","322.93","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","cis-2-aminocyclopentanecarboxylic acid","","- C6 H11 N O2 -","- C6 H11 N O2 -","- C12 H22 N2 O4 -","2","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.54184","CUkα","","0.0692","0.066","","","0.1726","0.1759","","","","","","1.423","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505017","5.16","0.001","6.383","0.001","12.281","0.001","95.11","0.01","100.51","0.01","108.97","0.01","371.29","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","cis-2-aminocyclohexanecarboxylic acid","","- C7 H13 N O2 -","- C7 H13 N O2 -","- C14 H26 N2 O4 -","2","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","0.71073","MOkα","","0.107","0.0486","","","0.1325","0.1519","","","","","","0.856","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505018","5.134","0.001","6.317","0.001","13.468","0.001","101.5","0.01","96.17","0.01","106.25","0.02","404.68","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","cis-2-aminocycloheptanecarboxylic acid","","- C8 H15 N O2 -","- C8 H15 N O2 -","- C16 H30 N2 O4 -","2","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.54184","CUkα","","0.0666","0.0581","","","0.1543","0.1595","","","","","","1.262","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505019","5.397","0.001","6.338","0.001","13.743","0.001","94.49","0.01","98.66","0.01","105.94","0.02","443.31","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","cis-2-aminocyclooctanecarboxylic acid","","- C9 H17 N O2 -","- C9 H17 N O2 -","- C18 H34 N2 O4 -","2","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.54184","CUkα","","0.0472","0.0374","","","0.1228","0.1289","","","","","","1.015","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505020","11.757","0.001","5.159","0.001","12.075","0.001","90","","110.27","0.01","90","","687.04","0.16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-2-aminocyclohex-4-enecarboxylic acid","","- C7 H11 N O2 -","- C7 H11 N O2 -","- C28 H44 N4 O8 -","4","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.5418","CUkα","","0.0403","0.0357","","","0.1424","0.1472","","","","","","1.305","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505021","11.597","0.002","5.64","0.001","13.011","0.001","90","","111.07","0.01","90","","794.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-2-aminocyclohexanecarboxylic acid","","- C7 H13 N O2 -","- C7 H13 N O2 -","- C28 H52 N4 O8 -","4","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.54184","CUkα","","0.038","0.0354","","","0.1459","0.1486","","","","","","1.369","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505022","10.961","0.001","5.448","0.001","12.994","0.001","90","","110.97","0.01","90","","724.55","0.17","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-2-aminocyclohex-4-enecarboxylic acid","","- C7 H11 N O2 -","- C7 H11 N O2 -","- C28 H44 N4 O8 -","4","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.54184","CUkα","","0.0472","0.0382","","","0.121","0.1298","","","","","","1.039","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505023","23.387","0.001","6.654","0.001","10.007","0.001","90","","90","","90","","1557.3","0.3","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","3-exo-aminobicyclo[2.2.1]heptane-2-exo-carboxylic acid","","- C8 H13 N O2 -","- C8 H13 N O2 -","- C64 H104 N8 O16 -","8","1","","Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs.","Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers","Crystal Growth & Design","2005","5","2","773","","10.1021/cg0497997","","","1.5418","CUkα","","0.0612","0.0526","","","0.1399","0.1488","","","","","","1.076","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505024","7.7535","0.0003","13.8362","0.0005","14.0188","0.0005","107.763","0.001","98.73","0.001","97.02","0.001","1392.76","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","2,3,6,7,10,11-Hexakis(methylthio)triphenylene bismuth trichloride","","","- C48 H48 Bi2 Cl6 S12 -","- C48 H48 Bi2 Cl6 S12 -","- C48 H48 Bi2 Cl6 S12 -","1","0.5","","Xu, Zhengtao; Li, Kunhao; Fettinger, James C.; Li, Jing; King, Michael M.","A Semiconductive Coordination Network Based on 2,3,6,7,10,11-Hexakis(methylthio)triphenylene and BiCl3","Crystal Growth & Design","2005","5","2","423","","10.1021/cg049817k","","","0.71073","mokα","","0.0229","0.0197","","","0.046","0.0476","","","","","","1.064","","","","has coordinates","278158","2022-09-26","15:28:11",""
"4505025","7.5608","0.0004","13.0954","0.0007","13.7926","0.0007","115.964","0.001","96.603","0.001","100.919","0.001","1174.88","0.11","173","2","173","2","","","","","","","","3","P -1","-P 1","2","2,3,6,7,10,11-Hexakis(methylthio)triphenylene","","","- C24 H24 S6 -","- C24 H24 S6 -","- C48 H48 S12 -","2","1","","Xu, Zhengtao; Li, Kunhao; Fettinger, James C.; Li, Jing; King, Michael M.","A Semiconductive Coordination Network Based on 2,3,6,7,10,11-Hexakis(methylthio)triphenylene and BiCl3","Crystal Growth & Design","2005","5","2","423","","10.1021/cg049817k","","","0.71073","MoKα","","0.0546","0.0452","","","0.1202","0.1265","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505026","18.3445","0.0011","9.5239","0.0006","17.1652","0.0011","90","","94.466","0.001","90","","2989.8","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H30 N2 O -","- C39 H30 N2 O -","- C156 H120 N8 O4 -","4","1","","Wong, Ken-Tsung; Liao, Yuan-Li; Peng, Ying-Chu; Wang, Chih-Chieh; Lin, Sue-Yi; Yang, Cheng-Han; Tseng, Shih-Min; Lee, Gene-Hsiang; Peng, Shie-Ming","A Novel Right-Angled Ligand that Forms Polymeric Metal−Organic Frameworks with Nanometer-Sized Square Cavities","Crystal Growth & Design","2005","5","2","667","","10.1021/cg049822o","","","0.71073","MoKα","","0.1704","0.0974","","","0.3001","0.3272","","","","","","1.231","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505027","25.7092","0.0012","14.4164","0.0006","15.6865","0.0007","90","","109.22","0.002","90","","5489.9","0.4","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C71 H49 Ag B F4 N4 O -","- C71 H49 Ag B F4 N4 O -","- C284 H196 Ag4 B4 F16 N16 O4 -","4","0.5","","Wong, Ken-Tsung; Liao, Yuan-Li; Peng, Ying-Chu; Wang, Chih-Chieh; Lin, Sue-Yi; Yang, Cheng-Han; Tseng, Shih-Min; Lee, Gene-Hsiang; Peng, Shie-Ming","A Novel Right-Angled Ligand that Forms Polymeric Metal−Organic Frameworks with Nanometer-Sized Square Cavities","Crystal Growth & Design","2005","5","2","667","","10.1021/cg049822o","","","0.71073","MoKα","","0.1236","0.0677","","","0.1774","0.2136","","","","","","1.022","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505028","8.2068","0.0008","12.7017","0.0014","13.3725","0.0014","94.106","0.002","99.216","0.002","94.645","0.002","1366.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H10 N8 O6 -","- C10 H10 N8 O6 -","- C40 H40 N32 O24 -","4","2","","Zhang, Xiu-Lian; Chen, Xiao-Ming","Supramolecular Architectures and Helical Water Chains in Cocrystals of Melamine and Aromatic Carboxylic Acids","Crystal Growth & Design","2005","5","2","617","","10.1021/cg0498251","","","0.71073","MoKα","","0.1014","0.067","","","0.1624","0.1891","","","","","","1.005","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505029","6.7992","0.0008","20.156","0.002","7.0861","0.0008","90","","93.366","0.002","90","","969.44","0.19","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 N6 O3 -","- C7 H11 N6 O3 -","- C28 H44 N24 O12 -","4","1","","Zhang, Xiu-Lian; Chen, Xiao-Ming","Supramolecular Architectures and Helical Water Chains in Cocrystals of Melamine and Aromatic Carboxylic Acids","Crystal Growth & Design","2005","5","2","617","","10.1021/cg0498251","","","0.71073","MoKα","","0.053","0.0446","","","0.1389","0.1587","","","","","","0.638","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505030","6.928","0.002","11.272","0.004","11.678","0.004","110.157","0.006","103.151","0.006","94.128","0.006","822.3","0.5","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H18 N6 O9 -","- C12 H18 N6 O9 -","- C24 H36 N12 O18 -","2","1","","Zhang, Xiu-Lian; Chen, Xiao-Ming","Supramolecular Architectures and Helical Water Chains in Cocrystals of Melamine and Aromatic Carboxylic Acids","Crystal Growth & Design","2005","5","2","617","","10.1021/cg0498251","","","0.71073","MoKα","","0.0885","0.0596","","","0.1581","0.1823","","","","","","0.909","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505031","13.139","0.003","8.164","0.002","14.947","0.003","90","","93.8","0.03","90","","1599.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 N6 O7 -","- C13 H16 N6 O7 -","- C52 H64 N24 O28 -","4","1","","Zhang, Xiu-Lian; Chen, Xiao-Ming","Supramolecular Architectures and Helical Water Chains in Cocrystals of Melamine and Aromatic Carboxylic Acids","Crystal Growth & Design","2005","5","2","617","","10.1021/cg0498251","","","0.71073","MoKα","","0.0555","0.0527","","","0.1573","0.1614","","","","","","0.976","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505032","9.423","0.0019","17.386","0.004","19.934","0.004","90","","90","","90","","3265.8","1.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H32 Ag2 N10 O8 -","- C27 H32 Ag2 N10 O8 -","- C108 H128 Ag8 N40 O32 -","4","1","","Zhang, Guoqi; Yang, Guoqiang; Chen, Qingqi; Ma, Jin Shi","Novel Network Polymers Formed by Self-Assembly of Silver Nitrate and Pyrrol-2-yl-methyleneamine Ligands with Flexible Spacers","Crystal Growth & Design","2005","5","2","661","","10.1021/cg049833h","","","0.71073","MoKα","","0.0609","0.0423","","","0.0912","0.0964","","","","","","0.938","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505033","11.693","0.002","10.006","0.002","17.434","0.004","90","","102.59","0.03","90","","1990.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H36 Ag2 Cl4 N10 O12 -","- C28 H36 Ag2 Cl4 N10 O12 -","- C56 H72 Ag4 Cl8 N20 O24 -","2","0.5","","Zhang, Guoqi; Yang, Guoqiang; Chen, Qingqi; Ma, Jin Shi","Novel Network Polymers Formed by Self-Assembly of Silver Nitrate and Pyrrol-2-yl-methyleneamine Ligands with Flexible Spacers","Crystal Growth & Design","2005","5","2","661","","10.1021/cg049833h","","","0.71073","MoKα","","0.0459","0.0382","","","0.112","0.1188","","","","","","0.97","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505034","14.354","0.003","14.127","0.003","8.0576","0.0016","90","","101.91","0.03","90","","1598.7","0.6","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H18 Ag N5 O3 -","- C14 H18 Ag N5 O3 -","- C56 H72 Ag4 N20 O12 -","4","1","","Zhang, Guoqi; Yang, Guoqiang; Chen, Qingqi; Ma, Jin Shi","Novel Network Polymers Formed by Self-Assembly of Silver Nitrate and Pyrrol-2-yl-methyleneamine Ligands with Flexible Spacers","Crystal Growth & Design","2005","5","2","661","","10.1021/cg049833h","","","0.71073","MoKα","","0.0405","0.0358","","","0.0826","0.1016","","","","","","1.059","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505035","14.142","0.004","14.381","0.004","8.033","0.003","90","","101.35","0.02","90","","1601.8","0.9","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H18 Ag N5 O3 -","- C14 H18 Ag N5 O3 -","- C56 H72 Ag4 N20 O12 -","4","1","","Zhang, Guoqi; Yang, Guoqiang; Chen, Qingqi; Ma, Jin Shi","Novel Network Polymers Formed by Self-Assembly of Silver Nitrate and Pyrrol-2-yl-methyleneamine Ligands with Flexible Spacers","Crystal Growth & Design","2005","5","2","661","","10.1021/cg049833h","","","0.71073","MoKα","","0.0361","0.0318","","","0.0827","0.0874","","","","","","1.106","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505036","8.92","0.001","16.524","0.002","9.857","0.001","90","","93.836","0.01","90","","1449.6","0.3","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Remacemide","2-Amino-N-(1-methyl-1,12-diphenylethyl)-acetamide","","- C17 H20 N2 O -","- C17 H20 N2 O -","- C68 H80 N8 O4 -","4","1","","Lewis, Gareth R.; Steele, Gerry; McBride, Lorraine; Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; David, William I. F.; Shankland, Kenneth; Teat, Simon J.","Hydrophobic vs. Hydrophilic: Ionic Competition in Remacemide Salt Structures","Crystal Growth & Design","2005","5","2","427","","10.1021/cg049836u","","","0.71069","MoKα","","0.1188","0.0409","","","0.0953","0.1152","","","","","","0.995","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505037","10.66","0.002","8.712","0.002","17.624","0.003","90","","90.77","0.018","90","","1636.6","0.6","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","remacemide hydrochloride salt","2-Amino-N-(1-methyl-1,12-diphenylethyl)-acetamide hydrochloride","","- C17 H21 Cl N2 O -","- C17 H21 Cl N2 O -","- C68 H84 Cl4 N8 O4 -","4","2","","Lewis, Gareth R.; Steele, Gerry; McBride, Lorraine; Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; David, William I. F.; Shankland, Kenneth; Teat, Simon J.","Hydrophobic vs. Hydrophilic: Ionic Competition in Remacemide Salt Structures","Crystal Growth & Design","2005","5","2","427","","10.1021/cg049836u","","","0.71069","MoKα","","0.0594","0.0344","","","0.084","0.0915","","","","","","1.021","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505038","11.724","0.004","8.932","0.004","15.872","0.004","90","","95.93","0.02","90","","1653.2","1","123","2","123","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","remacemide nitrate","2-Amino-N-(1-methyl-1,12-diphenylethyl)-acetamide nitrate","","- C17 H21 N3 O4 -","- C17 H21 N3 O4 -","- C68 H84 N12 O16 -","4","1","","Lewis, Gareth R.; Steele, Gerry; McBride, Lorraine; Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; David, William I. F.; Shankland, Kenneth; Teat, Simon J.","Hydrophobic vs. Hydrophilic: Ionic Competition in Remacemide Salt Structures","Crystal Growth & Design","2005","5","2","427","","10.1021/cg049836u","","","0.71069","MoKα","","0.1036","0.054","","","0.1386","0.1538","","","","","","1.107","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505039","15.4018","0.0003","6.7683","0.0001","17.3531","0.0003","90","","93.13","0.01","90","","1806.26","0.06","130","","130","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","remacemide acetate","2-Amino-N-(1-methyl-1,12-diphenylethyl)-acetamide acetate","","- C18 H24 N2 O3 -","- C19 H24 N2 O3 -","- C76 H96 N8 O12 -","4","1","","Lewis, Gareth R.; Steele, Gerry; McBride, Lorraine; Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; David, William I. F.; Shankland, Kenneth; Teat, Simon J.","Hydrophobic vs. Hydrophilic: Ionic Competition in Remacemide Salt Structures","Crystal Growth & Design","2005","5","2","427","","10.1021/cg049836u","powder diffraction","","0.850747","","","","","","","","","","","2.21","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505040","9.7297","0.0004","14.4323","0.0003","19.4269","0.0004","104.859","0.002","90.49","0.002","95.546","0.002","2622.82","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","remacemide napsilate","2-Amino-N-(1-methyl-1,12-diphenylethyl)-acetamide naphthalene-2-sulphonate","","- C27.77 H31.35 N2 O4.9 S -","- C27.791 H31.373 N2 O4.8955 S -","- C111.164 H125.492 N8 O19.582 S4 -","4","2","","Lewis, Gareth R.; Steele, Gerry; McBride, Lorraine; Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; David, William I. F.; Shankland, Kenneth; Teat, Simon J.","Hydrophobic vs. Hydrophilic: Ionic Competition in Remacemide Salt Structures","Crystal Growth & Design","2005","5","2","427","","10.1021/cg049836u","","","0.6892","synchrotron","","0.0731","0.0543","","","0.1475","0.1562","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505041","11.9187","0.001","31.801","0.003","7.9304","0.0007","90","","128.382","0.002","90","","2356.2","0.4","150","2","150","2","","","","","","","","4","C 1 c 1","C -2yc","9","remacemide xinafoate","2-Amino-N-(1-methyl-1,12-diphenylethyl)-acetamide 1-hydroxynaphthalene-2-carboxylate","","- C28 H28 N2 O4 -","- C28 H28 N2 O4 -","- C112 H112 N8 O16 -","4","1","","Lewis, Gareth R.; Steele, Gerry; McBride, Lorraine; Florence, Alastair J.; Kennedy, Alan R.; Shankland, Norman; David, William I. F.; Shankland, Kenneth; Teat, Simon J.","Hydrophobic vs. Hydrophilic: Ionic Competition in Remacemide Salt Structures","Crystal Growth & Design","2005","5","2","427","","10.1021/cg049836u","","","0.6892","synchrotron","","0.0619","0.0494","","","0.1206","0.1234","","","","","","1.162","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505042","11.419","0.003","10.29","0.002","15.695","0.005","90","","96.052","0.005","90","","1833.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17.5 H13 Co N3 O4.5 -","- C17.5 H11 Co N3 O4.5 -","- C70 H44 Co4 N12 O18 -","4","1","","Ghosh, Sujit K.; Ribas, Joan; Bharadwaj, Parimal K.","Characterization of 3-D Metal−Organic Frameworks Formed through Hydrogen Bonding Interactions of 2-D Networks with Rectangular Voids by CoII- and NiII-Pyridine-2,6-dicarboxylate and 4,4‘-Bipyridine or 1,2-Di(pyridyl)ethylene","Crystal Growth & Design","2005","5","2","623","","10.1021/cg049838e","","","0.71069","MoKα","","0.079","0.046","","","0.1253","0.1397","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505043","11.249","0.005","10.277","0.002","15.607","0.005","90","","97.916","0.005","90","","1787.1","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17.5 H13 N3 Ni O4.5 -","- C17.5 H11 N3 Ni O4.5 -","- C70 H44 N12 Ni4 O18 -","4","1","","Ghosh, Sujit K.; Ribas, Joan; Bharadwaj, Parimal K.","Characterization of 3-D Metal−Organic Frameworks Formed through Hydrogen Bonding Interactions of 2-D Networks with Rectangular Voids by CoII- and NiII-Pyridine-2,6-dicarboxylate and 4,4‘-Bipyridine or 1,2-Di(pyridyl)ethylene","Crystal Growth & Design","2005","5","2","623","","10.1021/cg049838e","","","0.71069","MoKα","","0.1322","0.0584","","","0.1548","0.1916","","","","","","0.99","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505044","8.915","0.002","19.844","0.006","15.799","0.005","90","","96.083","0.005","90","","2779.3","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 N4 Ni O13 -","- C26 H28 N4 Ni O13 -","- C104 H112 N16 Ni4 O52 -","4","1","","Ghosh, Sujit K.; Ribas, Joan; Bharadwaj, Parimal K.","Characterization of 3-D Metal−Organic Frameworks Formed through Hydrogen Bonding Interactions of 2-D Networks with Rectangular Voids by CoII- and NiII-Pyridine-2,6-dicarboxylate and 4,4‘-Bipyridine or 1,2-Di(pyridyl)ethylene","Crystal Growth & Design","2005","5","2","623","","10.1021/cg049838e","","","0.71069","MoKα","","0.0599","0.0391","","","0.0999","0.1169","","","","","","1.1","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505045","7.348","0.002","11.388","0.002","24.295","0.005","90","","90","","90","","2033","0.8","293","2","293","2","","","","","","","see text","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 Cu2 N2 O8 -","- C18 H22 Cu2 N2 O8 -","- C72 H88 Cu8 N8 O32 -","4","1","","Yang, Xiandong; Wu, Daqing; Ranford, John D.; Vittal, Jagadese J.","Influence of the CO···π Interaction on the Thermal Dehydration Behavior of [Cu2(sgly)2(H2O)]·1H2O†","Crystal Growth & Design","2005","5","1","41","","10.1021/cg0498406","","","0.71073","MoKα","","0.068","0.0382","","","0.0673","0.0771","","","","","","0.927","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505046","9.6337","0.0012","15.2001","0.0019","19.6","0.002","90","","97.71","0.002","90","","2844.1","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H88 B2 N4 O16 -","- C54 H88 B2 N4 O16 -","- C108 H176 B4 N8 O32 -","2","0.5","","Rodríguez-Cuamatzi, Patricia; Arillo-Flores, Oscar I.; Bernal-Uruchurtu, Margarita I.; Höpfl, Herbert","Theoretical and Experimental Evaluation of Homo- and Heterodimeric Hydrogen-Bonded Motifs Containing Boronic Acids, Carboxylic Acids, and Carboxylate Anions: Application for the Generation of Highly Stable Hydrogen-Bonded Supramolecular Systems","Crystal Growth & Design","2005","5","1","167","","10.1021/cg0498453","","","0.71073","MoKα","","0.0682","0.0607","","","0.12","0.1235","","","","","","1.237","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505047","8.64","0.0014","21.251","0.003","9.6811","0.0016","90","","112.105","0.003","90","","1646.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 B N O9 -","- C14 H14 B N O9 -","- C56 H56 B4 N4 O36 -","4","1","","Rodríguez-Cuamatzi, Patricia; Arillo-Flores, Oscar I.; Bernal-Uruchurtu, Margarita I.; Höpfl, Herbert","Theoretical and Experimental Evaluation of Homo- and Heterodimeric Hydrogen-Bonded Motifs Containing Boronic Acids, Carboxylic Acids, and Carboxylate Anions: Application for the Generation of Highly Stable Hydrogen-Bonded Supramolecular Systems","Crystal Growth & Design","2005","5","1","167","","10.1021/cg0498453","","","0.71073","MoKα","","0.1161","0.0666","","","0.1206","0.1396","","","","","","1.081","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505048","8.4979","0.0012","9.8102","0.0013","11.5937","0.0016","68.788","0.002","69.65","0.002","83.611","0.002","844.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 B N O10 -","- C14 H16 B N O10 -","- C28 H32 B2 N2 O20 -","2","1","","Rodríguez-Cuamatzi, Patricia; Arillo-Flores, Oscar I.; Bernal-Uruchurtu, Margarita I.; Höpfl, Herbert","Theoretical and Experimental Evaluation of Homo- and Heterodimeric Hydrogen-Bonded Motifs Containing Boronic Acids, Carboxylic Acids, and Carboxylate Anions: Application for the Generation of Highly Stable Hydrogen-Bonded Supramolecular Systems","Crystal Growth & Design","2005","5","1","167","","10.1021/cg0498453","","","0.71073","MoKα","","0.0884","0.0704","","","0.1433","0.1511","","","","","","1.21","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505049","10.5585","0.0011","17.4475","0.0019","16.253","0.0017","90","","91.315","0.002","90","","2993.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H48 B N O4 -","- C29 H48 B N O4 -","- C116 H192 B4 N4 O16 -","4","1","","Rodríguez-Cuamatzi, Patricia; Arillo-Flores, Oscar I.; Bernal-Uruchurtu, Margarita I.; Höpfl, Herbert","Theoretical and Experimental Evaluation of Homo- and Heterodimeric Hydrogen-Bonded Motifs Containing Boronic Acids, Carboxylic Acids, and Carboxylate Anions: Application for the Generation of Highly Stable Hydrogen-Bonded Supramolecular Systems","Crystal Growth & Design","2005","5","1","167","","10.1021/cg0498453","","","0.71073","MoKα","","0.1487","0.0913","","","0.168","0.1888","","","","","","1.255","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505050","8.4176","0.0005","10.3212","0.0006","11.3471","0.0006","73.459","0.002","68.572","0.002","72.099","0.002","856.56","0.09","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 Co N2 O6 -","- C16 H20 Co N2 O6 -","- C32 H40 Co2 N4 O12 -","2","1","","Ang, Siau Gek; Sun, Bai Wang","Crystal Structure and Characterization of Organic−Inorganic Hybridized Molecules with Molecular Zipper Structures and Two-Dimensional Grid Networks","Crystal Growth & Design","2005","5","1","383","","10.1021/cg049847n","","","0.71073","MoKα","","0.0482","0.0417","","","0.104","0.1074","","","","","","1.066","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505051","5.4016","0.0011","7.3711","0.0016","9.823","0.002","86.412","0.004","84.113","0.004","72.99","0.004","371.81","0.13","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 N2 O8 Zn -","- C14 H16 N2 O8 Zn -","- C14 H16 N2 O8 Zn -","1","0.5","","Ang, Siau Gek; Sun, Bai Wang","Crystal Structure and Characterization of Organic−Inorganic Hybridized Molecules with Molecular Zipper Structures and Two-Dimensional Grid Networks","Crystal Growth & Design","2005","5","1","383","","10.1021/cg049847n","","","0.71073","MoKα","","0.0264","0.0259","","","0.0668","0.0671","","","","","","1.084","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4505052","5.4059","0.0003","7.2938","0.0003","9.9853","0.0004","86.549","0.002","84.745","0.002","73.427","0.002","375.53","0.03","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Mn N2 O8 -","- C14 H16 Mn N2 O8 -","- C14 H16 Mn N2 O8 -","1","0.5","","Ang, Siau Gek; Sun, Bai Wang","Crystal Structure and Characterization of Organic−Inorganic Hybridized Molecules with Molecular Zipper Structures and Two-Dimensional Grid Networks","Crystal Growth & Design","2005","5","1","383","","10.1021/cg049847n","","","0.71073","MoKα","","0.0305","0.0299","","","0.0835","0.0841","","","","","","1.107","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505053","6.7947","0.0002","11.6963","0.0002","19.9102","0.0003","90","","90","","90","","1582.32","0.06","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C6 H18 B2 Ge3 N2 O11 -","- C6 H18 B2 Ge3 N2 O11 -","- C24 H72 B8 Ge12 N8 O44 -","4","0.5","","Wang, Guo-Ming; Sun, Yan-Qiong; Yang, Guo-Yu","Syntheses and Structures of Two New Organically Templated Borogermanates","Crystal Growth & Design","2005","5","1","313","","10.1021/cg049872t","","","0.71073","MoKα","","0.0397","0.0374","","","0.0836","0.0847","","","","","","1.167","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505054","6.8736","0.0002","11.7423","0.0003","27.6476","0.0002","90","","90","","90","","2231.49","0.09","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C10 H31 B2 Ge3 N4 O12.5 -","- C10 H20 B2 Ge3 N4 O12.5 -","- C40 H80 B8 Ge12 N16 O50 -","4","0.5","","Wang, Guo-Ming; Sun, Yan-Qiong; Yang, Guo-Yu","Syntheses and Structures of Two New Organically Templated Borogermanates","Crystal Growth & Design","2005","5","1","313","","10.1021/cg049872t","","","0.71073","MoKα","","0.038","0.0357","","","0.0856","0.0871","","","","","","1.13","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505055","9.006","0.002","9.006","0.002","5.6627","0.0018","90","","90","","90","","459.3","0.2","293","2","293","2","","","","","","","","7","P -4","P -4","81","","","","- C12 H16 Ag B F4 N4 O2 -","- C12 H16 Ag B F4 N4 O2 -","- C12 H16 Ag B F4 N4 O2 -","1","0.25","","Zhang, Jian; Li, Zhao-Ji; Kang, Yao; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen","Syntheses and Characterizations of Two Novel Silver(I) Complexes Constructed by Oxydipropionitrile Ligand","Crystal Growth & Design","2005","5","1","73","","10.1021/cg0498756","","","0.71073","MoKα","","","0.0506","","","0.1412","0.1498","","","","","","1.082","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505056","9.1699","0.001","9.1699","0.001","11.0088","0.0017","90","","90","","90","","925.7","0.2","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C12 H16 Ag Cl N4 O6 -","- C12 H16 Ag Cl N4 O6 -","- C24 H32 Ag2 Cl2 N8 O12 -","2","0.25","","Zhang, Jian; Li, Zhao-Ji; Kang, Yao; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen","Syntheses and Characterizations of Two Novel Silver(I) Complexes Constructed by Oxydipropionitrile Ligand","Crystal Growth & Design","2005","5","1","73","","10.1021/cg0498756","","","0.71073","MoKα","","","0.0371","","","0.101","0.1059","","","","","","1.048","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505057","9.289","0.0013","9.289","0.0013","25.028","0.005","90","","90","","90","","2159.6","0.6","193","2","193","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","3,3,3',3'-tetra(2-hydroxyethyl)-1,1'-isophthaloylbis(thiourea)","","- C18 H26 N4 O6 S2 -","- C18 H26 N4 O6 S2 -","- C72 H104 N16 O24 S8 -","4","0.5","","Bourne, Susan A.; Hallale, Oren; Koch, Klaus R.","Hydrogen-Bonding Networks in a Bipodal Acyl-thiourea and Its NiII2:2 Metallamacrocyclic Complex","Crystal Growth & Design","2005","5","1","307","","10.1021/cg049877q","","","0.71073","MoKα","","0.0287","0.0266","","","0.0736","0.0753","","","","","","1.026","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505058","9.4807","0.0019","12.993","0.003","18.474","0.004","97.3","0.03","100.3","0.03","100.52","0.03","2171.2","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","cis-[Ni(L-S,O)(pyridine)2]2. pyridine/water solvate","","- C81 H86 N17 Ni2 O14 S4 -","- C81 H86 N17 Ni2 O14 S4 -","- C81 H86 N17 Ni2 O14 S4 -","1","0.5","","Bourne, Susan A.; Hallale, Oren; Koch, Klaus R.","Hydrogen-Bonding Networks in a Bipodal Acyl-thiourea and Its NiII2:2 Metallamacrocyclic Complex","Crystal Growth & Design","2005","5","1","307","","10.1021/cg049877q","","","0.71073","MoKα","","0.089","0.0508","","","0.1185","0.1345","","","","","","1.036","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505059","18.077","0.006","6.857","0.002","13.266","0.004","90","","95.271","0.004","90","","1637.4","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- B5 H2 K2 O9.5 -","- B5 H2 K2 O9.5 -","- B40 H16 K16 O76 -","8","1","","Zhang, Hong-Xia; Zhang, Jie; Zheng, Shou-Tian; Yang, Guo-Yu","Two New Potassium Borates, K4B10O15(OH)4with Stepped Chain and KB5O7(OH)2·H2O with Double Helical Chain","Crystal Growth & Design","2005","5","1","157","","10.1021/cg049888j","","","0.71073","MoKα","","0.0246","0.0234","","","0.0633","0.0641","","","","","","1.123","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505060","9.4824","0.0008","7.518","0.0006","11.4154","0.0006","90","","97.277","0.003","90","","807.23","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- B5 H4 K O10 -","- B5 H4 K O10 -","- B20 H16 K4 O40 -","4","1","","Zhang, Hong-Xia; Zhang, Jie; Zheng, Shou-Tian; Yang, Guo-Yu","Two New Potassium Borates, K4B10O15(OH)4with Stepped Chain and KB5O7(OH)2·H2O with Double Helical Chain","Crystal Growth & Design","2005","5","1","157","","10.1021/cg049888j","","","0.71073","MoKα","","0.0677","0.0502","","","0.1271","0.1402","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505061","10.781","0.002","10.885","0.002","12.781","0.003","96.91","0.03","110.33","0.03","103.73","0.03","1332","0.6","293","2","293","2","","","","","","","","7","P 1","P 1","1","","","","- C30 H27 Cu3 Mo11 N6 O39 P -","- C30 H26 Cu3 Mo11 N6 O39 P -","- C30 H26 Cu3 Mo11 N6 O39 P -","1","1","","Lu, Ying; Xu, Yan; Wang, Enbo; Lü, Jian; Hu, Changwen; Xu, Lin","Novel Two-Dimensional Network Constructed from Polyoxomolybdate Chains Linked through Copper−Organonitrogen Coordination Polymer Chains: Hydrothermal Synthesis and Structure of [H2bpy][Cu(4,4‘-bpy)]2[HPCuMo11O39]","Crystal Growth & Design","2005","5","1","257","","10.1021/cg0498960","","","0.71073","MoKα","","0.0643","0.058","","","0.1606","0.1714","","","","","","1.077","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505062","17.1433","0.0006","33.3982","0.0011","18.4415","0.0006","90","","111.875","0.001","90","","9798.5","0.6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Cl2 Cu2 K La N2 O16 -","- C12 H12 Cl2 Cu2 K La N2 O16 -","- C192 H192 Cl32 Cu32 K16 La16 N32 O256 -","16","4","","Kou, Hui-Zhong; Jiang, Yun-Bo; Cui, Ai-Li","Two-Dimensional Coordination Polymers Exhibiting Antiferromagnetic Gd(III)−Cu(II) Coupling","Crystal Growth & Design","2005","5","1","77","","10.1021/cg049897s","","","0.71073","MoKα","","0.0739","0.0511","","","0.111","0.1211","","","","","","1.027","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505063","17.107","0.006","33.19","0.011","18.151","0.006","90","","111.534","0.005","90","","9586","6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Cl2 Cu2 Gd K N2 O16 -","- C12 H12 Cl2 Cu2 Gd K N2 O16.25 -","- C192 H192 Cl32 Cu32 Gd16 K16 N32 O260 -","16","4","","Kou, Hui-Zhong; Jiang, Yun-Bo; Cui, Ai-Li","Two-Dimensional Coordination Polymers Exhibiting Antiferromagnetic Gd(III)−Cu(II) Coupling","Crystal Growth & Design","2005","5","1","77","","10.1021/cg049897s","","","0.71073","MoKα","","0.1073","0.056","","","0.1059","0.1233","","","","","","1","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505064","16.9052","0.0006","32.537","0.001","18.1468","0.0006","90","","112.544","0.001","90","","9218.8","0.5","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Cl2 Cu2 Gd N2 Na O16 -","- C12 H12 Cl2 Cu2 Gd N2 Na O16 -","- C192 H192 Cl32 Cu32 Gd16 N32 Na16 O256 -","16","4","","Kou, Hui-Zhong; Jiang, Yun-Bo; Cui, Ai-Li","Two-Dimensional Coordination Polymers Exhibiting Antiferromagnetic Gd(III)−Cu(II) Coupling","Crystal Growth & Design","2005","5","1","77","","10.1021/cg049897s","","","0.71073","MoKα","","0.1248","0.0871","","","0.1833","0.202","","","","","","1.066","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505065","13.9822","0.0005","13.9822","0.0005","53.094","0.004","90","","90","","120","","8989.3","0.8","298","2","298","2","","","","","","","","2","R -3 :H","-R 3","148","1,1,1,6,6,6-hexaphenyl-2,4-hexadiyne","","","- C42 H30 -","- C42 H30 -","- C504 H360 -","12","0.666667","","Karlen, Steven D.; Khan, Saeed I.; Garcia-Garibay, Miguel A.","Removal of Conflicting Molecular Symmetries Restores a Hexagonal Array of Six-Fold Phenyl Embraces in a bis(Trityl)-Containing Compound. I. Crystals of 1,1,1,6,6,6-Hexaphenyl-2,4-hexadiyne","Crystal Growth & Design","2005","5","1","53","","10.1021/cg049898k","","","0.71073","MoKα","","0.1123","0.0477","","","0.116","0.1415","","","","","","1","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505066","11.3366","0.001","15.3829","0.001","11.1085","0.001","90","","91.398","0.01","90","","1936.6","0.3","293","2","293","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H K O8 Zn0.5 -","- C5 H K O8 Zn0.5 -","- C40 H8 K8 O64 Zn4 -","8","1","","Lu, Kuang-Lieh; Chen, Yen-Fu; Liu, Yen-Hsiang; Cheng, Yi-Wei; Liao, Rong-Tang; Wen, Yuh-Sheng","Bottom-Up Crystal Engineering toward Nanoporosity Exemplified by a Zinc Carboxylate Coordination Polymer Adopting a Tenorite Analogue Network Topology","Crystal Growth & Design","2005","5","2","403","","10.1021/cg049908h","","x-ray","0.71073","MoKα","","0.0577","0.0391","","","0.1052","0.1156","","","","","","1.058","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505067","9.753","0.002","10.353","0.002","17.208","0.003","90","","99.79","0.03","90","","1712.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 N3 O5 S -","- C16 H17 N3 O5 S -","- C64 H68 N12 O20 S4 -","4","1","","Biradha, Kumar; Mahata, Goutam","A 3D-Honeycomb Network with Unique Encapsulation of Dimers of 1D-Chains","Crystal Growth & Design","2005","5","1","49","","10.1021/cg0499257","","","0.71073","MoKα","","0.1397","0.064","","","0.148","0.2033","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505068","9.521","0.0019","19.944","0.004","26.149","0.005","90","","90","","90","","4965.4","1.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H24 N2 O6 S2 -","- C24 H24 N2 O6 S2 -","- C192 H192 N16 O48 S16 -","8","1","","Biradha, Kumar; Mahata, Goutam","A 3D-Honeycomb Network with Unique Encapsulation of Dimers of 1D-Chains","Crystal Growth & Design","2005","5","1","49","","10.1021/cg0499257","","","0.71073","MoKα","","0.1326","0.0687","","","0.1715","0.2195","","","","","","1.017","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505069","11.7633","0.0019","9.5108","0.0015","16.581","0.003","90","","92.208","0.004","90","","1853.7","0.5","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H28 Ba Cr2 N4 O22 -","- C28 H16 Ba Cr2 N4 O22 -","- C56 H32 Ba2 Cr4 N8 O44 -","2","0.5","","Marinescu, Gabriela; Andruh, Marius; Julve, Miguel; Lloret, Francesc; Llusar, Rosa; Uriel, Santiago; Vaissermann, Jacqueline","Heteropolymetallic Supramolecular Solid-State Architectures Constructed from [Cr(AA)(C2O4)2]-Tectons, and Sustained by Coordinative, Hydrogen Bond and π−π Stacking Interactions (AA = 2,2‘-Bipyridine; 1,10-Phenanthroline)","Crystal Growth & Design","2005","5","1","261","","10.1021/cg049944g","","","0.71073","MoKα","","0.0585","0.0344","","","0.0874","0.094","","","","","","0.955","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505070","7.7608","0.0012","21.176","0.004","21.462","0.004","90","","99.52","0.004","90","","3478.5","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H20 Ba Cr2 N4 O18 -","- C32 H18 Ba Cr2 N4 O18 -","- C128 H72 Ba4 Cr8 N16 O72 -","4","1","","Marinescu, Gabriela; Andruh, Marius; Julve, Miguel; Lloret, Francesc; Llusar, Rosa; Uriel, Santiago; Vaissermann, Jacqueline","Heteropolymetallic Supramolecular Solid-State Architectures Constructed from [Cr(AA)(C2O4)2]-Tectons, and Sustained by Coordinative, Hydrogen Bond and π−π Stacking Interactions (AA = 2,2‘-Bipyridine; 1,10-Phenanthroline)","Crystal Growth & Design","2005","5","1","261","","10.1021/cg049944g","","","0.71073","MoKα","","0.0842","0.0424","","","0.0881","0.1002","","","","","","0.968","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505071","11.401","0.004","9.943","0.003","19.681","0.006","90","","103.5","0.01","90","","2169.4","1.2","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(4-(4-hydroxybenzyl)phenol).(4-(4-aminobenzyl)aniline)","","- C26 H26 N2 O2 -","- C26 H26 N2 O2 -","- C104 H104 N8 O8 -","4","1","","Vangala, Venu R.; Mondal, Raju; Broder, Charlotte K.; Howard, Judith A. K.; Desiraju, Gautam R.","Dianiline-Diphenol Molecular Complexes Based on Supraminol Recognition","Crystal Growth & Design","2005","5","1","99","","10.1021/cg049967v","","","0.71073","MoKα","","0.0581","0.0437","","","0.1095","0.1204","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505072","11.2547","0.0011","10.1129","0.0009","19.9982","0.0017","90","","103.654","0.005","90","","2211.8","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4-(4-aminobenzyl)aniline).(4-(4-hydroxyphenylsulfanyl)phenol)","","- C25 H24 N2 O2 S -","- C25 H24 N2 O2 S -","- C100 H96 N8 O8 S4 -","4","1","","Vangala, Venu R.; Mondal, Raju; Broder, Charlotte K.; Howard, Judith A. K.; Desiraju, Gautam R.","Dianiline-Diphenol Molecular Complexes Based on Supraminol Recognition","Crystal Growth & Design","2005","5","1","99","","10.1021/cg049967v","","","0.71073","MoKα","","0.1215","0.0571","","","0.1162","0.1397","","","","","","0.987","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505073","5.2528","0.0001","42.3571","0.0006","9.4214","0.0001","90","","94.801","0.001","90","","2088.84","0.05","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4-(4-hydroxybenzyl)phenol).(4-(4-aminophenylsulfanyl)aniline)","","- C25 H24 N2 O2 S -","- C25 H24 N2 O2 S -","- C100 H96 N8 O8 S4 -","4","1","","Vangala, Venu R.; Mondal, Raju; Broder, Charlotte K.; Howard, Judith A. K.; Desiraju, Gautam R.","Dianiline-Diphenol Molecular Complexes Based on Supraminol Recognition","Crystal Growth & Design","2005","5","1","99","","10.1021/cg049967v","","","0.71073","MoKα","","0.0455","0.0368","","","0.0923","0.0974","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505074","9.909","0.0004","10.27","0.0004","22.01","0.0008","90","","90","","90","","2239.86","0.15","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(4-(4-aminophenylsulfanyl)aniline).(4-(4-hydroxyphenylsulfanyl)phenol)","","- C24 H22 N2 O2 S2 -","- C24 H22 N2 O2 S2 -","- C96 H88 N8 O8 S8 -","4","1","","Vangala, Venu R.; Mondal, Raju; Broder, Charlotte K.; Howard, Judith A. K.; Desiraju, Gautam R.","Dianiline-Diphenol Molecular Complexes Based on Supraminol Recognition","Crystal Growth & Design","2005","5","1","99","","10.1021/cg049967v","","","0.71073","MoKα","","0.0428","0.0369","","","0.0936","0.0965","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505075","14.268","0.0005","12.7763","0.0006","11.8165","0.0001","90","","101.347","0.002","90","","2111.95","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Cu N3 O5 -","- C24 H16 Cu N3 O5 -","- C96 H64 Cu4 N12 O20 -","4","0.5","","Chen, Shu-Mei; Lu, Can-Zhong; Xia, Chang-Kun; Xu, Xin-Jiang; Zhai, Quan-Guo","Reactivity of 1,4-Bis[2-(5-phenyloxazoly)]benzene toward Cu Salts under Different Reaction Conditions","Crystal Growth & Design","2005","5","4","1485","","10.1021/cg050003t","","","0.71073","MoKα","","","0.0496","","","0.1266","0.1401","","","","","","1.048","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505076","3.7498","0.0001","11.5531","0.0005","11.6843","0.0005","89.189","0.005","80.976","0.005","86.25","0.006","498.85","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H8 Cl Cu N O -","- C12 H8 Cl Cu N O -","- C24 H16 Cl2 Cu2 N2 O2 -","2","1","","Chen, Shu-Mei; Lu, Can-Zhong; Xia, Chang-Kun; Xu, Xin-Jiang; Zhai, Quan-Guo","Reactivity of 1,4-Bis[2-(5-phenyloxazoly)]benzene toward Cu Salts under Different Reaction Conditions","Crystal Growth & Design","2005","5","4","1485","","10.1021/cg050003t","","","0.71073","MoKα","","","0.023","","","0.0584","0.0604","","","","","","1.018","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505077","8.3035","0.0002","11.382","","14.0112","0.0001","69.943","0.005","86.895","0.006","74.063","0.005","1194.91","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H44 Cu2 N4 O12 -","- C56 H44 Cu2 N4 O12 -","- C56 H44 Cu2 N4 O12 -","1","0.5","","Chen, Shu-Mei; Lu, Can-Zhong; Xia, Chang-Kun; Xu, Xin-Jiang; Zhai, Quan-Guo","Reactivity of 1,4-Bis[2-(5-phenyloxazoly)]benzene toward Cu Salts under Different Reaction Conditions","Crystal Growth & Design","2005","5","4","1485","","10.1021/cg050003t","","","0.71073","MoKα","","","0.0339","","","0.0865","0.0898","","","","","","1.029","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505078","9.5749","0.0004","10.4852","0.0003","10.83","0.0005","113.688","0.002","94.916","0.002","110.594","0.002","898.77","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H34 Cu3 N2 O14 -","- C36 H34 Cu3 N2 O14 -","- C36 H34 Cu3 N2 O14 -","1","0.5","","Chen, Shu-Mei; Lu, Can-Zhong; Xia, Chang-Kun; Xu, Xin-Jiang; Zhai, Quan-Guo","Reactivity of 1,4-Bis[2-(5-phenyloxazoly)]benzene toward Cu Salts under Different Reaction Conditions","Crystal Growth & Design","2005","5","4","1485","","10.1021/cg050003t","","","0.71073","MoKα","","","0.0808","","","0.1699","0.1949","","","","","","1.115","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505079","9.427","0.002","12.546","0.003","22.514","0.005","99.53","0.03","100.79","0.03","99.37","0.03","2527.4","1.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H58 Mn Mo6 O31 S40 -","- C60 H58 Mn Mo6 O31 S40 -","- C60 H58 Mn Mo6 O31 S40 -","1","0.5","","Liu, Cai-Ming; Huang, Yong-Hong; Zhang, De-Qing; Gao, Song; Jiang, Feng-Chi; Zhang, Jian-Ying; Zhu, Dao-Ben","Bis(ethylenedithio)tetrathiafulvalene Radical Salts with Anderson Type Heteropolymolybdates Containing Tris(alkoxo) Ligands","Crystal Growth & Design","2005","5","4","1531","","10.1021/cg050004l","","","0.71073","MoKα","","0.1375","0.0487","","","0.1067","0.1488","","","","","","0.675","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505080","9.358","0.002","12.783","0.003","22.492","0.004","99.36","0.03","100.82","0.03","101.07","0.03","2537.9","1.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H50 Mn Mo6 N2 O24 S40 -","- C66 H50 Mn Mo6 N2 O24 S40 -","- C66 H50 Mn Mo6 N2 O24 S40 -","1","0.5","","Liu, Cai-Ming; Huang, Yong-Hong; Zhang, De-Qing; Gao, Song; Jiang, Feng-Chi; Zhang, Jian-Ying; Zhu, Dao-Ben","Bis(ethylenedithio)tetrathiafulvalene Radical Salts with Anderson Type Heteropolymolybdates Containing Tris(alkoxo) Ligands","Crystal Growth & Design","2005","5","4","1531","","10.1021/cg050004l","","","0.71073","MoKα","","0.19","0.0657","","","0.1463","0.1985","","","","","","0.727","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505081","9.0712","0.0018","15.977","0.003","21.698","0.004","70.01","0.03","84.35","0.03","88.29","0.03","2940.9","1.1","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C70 H64 Cl4 Mn Mo6 N2 O24 S48 -","- C70 H64 Cl4 Mn Mo6 N2 O24 S48 -","- C70 H64 Cl4 Mn Mo6 N2 O24 S48 -","1","0.5","","Liu, Cai-Ming; Huang, Yong-Hong; Zhang, De-Qing; Gao, Song; Jiang, Feng-Chi; Zhang, Jian-Ying; Zhu, Dao-Ben","Bis(ethylenedithio)tetrathiafulvalene Radical Salts with Anderson Type Heteropolymolybdates Containing Tris(alkoxo) Ligands","Crystal Growth & Design","2005","5","4","1531","","10.1021/cg050004l","","","0.71073","MoKα","","0.2251","0.0977","","","0.1562","0.2056","","","","","","0.975","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505082","8.4833","0.0014","12.478","0.002","8.5116","0.0014","90","","110.844","0.003","90","","842","0.2","383","2","383","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 N O6 P -","- C6 H8 N O6 P -","- C24 H32 N4 O24 P4 -","4","1","","Kong, Deyuan; Clearfield, Abraham","Supramolecular Hydrogen-Bonded Frameworks from 6-Phosphonopyridine-2-carboxylic Acid and Transition Metal Ions","Crystal Growth & Design","2005","5","3","1263","","10.1021/cg050015e","","","0.71073","MoKα","","0.055","0.0496","","","0.1272","0.1351","","","","","","1.098","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505083","19.9519","0.0018","7.2218","0.0006","25.516","0.002","90","","90","","90","","3676.6","0.5","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C6 H25 N Ni1.5 O16 P -","- C6 H25 N Ni1.5 O16 P -","- C48 H200 N8 Ni12 O128 P8 -","8","1","","Kong, Deyuan; Clearfield, Abraham","Supramolecular Hydrogen-Bonded Frameworks from 6-Phosphonopyridine-2-carboxylic Acid and Transition Metal Ions","Crystal Growth & Design","2005","5","3","1263","","10.1021/cg050015e","","","0.71073","MoKα","","0.0665","0.0611","","","0.1499","0.1591","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505084","8.1235","0.0005","14.9124","0.001","15.5084","0.001","90","","100.571","0.001","90","","1846.8","0.2","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 Cu N2 O13 P2 -","- C12 H16 Cu N2 O13 P2 -","- C48 H64 Cu4 N8 O52 P8 -","4","1","","Kong, Deyuan; Clearfield, Abraham","Supramolecular Hydrogen-Bonded Frameworks from 6-Phosphonopyridine-2-carboxylic Acid and Transition Metal Ions","Crystal Growth & Design","2005","5","3","1263","","10.1021/cg050015e","","","0.71073","MoKα","","0.0451","0.0414","","","0.1057","0.1096","","","","","","1.122","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505085","7.292","0.004","8.255","0.004","10.055","0.005","97.329","0.008","90.552","0.008","100.293","0.009","590.3","0.5","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H12 Co N O9 P -","- C6 H12 Co N O9 P -","- C12 H24 Co2 N2 O18 P2 -","2","1","","Kong, Deyuan; Clearfield, Abraham","Supramolecular Hydrogen-Bonded Frameworks from 6-Phosphonopyridine-2-carboxylic Acid and Transition Metal Ions","Crystal Growth & Design","2005","5","3","1263","","10.1021/cg050015e","","","0.71073","MoKα","","0.0829","0.0541","","","0.1189","0.1467","","","","","","1.112","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505086","10.5915","0.0016","10.2446","0.0016","7.5003","0.0011","90","","130.732","0.01","90","","616.69","0.19","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- K Lu O8 W2 -","- K Lu O8 W2 -","- K4 Lu4 O32 W8 -","4","0.5","","Wang, Kunpeng; Zhang, Jianxiu; Wang, Jiyang; Yu, Wentao; Zhang, Huaijin; Wang, Zhengping; Wang, Xuping; Ba, Mingfang","Predicted and Real Habits of Flux Grown Potassium Lutetium Tungstate Single Crystals","Crystal Growth & Design","2005","5","4","1555","","10.1021/cg050019j","","","0.71073","MoKα","","0.0684","0.067","","","0.1622","0.1644","","","","","","1.053","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505087","5.4329","0.0014","17.829","0.005","11.82","0.003","90","","94.361","0.005","90","","1141.6","0.5","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Hydrazinium Cyclohexane-3cis,5cis-dicarboxylic acid-1-carboxylate","","- C9 H16 N2 O6 -","- C9 H16 N2 O6 -","- C36 H64 N8 O24 -","4","1","","Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini","Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate","Crystal Growth & Design","2005","5","3","1271","","10.1021/cg0500270","","","0.71073","MoKα","","0.059","0.0414","","","0.0828","0.0896","","","","","","1.003","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505088","9.2006","0.0014","4.9116","0.0008","21.385","0.003","90","","96.835","0.005","90","","959.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sodium Cyclohexane-3cis,5cis-dicarboxylic acid-1-carboxylate","","- C9 H11 Na O6 -","- C9 H11 Na O6 -","- C36 H44 Na4 O24 -","4","1","","Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini","Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate","Crystal Growth & Design","2005","5","3","1271","","10.1021/cg0500270","","","0.71073","MoKα","","0.0826","0.0421","","","0.0846","0.0946","","","","","","0.936","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505089","7.6682","0.0009","8.4743","0.001","9.5164","0.0012","91.741","0.002","94.436","0.002","97.239","0.002","611.13","0.13","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Ethylammonium Cyclohexane-3cis,5cis-dicarboxylic acid-1-carboxylate","","- C11 H19 N O6 -","- C11 H19 N O6 -","- C22 H38 N2 O12 -","2","1","","Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini","Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate","Crystal Growth & Design","2005","5","3","1271","","10.1021/cg0500270","","","0.71073","MoKα","","0.0444","0.0408","","","0.0987","0.1008","","","","","","1.095","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505090","5.8655","0.0012","17.805","0.004","11.408","0.002","90","","93.7","0.03","90","","1188.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methylammonium cyclohexane-1-carboxylate-3cis,5-cis-dicarboxylic acid","","- C10 H17 N O6 -","- C10 H17 N O6 -","- C40 H68 N4 O24 -","4","1","","Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini","Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate","Crystal Growth & Design","2005","5","3","1271","","10.1021/cg0500270","","","0.71073","MoKα","","0.1551","0.0626","","","0.1087","0.1439","","","","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4505091","5.0737","0.0014","18.203","0.005","11.742","0.003","90","","93.275","0.004","90","","1082.7","0.5","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Hydroxylammonium Cyclohexane-3cis,5cis-dicarboxylic acid-1-carboxylate","","- C9 H15 N O7 -","- C9 H15 N O7 -","- C36 H60 N4 O28 -","4","1","","Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini","Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate","Crystal Growth & Design","2005","5","3","1271","","10.1021/cg0500270","","","0.71073","MoKα","","0.0326","0.0313","","","0.0708","0.0717","","","","","","1.058","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505092","4.7608","0.0011","19.703","0.005","11.502","0.003","90","","90.551","0.004","90","","1078.9","0.5","93","2","93","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Ammonium cyclohexane-1-carboxylate-3cis,5cis-dicarboxylic acid","","- C9 H15 N O6 -","- C9 H15 N O6 -","- C36 H60 N4 O24 -","4","1","","Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini","Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate","Crystal Growth & Design","2005","5","3","1271","","10.1021/cg0500270","","","0.71073","MoKα","","0.0314","0.0309","","","0.0824","0.0828","","","","","","1.03","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4505093","10.3098","0.0019","15.608","0.003","14.243","0.003","90","","101.618","0.003","90","","2245","0.8","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 N3 O9 P3 -","- C21 H21 N3 O9 P3 -","- C84 H84 N12 O36 P12 -","4","1","","Kong, Deyuan; Clearfield, Abraham; Zoń, Jerzy","Crystal-Engineered Three-Dimensional Hydrogen-Bonding Networks Built with 1,3,5-Benzenetri(phosphonic acid) and Bipyridine Synthons","Crystal Growth & Design","2005","5","5","1767","","10.1021/cg050033w","","","0.71073","MoKα","","0.0422","0.0416","","","0.0999","0.1002","","","","","","1.236","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505094","7.2494","0.0018","12.317","0.003","12.528","0.003","84.392","0.004","77.085","0.004","85.179","0.004","1082.9","0.5","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H23 N2 O12 P3 -","- C16 H23 N2 O12 P3 -","- C32 H46 N4 O24 P6 -","2","1","","Kong, Deyuan; Clearfield, Abraham; Zoń, Jerzy","Crystal-Engineered Three-Dimensional Hydrogen-Bonding Networks Built with 1,3,5-Benzenetri(phosphonic acid) and Bipyridine Synthons","Crystal Growth & Design","2005","5","5","1767","","10.1021/cg050033w","","","0.71073","MoKα","","0.0783","0.0674","","","0.1696","0.1845","","","","","","1.132","","","","has coordinates","179585","2020-10-21","18:00:00",""
"4505095","14.268","0.004","5.0065","0.0012","15.557","0.004","90","","90","","90","","1111.3","0.5","298","2","298","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C7 H8 Ag Cl N4 O4 -","- C7 H8 Ag Cl N4 O4 -","- C28 H32 Ag4 Cl4 N16 O16 -","4","0.5","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.0503","0.0357","","","0.0798","0.0866","","","","","","1.07","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505096","12.1263","0.0016","12.1263","0.0016","17.632","0.005","90","","90","","90","","2592.7","0.9","293","2","293","2","","","","","","","","6","P 42/n c m :2","-P 4ac 2ac","138","{[cu2(l)4(h2o)4].cl4.(h2o)5.(aceton)}n","","","- C31 H56 Cl4 Cu2 N16 O10 -","- C31 H34.04 Cl4 Cu2 N16 O10 -","- C62 H68.08 Cl8 Cu4 N32 O20 -","2","0.125","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.1089","0.0586","","","0.1625","0.191","","","","","","1.052","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505097","9","0.002","9.14","0.002","12.421","0.002","90","","91.048","0.003","90","","1021.6","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 B2 Cu F8 N8 O0 -","- C14 H16 B2 Cu F8 N8 -","- C28 H32 B4 Cu2 F16 N16 -","2","0.5","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.06","0.0436","","","0.1134","0.1261","","","","","","1.02","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505098","9.131","0.003","9.253","0.003","12.435","0.004","90","","92.58","0.005","90","","1049.6","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Cl2 Cu N8 O8 -","- C14 H16 Cl2 Cu N8 O8 -","- C28 H32 Cl4 Cu2 N16 O16 -","2","0.5","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.0655","0.047","","","0.1139","0.1244","","","","","","1.026","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505099","12.348","0.005","12.115","0.005","18.837","0.008","90","","100.775","0.006","90","","2768","2","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 Cl2 K0 N12 O8 S0 Zn -","- C21 H24 Cl2 N12 O8 Zn -","- C84 H96 Cl8 N48 O32 Zn4 -","4","0.5","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.0847","0.059","","","0.1432","0.1581","","","","","","1.086","","","","has coordinates,has disorder","179585","2020-10-21","18:00:00",""
"4505100","12.632","0.005","12.136","0.005","18.968","0.008","90","","99.78","0.006","90","","2866","2","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 Cd Cl2 K0 N12 O8 S0 -","- C21 H24 Cd Cl2 N12 O8 -","- C84 H96 Cd4 Cl8 N48 O32 -","4","0.5","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.0559","0.0445","","","0.119","0.129","","","","","","1.047","","","","has coordinates,has disorder","179586","2020-10-21","18:00:00",""
"4505101","16.347","0.006","9.346","0.003","7.156","0.002","90","","111.551","0.004","90","","1016.9","0.6","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C14 H16 Cd N14 O0 -","- C14 H16 Cd N14 -","- C28 H32 Cd2 N28 -","2","0.25","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.0248","0.0246","","","0.0618","0.0619","","","","","","1.119","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505102","15.9751","0.001","15.9751","0.001","21.701","0.003","90","","90","","90","","5538.2","0.9","298","2","298","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C20 H28 Cl2 N8 O8 Zn -","- C20 H28 Cl2 N8 O8 Zn -","- C160 H224 Cl16 N64 O64 Zn8 -","8","0.25","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.0944","0.0797","","","0.2407","0.2593","","","","","","1.133","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505103","12.1263","0.0016","12.1263","0.0016","17.632","0.005","90","","90","","90","","2592.7","0.9","293","2","293","2","","","","","","","","6","P 42/n c m :2","-P 4ac 2ac","138","","","","- C17 H27 Cl2 Cu N8 O3.5 -","- C17 H20 Cl2 Cu N8 O3.5 -","- C68 H80 Cl8 Cu4 N32 O14 -","4","0.25","","Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.","Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands","Crystal Growth & Design","2005","5","5","1775","","10.1021/cg050039l","","","0.71073","MoKα","","0.1111","0.0597","","","0.1448","0.1727","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4505104","36.81","0.03","10.419","0.009","11.955","0.01","90","","90","","90","","4585","7","293","2","293","2","","","","","","","","5","P n n 2","P 2 -2n","34","","","","- C46 H32.5 N6 O8.25 Zn2 -","- C46 H32 N6 O8.25 Zn2 -","- C184 H128 N24 O33 Zn8 -","4","1","","Dai, Yu-Mei; Ma, En; Tang, En; Zhang, Jian; Li, Zhao-Ji; Huang, Xu-Dong; Yao, Yuan-Gen","Paratactic Assembly of Two Distinct Units into a Unique 3D Architecture","Crystal Growth & Design","2005","5","4","1313","","10.1021/cg0500425","","","0.71073","MoKα","","","0.049","","","0.1074","0.1575","","","","","","0.959","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505105","34.238","0.013","12.321","0.005","15.762","0.006","90","","90","","90","","6649","4","223","2","223","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C39 H32 N4 O4 -","- C39 H32 N4 O4 -","- C312 H256 N32 O32 -","8","1","","Jayaraman, Akhila; Balasubramaniam, Venkataramanan; Valiyaveettil, Suresh","Self-Assembly of Tetraphenol and Its Complexes with Aromatic Diamines: Novel Interpenetrating and Noninterpenetrating Organic Assemblies","Crystal Growth & Design","2005","5","4","1575","","10.1021/cg050050l","","","0.71073","MoKα","","0.0896","0.0566","","","0.1165","0.1288","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505106","9.331","0.0012","10.9334","0.0014","20.492","0.003","96.124","0.003","100.397","0.003","110.341","0.003","1895.2","0.4","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H44 N4 O6 -","- C43 H44 N4 O6 -","- C86 H88 N8 O12 -","2","1","","Jayaraman, Akhila; Balasubramaniam, Venkataramanan; Valiyaveettil, Suresh","Self-Assembly of Tetraphenol and Its Complexes with Aromatic Diamines: Novel Interpenetrating and Noninterpenetrating Organic Assemblies","Crystal Growth & Design","2005","5","4","1575","","10.1021/cg050050l","","","0.71073","MoKα","","0.0745","0.0601","","","0.1591","0.1704","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505107","17.86","0.06","7.62","0.03","22.85","0.08","90","","104.25","0.1","90","","3014","19","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H31 N3 O4 -","- C37 H31 N3 O4 -","- C148 H124 N12 O16 -","4","1","","Jayaraman, Akhila; Balasubramaniam, Venkataramanan; Valiyaveettil, Suresh","Self-Assembly of Tetraphenol and Its Complexes with Aromatic Diamines: Novel Interpenetrating and Noninterpenetrating Organic Assemblies","Crystal Growth & Design","2005","5","4","1575","","10.1021/cg050050l","","","0.71073","MoKα","","0.0977","0.0649","","","0.1445","0.1601","","","","","","1.031","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505108","10.0382","0.0014","14.5786","0.0018","10.1183","0.0014","90","","101.79","0.003","90","","1449.5","0.3","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 O4 -","- C19 H16 O4 -","- C76 H64 O16 -","4","1","","Jayaraman, Akhila; Balasubramaniam, Venkataramanan; Valiyaveettil, Suresh","Self-Assembly of Tetraphenol and Its Complexes with Aromatic Diamines: Novel Interpenetrating and Noninterpenetrating Organic Assemblies","Crystal Growth & Design","2005","5","4","1575","","10.1021/cg050050l","","","0.71073","MoKα","","0.058","0.046","","","0.1127","0.1198","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505109","5.2784","0.0014","6.7945","0.0017","10.313","0.003","70.89","0.03","87.74","0.03","70.57","0.03","328.58","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","TTF(CH2OH)4","tetrakis(hydroxylmethyl)tetrathiafulvalene","","- C10 H12 O4 S4 -","- C10 H12 O4 S4 -","- C10 H12 O4 S4 -","1","0.5","","Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick","Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3)","Crystal Growth & Design","2005","5","4","1585","","10.1021/cg0500573","","","0.71073","MoKα","","0.0369","0.0235","","","0.0481","0.0512","","","","","","0.934","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505110","8.8407","0.0008","13.6353","0.0013","14.5467","0.0015","79.118","0.012","82.433","0.012","88.411","0.011","1707","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","TTF(CH2OH)4, Re6S5Cl9, 0.5CH3CN","[TTF(CH2OH)4][Re6S5Cl9](CH3CN)0.5","","- C11 H13.5 Cl9 N0.5 O4 Re6 S9 -","- C11 H12 Cl9 N0.5 O4 Re6 S9 -","- C22 H24 Cl18 N O8 Re12 S18 -","2","1","","Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick","Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3)","Crystal Growth & Design","2005","5","4","1585","","10.1021/cg0500573","","","0.71073","MoKα","","0.0687","0.0374","","","0.0838","0.0926","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505111","9.6045","0.0011","11.7209","0.0013","12.0618","0.0013","62.929","0.012","69.909","0.013","84.735","0.013","1132.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","2 TTF(CH2OH)4, Re6S6Cl8","[TTF(CH2OH)4]2[Re6S6Cl8]","","- C20 H24 Cl8 O8 Re6 S14 -","- C20 H12 Cl8 O8 Re6 S14 -","- C20 H12 Cl8 O8 Re6 S14 -","1","0.5","","Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick","Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3)","Crystal Growth & Design","2005","5","4","1585","","10.1021/cg0500573","","","0.71073","MoKα","","0.0615","0.044","","","0.1003","0.1063","","","","","","1.076","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505112","9.4212","0.0011","12.0528","0.0014","12.1076","0.0016","62.475","0.013","70.948","0.014","84.463","0.014","1150","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","2 TTF(CH2OH)4, Mo6Cl14","[TTF(CH2OH)4]2[Mo6Cl14]","","- C20 H24 Cl14 Mo6 O8 S8 -","- C20 H20 Cl14 Mo6 O8 S8 -","- C20 H20 Cl14 Mo6 O8 S8 -","1","0.5","","Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick","Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3)","Crystal Growth & Design","2005","5","4","1585","","10.1021/cg0500573","","","0.71073","MoKα","","0.0339","0.0271","","","0.0724","0.0743","","","","","","1.04","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505113","12.045","0.002","12.427","0.003","25.76","0.005","91.86","0.03","100","0.03","108.54","0.03","3584.3","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","4(TTF(CH2OH)4), Re6S7Cl7, Cl","[TTF(CH2OH)4]4[Re6S7Cl7]Cl","","- C40 H48 Cl8 O16 Re6 S23 -","- C40 H43 Cl8.04 O16 Re6 S23.04 -","- C80 H86 Cl16.08 O32 Re12 S46.08 -","2","1","","Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick","Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3)","Crystal Growth & Design","2005","5","4","1585","","10.1021/cg0500573","","","0.71073","MoKα","","0.0942","0.0397","","","0.0772","0.0917","","","","","","1","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505114","16.393","0.002","16.393","0.002","26.063","0.005","90","","90","","90","","7003.9","1.8","293","2","293","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","(TTF(CH2OH)4)4, Re6S8Cl6","[TTF(CH2OH)4]4[Re6S8Cl6]","","- C40 H48 Cl6 O16 Re6 S24 -","- C40 H48 Cl6 O16 Re6 S24 -","- C160 H192 Cl24 O64 Re24 S96 -","4","0.25","","Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick","Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3)","Crystal Growth & Design","2005","5","4","1585","","10.1021/cg0500573","","","0.71073","MoKα","","0.0502","0.0245","","","0.044","0.0485","","","","","","1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4505115","35.8","0.004","35.8","0.004","35.8","0.004","90","","90","","90","","45883","9","173","2","173","2","","","","","","","","7","F -4 3 c","F -4a 2 3","219","silver tris(2-pyridylmethyl)cyclotriguaiacylene hexafluorophosphine","","","- C42 H39 Ag1.5 F9 N3 O6 P1.5 -","- C42 H39 Ag1.5 F9.03 N3 O6 P1.5 -","- C1344 H1248 Ag48 F288.96 N96 O192 P48 -","32","0.333333","","Sumby, Christopher J.; Hardie, Michaele J.","Disentangling Disorder in the Three-Dimensional Coordination Network of {Ag3[Tris(2-pyridylmethyl)cyclotriguaiacylene]2}(PF6)3","Crystal Growth & Design","2005","5","4","1321","","10.1021/cg050061e","","","0.71073","MoKα","","0.2193","0.1574","","","0.3641","0.4178","","","","","","2.748","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4505116","17.699","0.003","18.111","0.003","18.844","0.003","111.183","0.002","93.828","0.001","102.13","0.002","5438.6","1.6","93.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 N2 -","- C40 H30 N2 -","- C320 H240 N16 -","8","4","","Kawai, Hidetoshi; Takeda, Takashi; Fujiwara, Kenshu; Inabe, Tamotsu; Suzuki, Takanori","Exceptionally Large Difference in Bond Length among Conformational Isomorphs of a Hexaphenylethane Derivative with a Dispiropyracene Skeleton†","Crystal Growth & Design","2005","5","6","2256","","10.1021/cg050064r","","","0.7107","MoKα","","","0.052","","","","0.12","","","","","","0.721","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505117","17.719","0.002","18.116","0.002","18.852","0.003","111.27","0.002","93.8","0.002","102.006","0.002","5448.8","1.2","123.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 N2 -","- C40 H30 N2 -","- C320 H240 N16 -","8","4","","Kawai, Hidetoshi; Takeda, Takashi; Fujiwara, Kenshu; Inabe, Tamotsu; Suzuki, Takanori","Exceptionally Large Difference in Bond Length among Conformational Isomorphs of a Hexaphenylethane Derivative with a Dispiropyracene Skeleton†","Crystal Growth & Design","2005","5","6","2256","","10.1021/cg050064r","","","0.7107","MoKα","","","0.059","","","","0.125","","","","","","0.576","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505118","17.752","0.004","18.146","0.005","18.871","0.005","111.246","0.005","93.85","0.004","101.827","0.002","5478","2","160.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 N2 -","- C40 H30 N2 -","- C320 H240 N16 -","8","4","","Kawai, Hidetoshi; Takeda, Takashi; Fujiwara, Kenshu; Inabe, Tamotsu; Suzuki, Takanori","Exceptionally Large Difference in Bond Length among Conformational Isomorphs of a Hexaphenylethane Derivative with a Dispiropyracene Skeleton†","Crystal Growth & Design","2005","5","6","2256","","10.1021/cg050064r","","","0.7107","MoKα","","","0.056","","","","0.127","","","","","","0.587","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505119","17.767","0.004","18.158","0.005","18.879","0.005","111.22","0.005","93.872","0.004","101.834","0.002","5490","2","180.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 N2 -","- C40 H30 N2 -","- C320 H240 N16 -","8","4","","Kawai, Hidetoshi; Takeda, Takashi; Fujiwara, Kenshu; Inabe, Tamotsu; Suzuki, Takanori","Exceptionally Large Difference in Bond Length among Conformational Isomorphs of a Hexaphenylethane Derivative with a Dispiropyracene Skeleton†","Crystal Growth & Design","2005","5","6","2256","","10.1021/cg050064r","","","0.7107","MoKα","","","0.058","","","","0.132","","","","","","0.588","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505120","17.814","0.005","18.219","0.006","18.881","0.006","111.085","0.005","94.033","0.005","102.044","0.003","5520","3","233.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 N2 -","- C40 H30 N2 -","- C320 H240 N16 -","8","4","","Kawai, Hidetoshi; Takeda, Takashi; Fujiwara, Kenshu; Inabe, Tamotsu; Suzuki, Takanori","Exceptionally Large Difference in Bond Length among Conformational Isomorphs of a Hexaphenylethane Derivative with a Dispiropyracene Skeleton†","Crystal Growth & Design","2005","5","6","2256","","10.1021/cg050064r","","","0.7107","MoKα","","","0.071","","","","0.163","","","","","","0.569","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505121","9.438","0.002","17.227","0.004","17.804","0.004","74.978","0.009","85.936","0.013","80.331","0.012","2754.9","1.1","233.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H30 N2 -","- C40 H30 N2 -","- C160 H120 N8 -","4","2","","Kawai, Hidetoshi; Takeda, Takashi; Fujiwara, Kenshu; Inabe, Tamotsu; Suzuki, Takanori","Exceptionally Large Difference in Bond Length among Conformational Isomorphs of a Hexaphenylethane Derivative with a Dispiropyracene Skeleton†","Crystal Growth & Design","2005","5","6","2256","","10.1021/cg050064r","","","0.7107","MoKα","","","0.067","","","","0.141","","","","","","0.732","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505122","5.7997","0.0018","15.664","0.005","7.911","0.002","90","","109.729","0.002","90","","676.5","0.3","130.15","","130.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H7 Mn O8 P -","- C2 H7 Mn O8 P -","- C8 H28 Mn4 O32 P4 -","4","1","","Fu, Ruibiao; Xiang, Shengchang; Zhang, Huishuang; Zhang, Jianjun; Wu, Xintao","Syntheses, Characterization, and Magnetic Properties of Four New Layered Transition-Metal Hydroxyl−Carboxylate−Phosphonates: [M(CH(OH)(CO2)(PO3H))(H2O)2] (M = Mn, Fe, Co, Zn)","Crystal Growth & Design","2005","5","5","1795","","10.1021/cg050065j","","","0.71073","MoKα","","0.0197","0.0188","","","0.0486","0.0492","","","","","","1.117","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505123","5.731","0.002","15.504","0.006","7.861","0.003","90","","109.287","0.004","90","","659.3","0.4","130.15","","130.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H7 Fe O8 P -","- C2 H7 Fe O8 P -","- C8 H28 Fe4 O32 P4 -","4","1","","Fu, Ruibiao; Xiang, Shengchang; Zhang, Huishuang; Zhang, Jianjun; Wu, Xintao","Syntheses, Characterization, and Magnetic Properties of Four New Layered Transition-Metal Hydroxyl−Carboxylate−Phosphonates: [M(CH(OH)(CO2)(PO3H))(H2O)2] (M = Mn, Fe, Co, Zn)","Crystal Growth & Design","2005","5","5","1795","","10.1021/cg050065j","","","0.71073","MoKα","","0.0268","0.0245","","","0.0601","0.0612","","","","","","1.145","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505124","5.678","0.002","15.469","0.006","7.846","0.003","90","","109.522","0.003","90","","649.5","0.4","130.15","","130.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H7 Co O8 P -","- C2 H7 Co O8 P -","- C8 H28 Co4 O32 P4 -","4","1","","Fu, Ruibiao; Xiang, Shengchang; Zhang, Huishuang; Zhang, Jianjun; Wu, Xintao","Syntheses, Characterization, and Magnetic Properties of Four New Layered Transition-Metal Hydroxyl−Carboxylate−Phosphonates: [M(CH(OH)(CO2)(PO3H))(H2O)2] (M = Mn, Fe, Co, Zn)","Crystal Growth & Design","2005","5","5","1795","","10.1021/cg050065j","","","0.71073","MoKα","","0.0223","0.0201","","","0.0478","0.0487","","","","","","1.082","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505125","5.72","0.0007","15.5327","0.0017","7.8528","0.0009","90","","110.332","0.003","90","","654.23","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H7 O8 P Zn -","- C2 H7 O8 P Zn -","- C8 H28 O32 P4 Zn4 -","4","1","","Fu, Ruibiao; Xiang, Shengchang; Zhang, Huishuang; Zhang, Jianjun; Wu, Xintao","Syntheses, Characterization, and Magnetic Properties of Four New Layered Transition-Metal Hydroxyl−Carboxylate−Phosphonates: [M(CH(OH)(CO2)(PO3H))(H2O)2] (M = Mn, Fe, Co, Zn)","Crystal Growth & Design","2005","5","5","1795","","10.1021/cg050065j","","","0.71073","MoKα","","","0.0794","","","0.198","0.2213","","","","","","1.078","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505126","29.2257","0.0019","6.6092","0.0004","29.855","0.0019","90","","108.838","0.001","90","","5457.9","0.6","293","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-nitroaniline (S)-10-camphorsulfonic acid. 0.5 water","","- C96 H138 N12 O39 S6 -","- C96 H138 N12 O39 S6 -","- C192 H276 N24 O78 S12 -","2","1","","Prakash, M. Jaya; Radhakrishnan, T. P.","Remote Functionalized Nonlinear Optical Chromophore: Optimal Assembly in Crystals for Second Harmonic Generation","Crystal Growth & Design","2005","5","5","1831","","10.1021/cg050066b","","","0.71073","MoKα","","0.0763","0.0507","","","0.1132","0.1257","","","","","","1.007","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505127","8.3786","0.0012","7.5384","0.0014","16.4319","0.0019","90","","101.385","0.01","90","","1017.4","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(2-aminoethyl)-4-nitroaniline (S)-10-camphorsulfonic acid","","- C18 H27 N3 O6 S -","- C18 H27 N3 O6 S -","- C36 H54 N6 O12 S2 -","2","1","","Prakash, M. Jaya; Radhakrishnan, T. P.","Remote Functionalized Nonlinear Optical Chromophore: Optimal Assembly in Crystals for Second Harmonic Generation","Crystal Growth & Design","2005","5","5","1831","","10.1021/cg050066b","","","0.71073","MoKα","","0.0792","0.0487","","","0.1132","0.1431","","","","","","1.12","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505128","7.8179","0.0016","9.4709","0.0019","15.568","0.003","90","","91.16","0.03","90","","1152.5","0.4","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(2-amino-4-hydroxypteridinate)ethylenediaminenickel(II)","","- C7 H13 N6 Ni0.5 O3.5 -","- C7 H13 N6 Ni0.5 O3.5 -","- C28 H52 N24 Ni2 O14 -","4","1","","Crispini, Alessandra; Pucci, Daniela; Bellusci, Anna; Barberio, Giovanna; La Deda, Massimo; Cataldi, Antonella; Ghedini, Mauro","Hydrogen-Bonding Network in Metal−Pterin Complexes: Synthesis and Characterization of Water-Soluble Octahedral Nickel and Cadmium Pterine Derivatives","Crystal Growth & Design","2005","5","4","1597","","10.1021/cg050075k","","","0.71073","MoKα","","0.0862","0.065","","","0.1828","0.1949","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505129","8.1675","0.0017","21.554","0.005","11.11","0.002","90","","93.822","0.003","90","","1951.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 Cd N2 O9 P -","- C15 H21 Cd N2 O9 P -","- C60 H84 Cd4 N8 O36 P4 -","4","1","","Zhang, Xian-Ming; Fang, Rui-Qin; Wu, Hai-Shun","Extended Water Tapes of Cyclic Hexamers Encapsulated in the Channels of a Metal Phosphonocarboxylate Network","Crystal Growth & Design","2005","5","4","1335","","10.1021/cg0500829","","","0.71073","MoKα","","0.0568","0.0356","","","0.0637","0.0703","","","","","","0.855","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505130","11.5319","0.0003","24.2933","0.0005","7.4351","0.0001","90","","95.1658","0.0008","90","","2074.47","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 Mn N8 O2 -","- C20 H12 Mn N8 O2 -","- C80 H48 Mn4 N32 O8 -","4","1","","Sun, Hao-Ling; Ma, Bao-Qing; Gao, Song; Batten, Stuart R.","A Novel Three-Dimensional Network Containing Mn(II) Ions and Tricyanomethanide with Rare 46.64Topology","Crystal Growth & Design","2005","5","4","1331","","10.1021/cg0500831","","","0.71073","MoKα","","0.0758","0.0335","","","0.0656","0.071","","","","","","0.923","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505131","13.3658","0.0002","19.5386","0.0003","24.7121","0.0004","85.67","","84.58","","88.38","","6404.9","0.17","90","1","90","1","","","","","","","","4","P -1","-P 1","2","[Zn(II)TPP]2Prz*C60","bis-(tetraphenylporphirinate Zn(II))pyrazine fullerene molecular complex","","- C190.5 H98.02 N10.66 Zn2 -","- C190.5 H98.02 N10.66 Zn2 -","- C381 H196.04 N21.32 Zn4 -","2","1","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.0774","0.0624","","","0.1724","0.1827","","","","","","1.049","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4505132","13.231","0.0013","49.036","0.005","23.027","0.002","90","","92.042","0.004","90","","14930","2","90","1","90","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[(ZnTPP)2BPy]C60-C7H8","","","- C246 H96 N10 Zn2 -","- C246 H96 N10 Zn2 -","- C984 H384 N40 Zn8 -","4","1","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.226","0.1112","","","0.2706","0.3349","","","","","","0.902","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505133","16.6488","0.001","19.0749","0.0011","21.5917","0.0013","90.344","0.002","105.864","0.002","96.447","0.002","6549.3","0.7","110","2","110","2","","","","","","","","4","P -1","-P 1","2","[60]fullerene ZnTPP TPyP clathrate","[60]fullerene zinc tetraphenylporphyrinate tetra(4-pyridyl)porphyrine clathrate","","- C180.25 H77.75 N13.75 Zn2 -","- C180.25 H77.75 N13.75 Zn2 -","- C360.5 H155.5 N27.5 Zn4 -","2","1","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.2379","0.0842","","0.2666","0.1959","","","","0.868","1.251","1.251","","","","","has coordinates,has disorder","179586","2020-10-21","18:00:00",""
"4505134","32.4381","0.0014","26.4829","0.0011","35.0797","0.0016","90","","115.202","0.001","90","","27267","2","90","1","90","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[ZnTPP(THF)]2x[C60]6.4xC6H5Cl","","","- C486 H76 Cl2 N8 O2 Zn2 -","- C486 H76 Cl N8 O2 Zn2 -","- C1944 H304 Cl4 N32 O8 Zn8 -","4","1","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.2902","0.2173","","","0.5341","0.5675","","","","","","4.108","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505135","15.0589","0.0004","19.1974","0.0005","24.4592","0.0006","90","","90","","90","","7071","0.3","90","1","90","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","[ZnTPP(TMDAE)]xC60x(C6H6)0.7x(C6H5Cl)0.3","","","- C116 H49.7 Cl0.3 N6 Zn -","- C116 H49.7 Cl0.3 N6 Zn -","- C464 H198.8 Cl1.2 N24 Zn4 -","4","1","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.0622","0.0454","","","0.1113","0.1259","","","","","","1.06","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4505136","17.7901","0.0013","13.4236","0.001","40.358","0.003","90","","99.313","0.001","90","","9510.7","1.2","90","1","90","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[(ZnTPP)2BPy]-C6H5CN","","","- C126 H84 N14 Zn2 -","- C126 H84 N14 Zn2 -","- C504 H336 N56 Zn8 -","4","0.5","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.0703","0.0515","","","0.1025","0.1087","","","","","","1.079","","","","has coordinates","271475","2021-12-16","11:44:44",""
"4505137","17.9296","0.0007","13.4047","0.0005","39.8176","0.0015","90","","99.769","0.001","90","","9431","0.6","90","1","90","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[(CoTPP)2BPy]-C6H5CN","","","- C126 H84 Co2 N14 -","- C126 H84 Co2 N14 -","- C504 H336 Co8 N56 -","4","0.5","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.0512","0.0369","","","0.0929","0.0977","","","","","","1.043","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505138","11.3466","0.0006","11.3616","0.0006","21.5015","0.0011","82.539","0.002","89.719","0.002","73.093","0.002","2628","0.2","90","1","90","1","","","","","","","","4","P -1","-P 1","2","[(ZnTPP)2-BPE]-BPE-C6H5CN-C7H8","","","- C70 H47.5 N7.5 Zn -","- C70 H47.5 N7.5 Zn -","- C140 H95 N15 Zn2 -","2","1","","Litvinov, Aleksey L.; Konarev, Dmitri V.; Kovalevsky, Andrey Yu.; Neretin, Ivan S.; Coppens, Philip; Lyubovskaya, Rimma N.","[60]Fullerene Complexes with Supramolecular Zinc Tetraphenylporphyrin Assemblies: Synthesis, Crystal Structures, and Optical Properties","Crystal Growth & Design","2005","5","5","1807","","10.1021/cg050095m","","","0.71073","MoKα","","0.1762","0.0821","","","0.1955","0.2353","","","","","","0.983","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505139","8.3431","0.0009","21.468","0.003","10.2766","0.0012","90","","99.415","0.002","90","","1815.8","0.4","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 Mo8 N4 O32 -","- C12 H32 Mo8 N4 O32 -","- C24 H64 Mo16 N8 O64 -","2","0.5","","Upreti, Shailesh; Ramanan, Arunachalam","Structure-Directing Role of Hydrogen-Bonded Dimers of Phenylenediammonium Cations: Supramolecular Assemblies of Octamolybdate-Based Organic−Inorganic Hybrids","Crystal Growth & Design","2005","5","5","1837","","10.1021/cg050100m","","","0.71073","MoKα","","0.039","0.0313","","","0.0657","0.0686","","","","","","1.086","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505140","10.8142","0.0013","14.1329","0.0017","11.1412","0.0014","90","","97.63","0.002","90","","1687.7","0.4","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H28 Mo8 N4 O30 -","- C12 H28 Mo8 N4 O30 -","- C24 H56 Mo16 N8 O60 -","2","0.5","","Upreti, Shailesh; Ramanan, Arunachalam","Structure-Directing Role of Hydrogen-Bonded Dimers of Phenylenediammonium Cations: Supramolecular Assemblies of Octamolybdate-Based Organic−Inorganic Hybrids","Crystal Growth & Design","2005","5","5","1837","","10.1021/cg050100m","","","0.71073","MoKα","","0.0216","0.0205","","","0.0517","0.0522","","","","","","1.167","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4505141","27.502","0.005","11.622","0.002","14.138","0.002","90","","109.442","0.003","90","","4261.2","1.2","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H36 Mo8 N8 O28 -","- C24 H36 Mo8 N8 O28 -","- C96 H144 Mo32 N32 O112 -","4","0.5","","Upreti, Shailesh; Ramanan, Arunachalam","Structure-Directing Role of Hydrogen-Bonded Dimers of Phenylenediammonium Cations: Supramolecular Assemblies of Octamolybdate-Based Organic−Inorganic Hybrids","Crystal Growth & Design","2005","5","5","1837","","10.1021/cg050100m","","","0.71073","MoKα","","0.0266","0.0251","","","0.0623","0.063","","","","","","1.162","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505142","9.0097","0.0008","9.7735","0.0005","10.8421","0.0002","60.379","0.014","67.235","0.016","70.25","0.018","752.38","0.15","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H40 Mn2 N10 S6 Sn2 -","- C10 H40 Mn2 N10 S6 Sn2 -","- C10 H40 Mn2 N10 S6 Sn2 -","1","0.5","","Gu, Xiao-Mei; Dai, Jie; Jia, Ding-Xian; Zhang, Yong; Zhu, Qin-Yu","Two-Step Solvothermal Preparation of a Coordination Polymer Containing a Transition Metal Complex Fragment and a Thiostannate Anion: [{Mn(en)2}2(μ-en)(μ-Sn2S6)]∞(en, Ethylenediamine)","Crystal Growth & Design","2005","5","5","1845","","10.1021/cg050109o","","","0.7107","MoKα","","0.0238","0.0218","","","0.0461","0.0468","","","","","","1.118","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4505143","8.1051","0.0007","17.6812","0.0014","8.5047","0.0007","90","","90.072","0.007","90","","1218.79","0.17","130.2","","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Co3 N6 O14 -","- C20 H22 Co3 N6 O14 -","- C40 H44 Co6 N12 O28 -","2","0.5","","Wang, Yu-Ling; Yuan, Da-Qiang; Bi, Wen-Hua; Li, Xing; Li, Xiao-Ju; Li, Feng; Cao, Rong","Syntheses and Characterizations of Two 3D Cobalt−Organic Frameworks from 2D Honeycomb Building Blocks","Crystal Growth & Design","2005","5","5","1849","","10.1021/cg0501128","","","0.71073","MoKα","","0.0705","0.0547","","","0.1016","0.1092","","","","","","1.058","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505144","11.4932","0.0002","11.6132","0.0001","11.8182","0.0001","65.275","0.008","81.174","0.012","72.752","0.01","1367.58","0.12","293","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H45 Co3 N11 O15 -","- C43 H30 Co3 N11 O15 -","- C43 H30 Co3 N11 O15 -","1","0.5","","Wang, Yu-Ling; Yuan, Da-Qiang; Bi, Wen-Hua; Li, Xing; Li, Xiao-Ju; Li, Feng; Cao, Rong","Syntheses and Characterizations of Two 3D Cobalt−Organic Frameworks from 2D Honeycomb Building Blocks","Crystal Growth & Design","2005","5","5","1849","","10.1021/cg0501128","","","0.71073","MoKα","","0.0943","0.0759","","","0.2146","0.2295","","","","","","1.097","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505145","6.436","0.002","15.863","0.005","20.213","0.007","90","","90","","90","","2063.6","1.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-N-(1-hydroxymethyl-2-methylpropyl)-4-(1,2,3,4- tetrahydro-1,4-methanonaphthalene-9-carbonyl)-benzamide","","- C24 H27 N O3 -","- C24 H27 N O3 -","- C96 H108 N4 O12 -","4","1","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.1944","0.0706","","","0.1103","0.1485","","","","","","0.972","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505146","5.419","0.001","10.052","0.002","39.197","0.007","90","","90","","90","","2135.1","0.7","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-N-(1-cyclohexylethyl)-4-(1,2,3,4-tetrahydro-1,4- methanonaphthalene-9-carbonyl)benzamide","","- C27 H31 N O2 -","- C27 H31 N O2 -","- C108 H124 N4 O8 -","4","1","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.124","0.0764","","","0.1564","0.1765","","","","","","1.041","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505147","46.067","0.008","7.01","0.001","14.141","0.002","90","","107.076","0.003","90","","4365.2","1.2","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","(S)-N-(1-hydroxymethyl-2-phenylethyl)-4-(1,2,3,4-tetra hydro-1,4-methanonaphthalene-9-carbonyl)benzamide","","- C28 H27 N O3 -","- C28 H27 N O3 -","- C224 H216 N8 O24 -","8","2","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.154","0.0597","","","0.0922","0.1185","","","","","","0.958","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505148","13.703","0.003","6.6574","0.0014","25.878","0.005","90","","93.116","0.004","90","","2357.3","0.8","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H29 N O3 -","- C29 H29 N O3 -","- C116 H116 N4 O12 -","4","2","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.1607","0.0809","","","0.167","0.2072","","","","","","0.97","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505149","8.8813","0.0008","12.9697","0.0011","10.3687","0.0009","90","","109.938","0.001","90","","1122.76","0.17","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-(2-adamantan-1-ylacetyl)-N-((R)-1-phenylethyl)benzamide","","- C27 H31 N O2 -","- C27 H31 N O2 -","- C54 H62 N2 O4 -","2","1","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.0472","0.0446","","","0.1102","0.1121","","","","","","1.048","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505150","9.4834","0.0007","11.4733","0.0008","10.5049","0.0007","90","","101.892","0.001","90","","1118.46","0.14","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-4-(2-adamantan-1-ylacetyl)-N-(1-phenylpropyl) benzamide","","- C28 H33 N O2 -","- C28 H33 N O2 -","- C56 H66 N2 O4 -","2","1","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.0521","0.0416","","","0.0899","0.0951","","","","","","1.042","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505151","19.561","0.005","10.652","0.003","9.899","0.003","90","","99.531","0.005","90","","2034.1","1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-(adamantyl-1-yl-acetyl)-N-(1,2-dimethylpropyl) benzamide","","- C24 H33 N O2 -","- C24 H33 N O2 -","- C96 H132 N4 O8 -","4","2","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.2401","0.0734","","","0.1048","0.1476","","","","","","0.915","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505152","33.5","0.004","6.2922","0.0008","11.84","0.01","90","","110.464","0.002","90","","2338","2","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","4-(2-adamantan-1-ylacetyl)benzoic acid 2,6,6- trimethylbicyclo[3.1.1]hept-3-yl ester","","- C29 H38 O3 -","- C29 H38 O3 -","- C116 H152 O12 -","4","1","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.0908","0.0554","","","0.1118","0.1231","","","","","","1.059","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505153","11.007","0.003","6.528","0.002","27.722","0.007","90","","90.435","0.004","90","","1991.9","1","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","4-(2-adamantan-1-ylacetyl)benzoic acid 2-bromo-1-methylethyl ester","","- C23 H29 Br O3 -","- C23 H27 Br0.99 O3 -","- C92 H108 Br3.96 O12 -","4","1","","Natarajan, Arunkumar; Mague, Joel T.; Ramamurthy, V.","Viability of a Covalent Chiral Auxiliary Method to Induce Asymmetric Induction in Solid-State Photoreactions Explored","Crystal Growth & Design","2005","5","6","2348","","10.1021/cg0501175","","","0.71073","MoKα","","0.1775","0.1383","","","0.2894","0.3081","","","","","","1.079","","","","has coordinates,has disorder","179586","2020-10-21","18:00:00",""
"4505154","13.5047","0.001","22.3136","0.0017","6.8889","0.0005","90","","90","","90","","2075.9","0.3","173","2","173","2","","","","","","","","5","P n n 2","P 2 -2n","34","","","","- C15 H25 N4 O9 S -","- C15 H25 N4 O9 S -","- C60 H100 N16 O36 S4 -","4","1","","Custelcean, Radu; Ward, Michael D.","Chiral Discrimination in Low-Density Hydrogen-Bonded Frameworks","Crystal Growth & Design","2005","5","6","2277","","10.1021/cg050118x","","","0.71073","MoKα","","0.0789","0.0443","","","0.0918","0.1022","","","","","","1.012","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505155","15.597","0.003","21.361","0.004","7.6072","0.0013","90","","90","","90","","2534.5","0.8","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C16 H26 N8 O12 S2 -","- C16 H18 N8 O12 S2 -","- C64 H72 N32 O48 S8 -","4","1","","Custelcean, Radu; Ward, Michael D.","Chiral Discrimination in Low-Density Hydrogen-Bonded Frameworks","Crystal Growth & Design","2005","5","6","2277","","10.1021/cg050118x","","","0.7107","MoKα","","0.0524","0.0461","","","0.1326","0.1373","","","","","","1.045","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505156","14.9757","0.001","7.2578","0.0005","20.0261","0.0013","90","","90","","90","","2176.6","0.3","173","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C14 H18 N8 O10 S2 -","- C14 H18 N8 O10 S2 -","- C56 H72 N32 O40 S8 -","4","1","","Custelcean, Radu; Ward, Michael D.","Chiral Discrimination in Low-Density Hydrogen-Bonded Frameworks","Crystal Growth & Design","2005","5","6","2277","","10.1021/cg050118x","","","0.71073","MoKα","","0.0472","0.0358","","","0.0761","0.0791","","","","","","0.951","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505157","7.4632","0.0015","12.587","0.003","29.788","0.006","90","","93.983","0.004","90","","2791.5","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H15 N4 O3 S -","- C10 H15 N4 O3 S -","- C80 H120 N32 O24 S8 -","8","1","","Custelcean, Radu; Ward, Michael D.","Chiral Discrimination in Low-Density Hydrogen-Bonded Frameworks","Crystal Growth & Design","2005","5","6","2277","","10.1021/cg050118x","","","0.71073","MoKα","","0.0656","0.0621","","","0.1491","0.151","","","","","","1.107","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505158","25.53","0.004","14.088","0.002","11.9203","0.0019","90","","90","","90","","4287.3","1.1","273","2","273","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C18 H26 Cl2 N6 O6 S2 -","- C18 H26 Cl2 N6 O6 S2 -","- C72 H104 Cl8 N24 O24 S8 -","4","0.5","","Custelcean, Radu; Ward, Michael D.","Chiral Discrimination in Low-Density Hydrogen-Bonded Frameworks","Crystal Growth & Design","2005","5","6","2277","","10.1021/cg050118x","","","0.71073","MoKα","","0.154","0.0797","","","0.1964","0.2237","","","","","","1.01","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505159","25.574","0.005","14.097","0.003","11.77","0.002","90","","90","","90","","4243.3","1.4","273","2","273","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C18 H26 Cl2 N6 O6 S2 -","- C10.2857 H14.8571 Cl1.14286 N3.42857 O3.42857 S1.14286 -","- C72 H104 Cl8 N24 O24 S8 -","7","0.875","","Custelcean, Radu; Ward, Michael D.","Chiral Discrimination in Low-Density Hydrogen-Bonded Frameworks","Crystal Growth & Design","2005","5","6","2277","","10.1021/cg050118x","","","0.71073","MoKα","","0.1811","0.0932","","","0.1973","0.2313","","","","","","1.038","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505160","18.734","0.002","19.448","0.004","7.724","0.001","90","","90","","90","","2814.2","0.7","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C5 H6 Cl N3 O -","- C5 H6 Cl N3 O -","- C80 H96 Cl16 N48 O16 -","16","1","","Kaftory, Menahem; Botoshansky, Mark; Sheinin, Yana","Dimormorphism and Cocrystal Formation of 3-(Chloroacetamido)pyrazole","Crystal Growth & Design","2005","5","6","2242","","10.1021/cg0501229","","","0.71073","MoKα","","0.0463","0.0342","","","0.0859","0.0918","","","","","","0.996","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505161","23.83","0.005","23.83","0.005","5.196","0.001","90","","90","","90","","2950.6","1","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Yana-370","","","- C5 H6 Cl N3 O -","- C5 H6 Cl N3 O -","- C80 H96 Cl16 N48 O16 -","16","1","","Kaftory, Menahem; Botoshansky, Mark; Sheinin, Yana","Dimormorphism and Cocrystal Formation of 3-(Chloroacetamido)pyrazole","Crystal Growth & Design","2005","5","6","2242","","10.1021/cg0501229","","","0.71073","MoKα","","0.1481","0.0488","","","0.114","0.1465","","","","","","0.81","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505162","5.157","0.001","14.293","0.002","15.318","0.003","90","","103.24","0.03","90","","1099.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Yana-31-I","","","- C7 H9 Cl2 N3 O3 -","- C7 H9 Cl2 N3 O3 -","- C28 H36 Cl8 N12 O12 -","4","1","","Kaftory, Menahem; Botoshansky, Mark; Sheinin, Yana","Dimormorphism and Cocrystal Formation of 3-(Chloroacetamido)pyrazole","Crystal Growth & Design","2005","5","6","2242","","10.1021/cg0501229","","","0.71073","MoKα","","0.0827","0.0441","","","0.1111","0.1233","","","","","","1.037","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505163","9.2636","0.0009","9.79","0.0009","10.7319","0.001","90","","115.025","0.001","90","","881.91","0.14","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","N,N'-bis(benzoyl)-(1R,2R)-diaminocyclohexane","","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C40 H44 N4 O4 -","2","1","","Anthony, S. Philip; Basavaiah, K.; Radhakrishnan, T. P.","Chiral Vicinal Bis(amide) Molecules: Polar/Helical Assemblies in Crystals and Second Harmonic Generation","Crystal Growth & Design","2005","5","5","1663","","10.1021/cg0501231","","","0.71073","MoKα","","0.0541","0.0407","","","0.0801","0.0847","","","","","","0.928","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505164","5.1328","0.0004","17.2924","0.0014","18.9976","0.0015","90","","90","","90","","1686.2","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N,N'-bis(isonicotinoyl)(1R,2R)diaminocyclohexane","","","- C18 H20 N4 O2 -","- C18 H20 N4 O2 -","- C72 H80 N16 O8 -","4","1","","Anthony, S. Philip; Basavaiah, K.; Radhakrishnan, T. P.","Chiral Vicinal Bis(amide) Molecules: Polar/Helical Assemblies in Crystals and Second Harmonic Generation","Crystal Growth & Design","2005","5","5","1663","","10.1021/cg0501231","","","0.71073","MoKα","","0.0907","0.044","","","0.0788","0.0901","","","","","","0.88","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505165","8.542","","9.243","0.0001","10.1091","0.0002","70.035","0.01","67.654","0.012","79.818","0.014","692.83","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H13 Cd N2 O5 -","- C13 H13 Cd N2 O5 -","- C26 H26 Cd2 N4 O10 -","2","1","","Li, Xiaoju; Cao, Rong; Bi, Wenhua; Wang, Yanqin; Wang, Yuling; Li, Xing; Guo, Zhengang","A New Family of Cadmium(II) Coordination Polymers from Coligands: Effect of the Coexistent Groups (R = H, −NO2, −OH) on Crystal Structures and Properties","Crystal Growth & Design","2005","5","4","1651","","10.1021/cg050126d","","","0.71073","MoKα","","0.0408","0.0344","","","0.1027","0.1121","","","","","","0.84","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505166","8.411","0.003","10.05","0.003","10.664","0.003","91.273","0.002","103.991","0.003","113.77","0.003","793.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H24 Cd2 N6 O14 -","- C26 H24 Cd2 N6 O14 -","- C26 H24 Cd2 N6 O14 -","1","0.5","","Li, Xiaoju; Cao, Rong; Bi, Wenhua; Wang, Yanqin; Wang, Yuling; Li, Xing; Guo, Zhengang","A New Family of Cadmium(II) Coordination Polymers from Coligands: Effect of the Coexistent Groups (R = H, −NO2, −OH) on Crystal Structures and Properties","Crystal Growth & Design","2005","5","4","1651","","10.1021/cg050126d","","","0.71073","MoKα","","0.0355","0.032","","","0.0865","0.0901","","","","","","0.676","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505167","15.187","0.004","14.094","0.003","13.069","0.003","90","","109.117","0.002","90","","2643.1","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H13 Cd N2 O6 -","- C13 H13 Cd N2 O6 -","- C104 H104 Cd8 N16 O48 -","8","1","","Li, Xiaoju; Cao, Rong; Bi, Wenhua; Wang, Yanqin; Wang, Yuling; Li, Xing; Guo, Zhengang","A New Family of Cadmium(II) Coordination Polymers from Coligands: Effect of the Coexistent Groups (R = H, −NO2, −OH) on Crystal Structures and Properties","Crystal Growth & Design","2005","5","4","1651","","10.1021/cg050126d","","","0.71073","MoKα","","0.0217","0.0205","","","0.0897","0.0921","","","","","","0.847","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505168","9.377","0.0019","10.671","0.002","11.907","0.002","90","","108.4","0.03","90","","1130.5","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H6 Br F4 N -","- C13 H6 Br F4 N -","- C52 H24 Br4 F16 N4 -","4","1","","Lucassen, André C. B.; Vartanian, Maida; Leitus, Gregory; van der Boom, Milko E.","4‘-Bromo-2‘,3‘,5‘,6‘-tetrafluorostilbazole: Donor and Acceptor Site for Halogen Bonding and π-Stacking in One Rigid-Rod-Type Molecule","Crystal Growth & Design","2005","5","5","1671","","10.1021/cg0501433","","","0.71073","MoKα","","0.0276","0.0241","","","0.0577","0.0591","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505169","8.0456","0.0007","11.4433","0.001","16.9978","0.0015","90","","93.866","0.002","90","","1561.4","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bipyridine suucinato nickel","","","- C14 H18 N2 Ni O7 -","- C14 H18 N2 Ni O7 -","- C56 H72 N8 Ni4 O28 -","4","1","","Zhou, Zhao-Hui; Yang, Jin-Mei; Wan, Hui-Lin","Diamine Substitution Reactions of Tetrahydrate Succinato Nickel, Cobalt, and Zinc Coordination Polymers","Crystal Growth & Design","2005","5","5","1825","","10.1021/cg050150r","","","0.71073","MoKα","","0.0779","0.058","","","0.1275","0.1365","","","","","","1.004","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505170","8.1405","0.0003","11.4833","0.0005","17.0073","0.0007","90","","94.193","0.001","90","","1585.58","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bipyridine succinato cobalt","","","- C14 H18 Co N2 O7 -","- C14 H18 Co N2 O7 -","- C56 H72 Co4 N8 O28 -","4","1","","Zhou, Zhao-Hui; Yang, Jin-Mei; Wan, Hui-Lin","Diamine Substitution Reactions of Tetrahydrate Succinato Nickel, Cobalt, and Zinc Coordination Polymers","Crystal Growth & Design","2005","5","5","1825","","10.1021/cg050150r","","","0.71073","MoKα","","0.0461","0.0402","","","0.0967","0.1002","","","","","","1.063","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505171","7.4798","0.0004","10.2092","0.0006","10.5362","0.0006","97.533","0.001","106.675","0.001","100.837","0.001","742.21","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","phenanthroline succinato nickel","","","- C16 H14 N2 Ni O5 -","- C16 H14 N2 Ni O5 -","- C32 H28 N4 Ni2 O10 -","2","1","","Zhou, Zhao-Hui; Yang, Jin-Mei; Wan, Hui-Lin","Diamine Substitution Reactions of Tetrahydrate Succinato Nickel, Cobalt, and Zinc Coordination Polymers","Crystal Growth & Design","2005","5","5","1825","","10.1021/cg050150r","","","0.71073","MoKα","","0.0524","0.0461","","","0.1041","0.1077","","","","","","1.078","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505172","7.5222","0.0006","10.3016","0.0008","10.5214","0.0008","97.624","0.001","106.787","0.001","100.583","0.001","752.2","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","phenanthroline succinato cobalt","","","- C16 H14 Co N2 O5 -","- C16 H14 Co N2 O5 -","- C32 H28 Co2 N4 O10 -","2","1","","Zhou, Zhao-Hui; Yang, Jin-Mei; Wan, Hui-Lin","Diamine Substitution Reactions of Tetrahydrate Succinato Nickel, Cobalt, and Zinc Coordination Polymers","Crystal Growth & Design","2005","5","5","1825","","10.1021/cg050150r","","","0.71073","MoKα","","0.0703","0.0509","","","0.0951","0.1047","","","","","","1.007","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505173","4.6868","0.0003","18.4268","0.0012","14.7201","0.0009","90","","90.5","0.001","90","","1271.22","0.14","373","2","373","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N4 O5 -","- C13 H10 N4 O5 -","- C52 H40 N16 O20 -","4","1","","Rafilovich, Michal; Bernstein, Joel; Harris, Robin K.; Apperley, David C.; Karamertzanis, Panagiotis G.; Price, Sarah L.","Groth's Original Concomitant Polymorphs Revisited","Crystal Growth & Design","2005","5","6","2197","","10.1021/cg050151j","","","0.71073","MoKα","","0.051","0.0465","","","0.1172","0.1212","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505174","24.744","0.005","7.3803","0.0015","3.736","0.0007","90","","96.39","0.004","90","","678","0.2","373","2","373","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C13 H12 N4 O6 -","- C13 H12 N4 O6 -","- C26 H24 N8 O12 -","2","0.5","","Rafilovich, Michal; Bernstein, Joel; Harris, Robin K.; Apperley, David C.; Karamertzanis, Panagiotis G.; Price, Sarah L.","Groth's Original Concomitant Polymorphs Revisited","Crystal Growth & Design","2005","5","6","2197","","10.1021/cg050151j","","","0.71073","MoKα","","0.0484","0.0473","","","0.1199","0.1207","","","","","","1.131","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505175","11.6715","0.0004","13.2581","0.0004","18.4734","0.0006","90","","90","","90","","2858.61","0.16","183.2","","183.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H31 Cl Mo O2 P2 -","- C32 H31 Cl Mo O2 P2 -","- C128 H124 Cl4 Mo4 O8 P8 -","4","1","","Faller, J. W.; Sarantopoulos, Nikos","Crystallization-Induced Asymmetric Transformations in Crotyl Molybdenum Complexes†","Crystal Growth & Design","2005","5","6","2356","","10.1021/cg050152b","","","0.7107","MoKα","","0.0596","0.034","","0.041","","0.034","","","0.759","","","0.73","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505176","9.8187","0.0006","16.4878","0.0007","11.0874","0.0007","90","","107.278","0.002","90","","1713.93","0.17","183.2","","183.2","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C35 H37 Cl3 Mo O2 P2 -","- C35 H37 Cl3 Mo O2 P2 -","- C70 H74 Cl6 Mo2 O4 P4 -","2","1","","Faller, J. W.; Sarantopoulos, Nikos","Crystallization-Induced Asymmetric Transformations in Crotyl Molybdenum Complexes†","Crystal Growth & Design","2005","5","6","2356","","10.1021/cg050152b","","","0.7107","MoKα","","0.072","0.044","","0.067","","0.049","","","1.312","","","1.14","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505177","5.9429","0.0001","16.9118","0.0003","15.8675","0.0004","90","","94.0831","0.0007","90","","1590.72","0.06","298","","","","","","","","","","Local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H24 N2 O -","- C17 H24 N2 O -","- C68 H96 N8 O4 -","4","1","","Delen, Zeynep; Xie, Chunping; Hill, Pamela J.; Choi, Jong; Lahti, Paul M.","Hindered Hydrogen Bonding in 2,6-Di-tert-butylphenols with Para Aza-Heterocyclic Rings","Crystal Growth & Design","2005","5","5","1867","","10.1021/cg050156g","","","0.71073","MoKα","","0.0678","0.0482","","","0.1229","0.1318","","","","","","1.404","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505178","13.3482","0.0003","10.436","0.0003","11.372","0.0003","90","","93.652","0.002","90","","1580.92","0.07","298","","","","","","","","","","Lahti group laboratory","4","C 1 2/c 1","-C 2yc","15","","1-(3,5-di-t-butyl-4-hydroxyphenyl)-1,2,4-triazole","","- C16 H23 N3 O -","- C14 H21 N5 O -","- C56 H84 N20 O4 -","4","0.5","","Delen, Zeynep; Xie, Chunping; Hill, Pamela J.; Choi, Jong; Lahti, Paul M.","Hindered Hydrogen Bonding in 2,6-Di-tert-butylphenols with Para Aza-Heterocyclic Rings","Crystal Growth & Design","2005","5","5","1867","","10.1021/cg050156g","","","0.71073","MoKα","","0.0706","0.0598","","","0.1676","0.1781","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505179","18.6369","0.0002","37.3688","0.0004","12.3269","0.0001","90","","109.288","0.0004","90","","8103.04","0.14","298","","","","","","","","","","zd1128","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H24 N2 O -","- C17 H24 N2 O -","- C340 H480 N40 O20 -","20","5","","Delen, Zeynep; Xie, Chunping; Hill, Pamela J.; Choi, Jong; Lahti, Paul M.","Hindered Hydrogen Bonding in 2,6-Di-tert-butylphenols with Para Aza-Heterocyclic Rings","Crystal Growth & Design","2005","5","5","1867","","10.1021/cg050156g","","","0.71073","MoKα","","0.1283","0.0615","","","0.1377","0.1683","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505180","9.9313","0.0002","11.9628","0.0002","15.316","0.0003","95.3533","0.0009","106.63","0.001","105.017","0.0008","1656.18","0.06","298","","","","","","","","","","Lahti group laboratory","4","P -1","-P 1","2","","","","- C18 H23 N2 O -","- C18 H23 N2 O -","- C72 H92 N8 O4 -","4","2","","Delen, Zeynep; Xie, Chunping; Hill, Pamela J.; Choi, Jong; Lahti, Paul M.","Hindered Hydrogen Bonding in 2,6-Di-tert-butylphenols with Para Aza-Heterocyclic Rings","Crystal Growth & Design","2005","5","5","1867","","10.1021/cg050156g","","","0.71073","MoKα","","0.1045","0.062","","","0.1565","0.1897","","","","","","1.094","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505181","16.9957","0.0005","9.8726","0.0003","21.8641","0.0007","90","","90","","90","","3668.62","0.19","293","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(2-Benzimidazolyl)-3,5-di-tert-butylphenol","","- C21 H26 N2 O -","- C21 H26 N2 O -","- C168 H208 N16 O8 -","8","1","","Delen, Zeynep; Xie, Chunping; Hill, Pamela J.; Choi, Jong; Lahti, Paul M.","Hindered Hydrogen Bonding in 2,6-Di-tert-butylphenols with Para Aza-Heterocyclic Rings","Crystal Growth & Design","2005","5","5","1867","","10.1021/cg050156g","","","1.54178","CuKα","","0.0625","0.0492","","","0.1205","0.1277","","","","","","0.944","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505182","7.7985","0.0007","12.0911","0.001","13.2824","0.0011","106.716","0.002","99.849","0.002","90.897","0.002","1179.03","0.17","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C10 H18 Br3 F6 N3 O5 P S2 -","- C10 H18 Br2.5 F6 N3 O5 P S2 -","- C20 H36 Br5 F12 N6 O10 P2 S4 -","2","1","","Zhu, Shizheng; Jiang, Huiling; Zhao, Jingwei; Li, Zhanting","Reaction of 1,1,3,3-Tetraoxa-2,2-dibromo- 4,4,5,5,6,6-hexafluoro-1,3-dithiacyclohexane with Pyrazine and Hexamethylphosphoramide: Unexpected Cocrystals through Halogen Bonding","Crystal Growth & Design","2005","5","5","1675","","10.1021/cg0501579","","","0.71073","MoKα","","0.0883","0.0694","","","0.1678","0.1735","","","","","","0.911","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505183","13.6434","0.0011","14.8362","0.0012","13.1386","0.0011","90","","118.375","0.001","90","","2339.9","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C13 H27 F6 N4 O5 P S2 -","- C13 H27 F6 N4 O5 P S2 -","- C52 H108 F24 N16 O20 P4 S8 -","4","1","","Zhu, Shizheng; Jiang, Huiling; Zhao, Jingwei; Li, Zhanting","Reaction of 1,1,3,3-Tetraoxa-2,2-dibromo- 4,4,5,5,6,6-hexafluoro-1,3-dithiacyclohexane with Pyrazine and Hexamethylphosphoramide: Unexpected Cocrystals through Halogen Bonding","Crystal Growth & Design","2005","5","5","1675","","10.1021/cg0501579","","","0.71073","MoKα","","0.0708","0.0475","","","0.1135","0.1216","","","","","","0.933","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505184","7.707","0.001","4.869","0.001","13.3","0.001","90","","99.946","0.01","90","","491.59","0.13","198","2","198","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 Cl2 N4 O4 -","- C6 H10 Cl2 N4 O4 -","- C12 H20 Cl4 N8 O8 -","2","0.5","","Kühl, Olaf; Goutal, Sigrid","Acid/Base versus Redox Reaction−The Case of Chloranilic Acid and Hydrazine: A Supramolecular Decision?","Crystal Growth & Design","2005","5","5","1875","","10.1021/cg0501581","","","0.71073","MoKα","","0.0263","0.0222","","","0.0576","0.0613","","","","","","1.124","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505185","7.6158","0.0015","18.64","0.004","5.6584","0.0014","90","","104.838","0.017","90","","776.5","0.3","294","","294","","","","1","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Abdelmoty, Iman; Buchholz, Vera; Di, Li; Guo, Chengyun; Kowitz, Kathleen; Enkelmann, Volker; Wegner, Gerhard; Foxman, Bruce M.","Polymorphism of Cinnamic and α-Truxillic Acids: New Additions to an Old Story†","Crystal Growth & Design","2005","5","6","2210","","10.1021/cg050160s","","","0.71073","MoKα","","0.1291","0.0441","","0.1269","0.0542","0.0542","","","","","","1.1161","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505186","7.6462","0.0011","18.2905","0.0014","5.6092","0.0012","90","","106.057","0.016","90","","753.9","0.2","294","","294","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 O2 -","- C9 H7 O2 -","- C36 H28 O8 -","4","1","","Abdelmoty, Iman; Buchholz, Vera; Di, Li; Guo, Chengyun; Kowitz, Kathleen; Enkelmann, Volker; Wegner, Gerhard; Foxman, Bruce M.","Polymorphism of Cinnamic and α-Truxillic Acids: New Additions to an Old Story†","Crystal Growth & Design","2005","5","6","2210","","10.1021/cg050160s","","","1.5418","CuKα","","0.0695","0.0621","","0.0852","0.0751","0.0751","","","","","","0.9664","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505187","15.9958","0.0012","5.6586","0.0005","16.3091","0.0012","90","","99.615","0.006","90","","1455.5","0.2","294","","294","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","0.5","","Abdelmoty, Iman; Buchholz, Vera; Di, Li; Guo, Chengyun; Kowitz, Kathleen; Enkelmann, Volker; Wegner, Gerhard; Foxman, Bruce M.","Polymorphism of Cinnamic and α-Truxillic Acids: New Additions to an Old Story†","Crystal Growth & Design","2005","5","6","2210","","10.1021/cg050160s","","","1.5418","CuKα","","0.0426","0.0349","","0.0509","0.0447","0.0447","","","","","","1.0407","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505188","31.296","0.004","4.0152","0.0017","6.083","0.002","90","","90.146","0.019","90","","764.4","0.4","294","","294","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Abdelmoty, Iman; Buchholz, Vera; Di, Li; Guo, Chengyun; Kowitz, Kathleen; Enkelmann, Volker; Wegner, Gerhard; Foxman, Bruce M.","Polymorphism of Cinnamic and α-Truxillic Acids: New Additions to an Old Story†","Crystal Growth & Design","2005","5","6","2210","","10.1021/cg050160s","","","0.71073","MoKα","","0.1155","0.0364","","0.1009","0.0443","0.0443","","","","","","1.1248","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4505189","14.741","0.002","9.137","0.0015","20.542","0.002","90","","90","","90","","2766.8","0.6","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H18 N4 S2 -","- C12 H18 N4 S2 -","- C96 H144 N32 S16 -","8","1","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.072","0.044","","0.093","","0.042","","","1.08","","","1.14","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505190","8.834","0.004","12.4201","0.0018","17.0105","0.0017","90","","96.51","0.02","90","","1854.3","0.9","296","","296","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H26 N4 S2 -","- C16 H19 N4 S2 -","- C64 H76 N16 S8 -","4","1","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.138","0.078","","0.156","","0.074","","","1.58","","","1.93","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505191","39.055","0.009","12.437","0.003","8.824","0.002","90","","101.08","0.02","90","","4206.2","1.7","296.2","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 N4 S2 -","- C18 H30 N4 S2 -","- C144 H240 N32 S16 -","8","1","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.252","0.121","","0.228","","0.11","","","1.49","","","2.13","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505192","23.056","0.002","8.6042","0.0009","9.45","0.001","90","","107.38","0.01","90","","1789.1","0.3","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H24 N4 S2 -","- C13.5 H24.5 N4 S2 -","- C54 H98 N16 S8 -","4","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.089","0.062","","0.178","","0.088","","","3.24","","","3.52","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505193","16.975","0.002","16.975","0.002","17.007","0.002","90","","90","","90","","4900.6","1","296","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C21 H36 N4 S2 -","- C19.5 H32.5 N4 S2 -","- C156 H260 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.107","0.078","","0.149","","0.072","","","1.84","","","2.44","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505194","17.47","0.003","9.6949","0.0015","9.5174","0.0014","90","","90.275","0.003","90","","1611.9","0.4","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 N4 S2 -","- C14 H22 N4 S2 -","- C56 H88 N16 S8 -","4","1","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.0496","0.0381","","","0.1095","0.1273","","","","","","0.9","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505195","16.755","0.002","16.755","0.002","18.559","0.003","90","","90","","90","","5210.1","1.2","296","","296","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H38 N4 S2 -","- C20.5 H37.5 N4 S2 -","- C164 H300 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.074","0.069","","0.143","","0.079","","","1.75","","","2.66","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505196","17.571","0.006","10.062","0.004","9.506","0.003","90","","91.699","0.006","90","","1679.9","1","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 N4 S2 -","- C15 H24 N4 S2 -","- C60 H96 N16 S8 -","4","1","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.1387","0.1243","","","0.3291","0.3391","","","","","","1.914","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505197","16.854","0.003","16.854","0.003","18.943","0.004","90","","90","","90","","5380.9","1.8","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C23 H40 N4 S2 -","- C21 H34 N4 S2 -","- C168 H272 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.141","0.085","","","0.2348","0.2567","","","","","","1.283","","","","has coordinates","179586","2020-10-21","18:00:00",""
"4505198","43.78","0.005","9.814","0.005","18.682","0.002","90","","108.49","0.01","90","","7612","4","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H26 N4 S2 -","- C16 H26 N4 S2 -","- C256 H416 N64 S32 -","16","2","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.137","0.07","","0.122","","0.055","","","1.11","","","1.36","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505199","18.535","0.003","9.878","0.001","25.659","0.004","90","","110.15","0.01","90","","4410.3","1.1","295","","295","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19.5 H30 N4 S2 -","- C19 H26 N4 S2 -","- C152 H208 N32 S16 -","8","2","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.154","0.098","","0.188","","0.097","","","2.36","","","3","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505200","13.1508","0.0014","15.054","0.0013","25.211","0.002","86.298","0.008","80.032","0.008","68.092","0.008","4560.7","0.8","296","","296","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H34 N4 S2 -","- C19.875 H23.25 N4 S2 -","- C159 H186 N32 S16 -","8","4","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.157","0.093","","0.215","","0.107","","","2.66","","","3.35","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505201","16.699","0.004","16.693","0.006","18.989","0.004","90","","90","","90","","5293","3","273","","273","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C22 H38 N4 S2 -","- C20.5 H37.5 N4 S2 -","- C164 H300 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.184","0.116","","0.152","","0.071","","","1.19","","","1.82","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505202","16.705","0.004","16.705","0.004","19.205","0.007","90","","90","","90","","5359","3","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C24 H42 N4 S2 -","- C24.2 H33 N4 S2 -","- C193.6 H264 N32 S16 -","8","0.5","","Succaw, Gary L.; Weakley, Timothy J. R.; Han, Fusan; Doxsee, Kenneth M.","Crystal Engineering with Bis(thiourea) Derivatives†","Crystal Growth & Design","2005","5","6","2288","","10.1021/cg050162c","","","0.71073","MoKα","","0.1536","0.1102","","","0.2229","0.2406","","","","","","1.243","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505203","11.4624","0.0008","9.5205","0.0006","20.8472","0.0017","90","","103.046","0.007","90","","2216.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Mn N2 O6 -","- C24 H24 Mn N2 O6 -","- C96 H96 Mn4 N8 O24 -","4","1","","Dobrzyńska, Danuta; Jerzykiewicz, Lucjan B.; Jezierska, Julia; Duczmal, Marek","Crystal Structure and Characterization of Manganese(II) Carboxylates: 3D Metal−Organic Frameworks","Crystal Growth & Design","2005","5","5","1945","","10.1021/cg050169u","","","0.71073","MoKα","","0.063","0.0404","","","0.0748","0.0827","","","","","","1.043","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505204","11.5301","0.0016","11.5301","0.0016","11.5301","0.0016","90","","90","","90","","1532.8","0.4","203","2","203","2","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- C10 H24 Cl N3 -","- C10 H24 Cl N3 -","- C40 H96 Cl4 N12 -","4","0.333333","","Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin","Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides","Crystal Growth & Design","2005","5","5","1881","","10.1021/cg050172d","","","0.71073","MoKα","","0.0813","0.0658","","","0.1772","0.1983","","","","","","1.087","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505205","9.6903","0.0012","9.6903","0.0012","34.257","0.006","90","","90","","90","","3216.8","0.8","203","2","203","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C10 H26 Br N3 O -","- C10 H26 Br N3 O -","- C80 H208 Br8 N24 O8 -","8","1","","Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin","Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides","Crystal Growth & Design","2005","5","5","1881","","10.1021/cg050172d","","","0.71073","MoKα","","0.1457","0.0585","","","0.0764","0.0922","","","","","","1.026","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505206","7.991","0.004","18.379","0.009","11.456","0.006","90","","91.82","0.03","90","","1681.7","1.5","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H26 Br N3 -","- C15 H26 Br N3 -","- C60 H104 Br4 N12 -","4","1","","Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin","Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides","Crystal Growth & Design","2005","5","5","1881","","10.1021/cg050172d","","","0.71073","MoKα","","0.1318","0.0587","","","0.0718","0.0838","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505207","11.978","0.002","37.836","0.006","14.948","0.003","90","","90","","90","","6774","2","203","2","203","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","","","- C15 H26 Cl N3 -","- C15 H26 Cl N3 -","- C240 H416 Cl16 N48 -","16","","","Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin","Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides","Crystal Growth & Design","2005","5","5","1881","","10.1021/cg050172d","","","0.71073","MoKα","","0.1401","0.068","","","0.1612","0.1952","","","","","","1.067","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505208","9.3242","0.0001","11.1757","0.0002","14.5623","0.0002","90","","96.671","0.001","90","","1507.18","0.04","223","2","223","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 Ag Cl O4 S2 -","- C13 H12 Ag Cl O4 S2 -","- C52 H48 Ag4 Cl4 O16 S8 -","4","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0347","0.0323","","","0.0847","0.0862","","","","","","1.006","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505209","9.2281","0.0001","11.2482","0.0001","14.3353","0.0001","90","","95.738","0.001","90","","1480.54","0.02","220","2","220","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 Ag B F4 S2 -","- C13 H12 Ag B F4 S2 -","- C52 H48 Ag4 B4 F16 S8 -","4","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0376","0.0319","","","0.0765","0.0787","","","","","","0.975","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505210","4.9373","0.0001","19.9552","0.0005","16.2439","0.0004","90","","90.882","0.002","90","","1600.24","0.06","220","2","220","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 Ag F3 O2 S2 -","- C15 H12 Ag F3 O2 S2 -","- C60 H48 Ag4 F12 O8 S8 -","4","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0904","0.0577","","","0.136","0.1476","","","","","","0.986","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505211","8.953","0.002","19.407","0.002","10.506","0.002","90","","110","0.02","90","","1715.3","0.6","220","2","220","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 Ag F3 O3 S3 -","- C14 H12 Ag F3 O3 S3 -","- C56 H48 Ag4 F12 O12 S12 -","4","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.077","0.0504","","","0.1223","0.1302","","","","","","0.877","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505212","12.526","0.002","12.905","0.002","13.186","0.002","109.48","0.02","109.36","0.02","100.79","0.02","1786.5","0.7","220","2","220","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C28 H24 Ag2 F6 O6 S6 -","- C28.002 H24 Ag2 F6 O6 S6 -","- C56.004 H48 Ag4 F12 O12 S12 -","2","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0561","0.048","","","0.1313","0.1364","","","","","","1.017","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505213","6.9224","0.0001","11.1849","0.0002","12.859","0.0002","87.831","0.001","84.059","0.001","76.027","0.001","960.89","0.03","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C17 H12 Ag F7 O2 S2 -","- C17 H12 Ag F7 O2 S2 -","- C34 H24 Ag2 F14 O4 S4 -","2","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0317","0.0311","","","0.0853","0.0859","","","","","","1.056","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505214","10.9903","0.0002","11.3039","0.0002","13.0694","0.0002","99.339","0.001","90.383","0.001","99.491","0.001","1579.27","0.05","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C30 H24 Ag2 F4 O4 S4 -","- C30 H24 Ag2 F4 O4 S4 -","- C60 H48 Ag4 F8 O8 S8 -","2","1","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0369","0.0317","","","0.0792","0.0839","","","","","","0.947","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505215","10.0741","0.0002","12.2003","0.0002","4.63","0.0001","90","","90","","90","","569.06","0.019","220","2","220","2","","","","","","","Synthesized by the authors. See text","3","P 21 21 2","P 2 2ab","18","","","","- C13 H12 S2 -","- C13 H12 S2 -","- C26 H24 S4 -","2","0.5","","Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François","Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO-","Crystal Growth & Design","2005","5","5","1897","","10.1021/cg050180u","","","1.54178","CuKα","","0.0328","0.0314","","","0.0852","0.0864","","","","","","1.051","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505216","14.6317","0.0002","14.6317","0.0002","15.875","0.0006","90","","90","","90","","3398.63","0.14","293","2","293","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C20 H44 Cl2 Cu O12 S4 -","- C20 H44 Cl2 Cu O12 S4 -","- C80 H176 Cl8 Cu4 O48 S16 -","4","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Ribas, Joan","Flexible Disulfoxides as Bridging Ligands for Copper(II) Coordination Architectures: Fine Tuning the Complex Structures by Ligand Modifications","Crystal Growth & Design","2005","5","5","1919","","10.1021/cg050181m","","","0.71073","MoKα","","0.1034","0.0598","","","0.1482","0.1807","","","","","","1.091","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505217","11.844","0.004","11.924","0.004","27.91","0.009","94.575","0.005","99.754","0.005","90.059","0.005","3872","2","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C90 H194 Cl14 Cu4 O48 S16 -","- C89 H184 Cl14 Cu4 O48 S16 -","- C89 H184 Cl14 Cu4 O48 S16 -","1","0.5","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Ribas, Joan","Flexible Disulfoxides as Bridging Ligands for Copper(II) Coordination Architectures: Fine Tuning the Complex Structures by Ligand Modifications","Crystal Growth & Design","2005","5","5","1919","","10.1021/cg050181m","","","0.71073","MoKα","","0.2334","0.0811","","","0.133","0.1572","","","","","","0.719","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505218","8.7482","0.0009","9.081","0.0007","20.5411","0.0018","92.143","0.007","93.011","0.008","94.315","0.007","1623.6","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H26 N12 Ni O4 -","- C34 H26 N12 Ni O4 -","- C68 H52 N24 Ni2 O8 -","2","1","","Nayak, Malabika; Koner, Rajesh; Stoeckli-Evans, Helen; Mohanta, Sasankasekhar","Hydrogen-Bonded One-Dimensional Zigzag Pairs and Helical Dimers in an Enolic 4-Terpyridone Based Nickel(II) Dicyanamide Supramolecule","Crystal Growth & Design","2005","5","5","1907","","10.1021/cg050182e","","","0.71073","MoKα","","0.0677","0.0394","","","0.0756","0.081","","","","","","0.885","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505219","8.5398","0.0006","10.75","0.0009","18.1077","0.0011","90","","90","","90","","1662.3","0.2","153","2","153","2","","","","","","","?","6","P 21 21 21","P 2ac 2ab","19","","","","- C5 H16 Mo3 N2 O14 S -","- C5 H16 Mo3 N2 O14 S -","- C20 H64 Mo12 N8 O56 S4 -","4","1","","Muller, Eric A.; Cannon, Robert J.; Sarjeant, Amy Narducci; Ok, Kang Min; Halasyamani, P. Shiv; Norquist, Alexander J.","Directed Synthesis of Noncentrosymmetric Molybdates","Crystal Growth & Design","2005","5","5","1913","","10.1021/cg050184z","","","0.7107","MoKα","","0.0482","0.0231","","0.0527","0.0524","0.0524","","","","","","0.8768","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505220","36.4719","0.0018","16.3165","0.0009","7.847","0.0006","90","","90","","90","","4669.7","0.5","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C47 H73 N7 O7 -","- C47 H73 N7 O7 -","- C188 H292 N28 O28 -","4","1","","Chmielewski, Michał J.; Dobrzycki, Łukasz; Jurczak, Janusz; Woźniak, Krzysztof","Unusual Anion−Anion Assembly inside a Macrocycle-Defined Channel in the Crystal Lattice","Crystal Growth & Design","2005","5","4","1339","","10.1021/cg0501938","","","0.71073","MoKα","","0.0767","0.0509","","","0.1088","0.1295","","","","","","1.039","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505221","20.735","0.005","9.323","0.003","20.978","0.005","90","","95.8","0.04","90","","4034.5","1.9","293","2","293","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H30 Cu Mo0.5 N8 O3 -","- C14 H30 Cu Mo0.5 N8 O3 -","- C112 H240 Cu8 Mo4 N64 O24 -","8","1","","Mukhopadhyay, Uday; Bernal, Ivan","Self-Assembled Hexameric Water Clusters Stabilized by a Cyano-Bridged Trimetallic Complex","Crystal Growth & Design","2005","5","5","1687","","10.1021/cg0501940","","x-ray","0.71073","MoKα","","0.0421","0.0269","","","0.062","0.0673","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505222","19.27","0.003","19.906","0.003","25.249","0.003","90","","90","","90","","9685","2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2:3 co-crystal Form I of Trimesic acid and 1,2-bis(4-pyridyl)ethane","2:3 co-crystal Form I of Benzene-1,3,5-tricarboxylic acid and 1,2-bis(4-pyridyl)ethane","","- C54 H48 N6 O12 -","- C54 H48 N6 O12 -","- C432 H384 N48 O96 -","8","1","","Shattock, Tanise R.; Vishweshwar, Peddy; Wang, Zhenqiang; Zaworotko, Michael J.","18-Fold Interpenetration and Concomitant Polymorphism in the 2:3 Co-Crystal of Trimesic Acid and 1,2-Bis(4-pyridyl)ethane†","Crystal Growth & Design","2005","5","6","2046","","10.1021/cg0501985","","","0.71073","MoKα","","0.0915","0.0557","","","0.1262","0.1548","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4505223","10.344","0.002","12.313","0.002","18.914","0.004","90","","94.309","0.004","90","","2402.2","0.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2:3 co-crystal Form II of Trimesic acid and 1,2-bis(4-pyridyl)ethane","2:3 co-crystal Form II of Benzene-1,3,5-tricarboxylic acid and 1,2-bis(4-pyridyl)ethane","","- C54 H48 N6 O12 -","- C54 H48 N6 O12 -","- C108 H96 N12 O24 -","2","0.5","","Shattock, Tanise R.; Vishweshwar, Peddy; Wang, Zhenqiang; Zaworotko, Michael J.","18-Fold Interpenetration and Concomitant Polymorphism in the 2:3 Co-Crystal of Trimesic Acid and 1,2-Bis(4-pyridyl)ethane†","Crystal Growth & Design","2005","5","6","2046","","10.1021/cg0501985","","","0.71073","MoKα","","0.135","0.0626","","","0.1241","0.1484","","","","","","0.906","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505224","17.576","0.003","4.9526","0.0009","22.989","0.004","90","","97.321","0.004","90","","1984.8","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 N4 O6 -","- C20 H16 N4 O6 -","- C80 H64 N16 O24 -","4","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.0888","0.048","","","0.117","0.1315","","","","","","0.82","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505225","4.928","0.002","10.098","0.004","19.901","0.008","90","","95.029","0.009","90","","986.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 N4 O6 -","- C20 H16 N4 O6 -","- C40 H32 N8 O12 -","2","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.2995","0.0635","","","0.1244","0.1803","","","","","","1.348","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505226","5.0624","0.0016","10.196","0.004","10.958","0.004","105.163","0.01","100.651","0.006","97.373","0.006","527.1","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H20 N4 O6 -","- C22 H20 N4 O6 -","- C22 H20 N4 O6 -","1","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.1607","0.0802","","","0.1421","0.1862","","","","","","1.169","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505227","5.2321","0.0008","7.773","0.0012","14.009","0.002","88.809","0.003","79.727","0.003","72.899","0.003","535.51","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H20 N4 O6 -","- C22 H20 N4 O6 -","- C22 H20 N4 O6 -","1","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.0741","0.062","","","0.1693","0.1946","","","","","","1.106","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505228","5.1373","0.0007","5.1989","0.0008","23.223","0.003","86.042","0.003","88.088","0.003","86.449","0.003","617.32","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H28 N4 O6 -","- C26 H28 N4 O6 -","- C26 H28 N4 O6 -","1","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.0926","0.0611","","","0.1561","0.1894","","","","","","0.95","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505229","5.1801","0.001","5.2099","0.001","23.409","0.005","88.219","0.006","85.486","0.004","88.992","0.005","629.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H28 N4 O6 -","- C26 H28 N4 O6 -","- C26 H28 N4 O6 -","1","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.1564","0.0654","","","0.1609","0.2468","","","","","","0.867","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505230","5.215","0.002","6.86","0.003","18.858","0.007","84.79","0.007","89.247","0.007","80.962","0.007","663.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 N4 O6 -","- C28 H32 N4 O6 -","- C28 H32 N4 O6 -","1","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.1266","0.0627","","","0.1479","0.1951","","","","","","0.885","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505231","5.2263","0.001","6.9022","0.0013","19.145","0.004","94.246","0.004","90.234","0.004","100.533","0.004","677","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 N4 O6 -","- C28 H32 N4 O6 -","- C28 H32 N4 O6 -","1","0.5","","Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W.","A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design","Crystal Growth & Design","2005","5","6","2313","","10.1021/cg050204x","","","0.71073","MoKα","","0.202","0.0629","","","0.1771","0.2082","","","","","","1.163","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505232","12.8498","0.0014","9.0701","0.001","19.779","0.002","90","","100.132","0.002","90","","2269.3","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 Cu N O3 S2 -","- C21 H24 Cu N O3 S2 -","- C84 H96 Cu4 N4 O12 S8 -","4","1","","Park, Ki-Min; Yoon, Il; Seo, Joobeom; Lee, Ji-Eun; Kim, Jineun; Choi, Kyu Seong; Jung, Ok-Sang; Lee, Shim Sung","Two-Dimensional Square-Grid versus One-Dimensional Double-Stranded Networks: Counterion Regulation of the Formation of Macrocycle-Based Copper(I) Coordination Frameworks","Crystal Growth & Design","2005","5","5","1707","","10.1021/cg050220u","","","0.71073","MoKα","","0.1513","0.0658","","","0.1613","0.2035","","","","","","0.953","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505233","9.9125","0.0019","10.2339","0.0019","13.055","0.002","102.88","0.004","102.706","0.004","94.705","0.003","1247.4","0.4","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H27 Cu I N O3 S2 -","- C22 H27 Cu I N O3 S2 -","- C44 H54 Cu2 I2 N2 O6 S4 -","2","1","","Park, Ki-Min; Yoon, Il; Seo, Joobeom; Lee, Ji-Eun; Kim, Jineun; Choi, Kyu Seong; Jung, Ok-Sang; Lee, Shim Sung","Two-Dimensional Square-Grid versus One-Dimensional Double-Stranded Networks: Counterion Regulation of the Formation of Macrocycle-Based Copper(I) Coordination Frameworks","Crystal Growth & Design","2005","5","5","1707","","10.1021/cg050220u","","","0.71073","MoKα","","0.2139","0.0759","","","0.1805","0.26","","","","","","0.988","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505234","7.5099","0.0007","9.1405","0.0011","10.2177","0.0013","72.744","0.003","72.976","0.003","74.679","0.005","628.27","0.13","293","2","293","2","","","","","","","","2","P -1","-P 1","2","Cis-DPDSB","Cis,cis-2,5-Diphenyl-1,4-distyrylbenzene","","- C34 H26 -","- C34 H26 -","- C34 H26 -","1","0.5","","Xie, Zengqi; Liu, Linlin; Yang, Bing; Yang, Guangdi; Ye, Ling; Li, Min; Ma, Yuguang","Polymorphism of 2,5-Diphenyl-1,4-distyrylbenzene with Two cis Double Bonds: The Essential Role of Aromatic CH/π Hydrogen Bonds","Crystal Growth & Design","2005","5","5","1959","","10.1021/cg0502441","","x-ray","0.71073","MoKα","","0.0731","0.0506","","","0.1508","0.1679","","","","","","1.055","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505235","5.4867","0.0011","12.864","0.003","17.893","0.004","97.67","0.03","90.92","0.03","96","0.03","1244.2","0.5","293","2","293","2","","","","","","","","2","P -1","-P 1","2","","","","- C34 H26 -","- C34 H26 -","- C68 H52 -","2","1","","Xie, Zengqi; Liu, Linlin; Yang, Bing; Yang, Guangdi; Ye, Ling; Li, Min; Ma, Yuguang","Polymorphism of 2,5-Diphenyl-1,4-distyrylbenzene with Two cis Double Bonds: The Essential Role of Aromatic CH/π Hydrogen Bonds","Crystal Growth & Design","2005","5","5","1959","","10.1021/cg0502441","","","0.71073","MoKα","","0.2091","0.0646","","","0.0887","0.1086","","","","","","0.971","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505236","17.562","0.003","17.562","0.003","26.71","0.005","90","","90","","120","","7134","2","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C78 H106 N6 Ni2 O37 -","- C78 H60 N6 Ni2 O36.96 -","- C234 H180 N18 Ni6 O110.88 -","3","0.166667","","Sun, Yan-Qiong; Zhang, Jie; Ju, Zhan-Feng; Yang, Guo-Yu","Two-Dimensional Noninterpenetrating Transition Metal Coordination Polymers with Large Honeycomb-like Hexagonal Cavities Constructed from a Carboxybenzyl Viologen Ligand","Crystal Growth & Design","2005","5","5","1939","","10.1021/cg050249y","","","0.71073","MoKα","","0.0806","0.0769","","","0.2152","0.2205","","","","","","1.089","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505237","17.7161","0.0008","17.7161","0.0008","26.869","0.003","90","","90","","120","","7303.3","0.9","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C78 H106 Co2 N6 O37 -","- C78 H60 Co2 N6 O36.96 -","- C234 H180 Co6 N18 O110.88 -","3","0.166667","","Sun, Yan-Qiong; Zhang, Jie; Ju, Zhan-Feng; Yang, Guo-Yu","Two-Dimensional Noninterpenetrating Transition Metal Coordination Polymers with Large Honeycomb-like Hexagonal Cavities Constructed from a Carboxybenzyl Viologen Ligand","Crystal Growth & Design","2005","5","5","1939","","10.1021/cg050249y","","","0.71073","MoKα","","0.0864","0.0773","","","0.2062","0.2159","","","","","","1.129","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505238","15.2821","0.0017","21.417","0.002","9.215","0.001","90","","104.901","0.002","90","","2914.6","0.5","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C48 H50 N8 O28 P6 Zn4 -","- C48 H32 N8 O28 P6 Zn4 -","- C96 H64 N16 O56 P12 Zn8 -","2","0.25","","Venegas-Yazigi, D.; Cubillos, M.; Le Fur, E.; Pivan, J. Y.; Garland, M. T.; Baggio, R.; Spodine, E.","Organo-Inorganic Tetrameric Zinc Cluster with Phosphate Bridges. [Zn4(HPO4)4(phen)4](H3PO4)2(H2O)4","Crystal Growth & Design","2005","5","5","1695","","10.1021/cg0502690","","","0.71073","MoKα","","0.0582","0.0522","","","0.1345","0.1389","","","","","","1.108","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505239","6.2323","0.0009","33.014","0.005","6.4077","0.0009","90","","115.897","0.002","90","","1186","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","myo-inositol 1,3,5-orthobenzoate","","- C13 H14 O6 -","- C13 H14 O6 -","- C52 H56 O24 -","4","1","","Bhosekar, Gaurav; Murali, Chebrolu; Gonnade, Rajesh G.; Shashidhar, Mysore S.; Bhadbhade, Mohan M.","Identical Molecular Strings Woven Differently by Intermolecular Interactions in Dimorphs ofmyo-Inositol 1,3,5-Orthobenzoate","Crystal Growth & Design","2005","5","5","1977","","10.1021/cg050272j","","","0.71073","MoKα","","0.0465","0.0435","","","0.1029","0.1048","","","","","","1.147","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505240","17.08","0.004","6.3196","0.0014","11.361","0.003","90","","108.087","0.004","90","","1165.7","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","myo-inositol 1,3,5-orthobenzoate","","- C13 H14 O6 -","- C13 H14 O6 -","- C52 H56 O24 -","4","1","","Bhosekar, Gaurav; Murali, Chebrolu; Gonnade, Rajesh G.; Shashidhar, Mysore S.; Bhadbhade, Mohan M.","Identical Molecular Strings Woven Differently by Intermolecular Interactions in Dimorphs ofmyo-Inositol 1,3,5-Orthobenzoate","Crystal Growth & Design","2005","5","5","1977","","10.1021/cg050272j","","","0.71073","MoKα","","0.04","0.0343","","","0.0921","0.0958","","","","","","1.054","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505241","14.544","0.003","28.47","0.006","10.646","0.002","89.78","0.03","126.43","0.04","89.98","0.03","3547","2","90","2","90","2","","","","","","","","5","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","diaqua(15-crown-5)manganese(II) nitrate","","- C10 H24 Mn N2 O13 -","- C10 H24 Mn N2 O13 -","- C80 H192 Mn8 N16 O104 -","8","","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.0361","0.0285","","","0.0689","0.0731","","","","","","1.011","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505242","14.73","0.003","28.329","0.006","10.786","0.003","89.95","0.03","126.05","0.04","90.05","0.03","3639","2","294","2","294","2","","","","","","","","5","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","diaqua(15-crown-5)manganese(II) nitrate","","- C10 H24 Mn N2 O13 -","- C10 H24 Mn N2 O13 -","- C80 H192 Mn8 N16 O104 -","8","","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.1099","0.0458","","","0.0955","0.1143","","","","","","0.948","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505243","14.647","0.003","14.127","0.003","25.823","0.005","90","","96.22","0.03","90","","5311.8","1.9","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diaqua(15-crown-5)manganese(II) nitrate","","- C10 H24 Mn N2 O13 -","- C10 H24 Mn N2 O13 -","- C120 H288 Mn12 N24 O156 -","12","3","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.1595","0.0505","","","0.0959","0.1264","","","","","","0.929","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505244","14.728","0.002","14.154","0.002","26.168","0.003","90","","96.44","0.01","90","","5420.6","1.2","267","2","267","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diaqua(15-crown-5)manganese(II) nitrate","","- C10 H24 Mn N2 O13 -","- C10 H24 Mn N2 O13 -","- C120 H288 Mn12 N24 O156 -","12","3","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.1195","0.0392","","","0.0921","0.1227","","","","","","0.91","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505245","11.355","0.002","11.355","0.002","27.183","0.005","90","","90","","90","","3504.9","1.1","90","2","90","2","","","","","","","","5","P 43","P 4cw","78","","diaqua(15-crown-5)manganese(II) nitrate","","- C10 H24 Mn N2 O13 -","- C10 H24 Mn N2 O13 -","- C80 H192 Mn8 N16 O104 -","8","2","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.0535","0.0361","","","0.0706","0.0755","","","","","","1.025","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505246","11.482","0.002","11.482","0.002","27.424","0.006","90","","90","","90","","3615.5","1.2","294","2","294","2","","","","","","","","5","P 43","P 4cw","78","","diaqua(15-crown-5)manganese(II) nitrate","","- C10 H24 Mn N2 O13 -","- C10 H24 Mn N2 O13 -","- C80 H192 Mn8 N16 O104 -","8","2","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.1209","0.0466","","","0.0819","0.1011","","","","","","0.947","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505247","14.521","0.001","14.229","0.001","68.443","0.003","90","","96.26","0.01","90","","14057.3","1.5","90","0.2","90","0.2","","","","","","","","5","B 1 21 1","P 2yb (1/2*x,y,-1/2*x+z)","4","diaqua(15-crown-5)iron(II) nitrate","","","- C10 H24 Fe N2 O13 -","- C10 H24 Fe N2 O13 -","- C320 H768 Fe32 N64 O416 -","32","","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.1222","0.0462","","","0.1075","0.134","","","","","","1.016","","","","has coordinates,has disorder","179587","2020-10-21","18:00:00",""
"4505248","14.541","0.001","14.191","0.001","25.647","0.003","90","","96.21","0.01","90","","5261.2","0.8","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diaqua(15-crown-5)iron(II) nitrate","","- C10 H24 Fe N2 O13 -","- C10 H24 Fe N2 O13 -","- C120 H288 Fe12 N24 O156 -","12","3","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.0643","0.0345","","","0.0861","0.0982","","","","","","1.042","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505249","14.664","0.002","14.192","0.002","25.991","0.003","90","","96.23","0.01","90","","5377.1","1.2","263","2","263","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diaqua(15-crown-5)iron(II) nitrate","","- C10 H24 Fe N2 O13 -","- C10 H24 Fe N2 O13 -","- C120 H288 Fe12 N24 O156 -","12","3","","Hao, Xiang; Siegler, Maxime A.; Parkin, Sean; Brock, Carolyn Pratt","[M(H2O)2(15-crown-5)](NO3)2: A System Rich in Polymorphic and Modulated Phases†","Crystal Growth & Design","2005","5","6","2225","","10.1021/cg050312j","","","0.71073","MoKα","","0.0985","0.0385","","","0.0958","0.1213","","","","","","0.968","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505250","8.179","0.005","15.831","0.003","16.908","0.007","90","","101.67","0.04","90","","2144","1.7","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","methoxynitrospiropyran 1b","3',3'-dimethyl-6-methoxy-8-nitro-1'-phenylspiro[2H-1-benzopyran-2,2'-indoline","","- C25 H22 N2 O4 -","- C25 H22 N2 O4 -","- C100 H88 N8 O16 -","4","1","","Vary, Michael W.; McBride, J. Michael","Using Spiropyran Fragment Superposition To Assign the EPR Spectrum of Localized Triplet Excitation on a Distorted Aromatic Nitro Group†","Crystal Growth & Design","2005","5","6","2036","","10.1021/cg0503907","","","0.7107","MoKα","","","0.063","","","","0.058","","","","","","","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505251","8.26","0.003","17.21","0.005","8.341","0.004","90","","105.36","0.04","90","","1143.4","0.8","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","ethoxynitrospiropyran 1b","3',3'-dimethyl-6-Ethoxy-8-nitro-1'-phenylspiro[2H-1-benzopyran-2,2'-indoline","","- C26 H24 N2 O4 -","- C26 H24 N2 O4 -","- C52 H48 N4 O8 -","2","1","","Vary, Michael W.; McBride, J. Michael","Using Spiropyran Fragment Superposition To Assign the EPR Spectrum of Localized Triplet Excitation on a Distorted Aromatic Nitro Group†","Crystal Growth & Design","2005","5","6","2036","","10.1021/cg0503907","","","0.7107","MoKα","","","0.046","","","","0.06","","","","","","","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505252","8.474","0.003","10.496","0.001","14.552","0.004","76.89","0.02","86.59","0.03","82.58","0.02","1249.4","0.6","296","","296","","","","","","","","","4","P -1","-P 1","2","Methylmethoxynitrospiropyran_Benzene_Solvate","3,3',3'-trimethyl-6-methoxy-8-nitro-1'-phenylspiro[2H-1-benzopyran -2,2'-indoline benzene solvate","","- C29 H27 N2 O4 -","- C29 H27 N2 O4 -","- C58 H54 N4 O8 -","2","1","","Vary, Michael W.; McBride, J. Michael","Using Spiropyran Fragment Superposition To Assign the EPR Spectrum of Localized Triplet Excitation on a Distorted Aromatic Nitro Group†","Crystal Growth & Design","2005","5","6","2036","","10.1021/cg0503907","","","0.7107","MoKα","","","0.049","","","","0.06","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505253","33.167","0.007","9.954","0.002","14.988","0.003","90","","110.91","0.03","90","","4622.3","1.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 4,4'-bipyridine - 1,2-bis(4-pyridyl)ethane","","- C25 H26 N3 O6 -","- C25 H26 N3 O6 -","- C200 H208 N24 O48 -","8","1","","Bhogala, Balakrishna R.; Basavoju, Srinivas; Nangia, Ashwini","Three-Component Carboxylic Acid−Bipyridine Lattice Inclusion Host. Supramolecular Synthesis of Ternary Cocrystals","Crystal Growth & Design","2005","5","5","1683","","10.1021/cg058012p","","","0.71073","MoKα","","0.1025","0.053","","","0.1122","0.1425","","","","","","1.064","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505254","5.711","0.0004","14.1003","0.001","18.396","0.0013","86.1","0.001","84.56","0.001","82.123","0.001","1458.51","0.18","100","2","373","2","","","","","","","","4","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - p-xylene","","- C32 H37 N3 O6 -","- C32 H37 N3 O6 -","- C64 H74 N6 O12 -","2","1","","Bhogala, Balakrishna R.; Basavoju, Srinivas; Nangia, Ashwini","Three-Component Carboxylic Acid−Bipyridine Lattice Inclusion Host. Supramolecular Synthesis of Ternary Cocrystals","Crystal Growth & Design","2005","5","5","1683","","10.1021/cg058012p","","","0.71073","MoKα","","0.0722","0.0641","","","0.1637","0.1704","","","","","","1.04","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4505255","6.1002","0.0012","12.531","0.003","25.138","0.005","90","","93.73","0.03","90","","1917.5","0.7","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl-N-oxy)ethylene - 4,4'-bipyridine","","- C20 H21 N2 O7 -","- C20 H21 N2 O7 -","- C80 H84 N8 O28 -","4","1","","Bhogala, Balakrishna R.; Basavoju, Srinivas; Nangia, Ashwini","Three-Component Carboxylic Acid−Bipyridine Lattice Inclusion Host. Supramolecular Synthesis of Ternary Cocrystals","Crystal Growth & Design","2005","5","5","1683","","10.1021/cg058012p","","","0.71073","MoKα","","0.1171","0.0618","","","0.1488","0.1888","","","","","","1.028","","","","has coordinates","179587","2020-10-21","18:00:00",""
"4511548","7.616","0.0019","19.37","0.005","15.222","0.004","90","","98.312","0.005","90","","2222","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H17 Co N2 O5.5 -","- C26 H17 Co N2 O5.5 -","- C104 H68 Co4 N8 O22 -","4","1","","Han, Zheng-Bo; Cheng, Xiao-Ning; Chen, Xiao-Ming","Effect of the Size of Aromatic Chelate Ligands on the Frameworks of Metal Dicarboxylate Polymers: From Helical Chains to 2-D Networks","Crystal Growth & Design","2005","5","2","695","","10.1021/cg049834+","","","0.71073","MoKα","","0.0975","0.0771","","","0.1775","0.1887","","","","","","1.1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511549","7.6777","0.0008","19.0226","0.0019","15.2344","0.0015","90","","97.407","0.002","90","","2206.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H17 N2 Ni O5.5 -","- C26 H17 N2 Ni O5.5 -","- C104 H68 N8 Ni4 O22 -","4","1","","Han, Zheng-Bo; Cheng, Xiao-Ning; Chen, Xiao-Ming","Effect of the Size of Aromatic Chelate Ligands on the Frameworks of Metal Dicarboxylate Polymers: From Helical Chains to 2-D Networks","Crystal Growth & Design","2005","5","2","695","","10.1021/cg049834+","","","0.71073","MoKα","","0.0786","0.0592","","","0.1274","0.136","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511550","16.295","0.003","16.093","0.003","20.271","0.004","90","","110.33","0.003","90","","4984.6","1.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H38 Co2 N8 O13 -","- C56 H38 Co2 N8 O13 -","- C224 H152 Co8 N32 O52 -","4","1","","Han, Zheng-Bo; Cheng, Xiao-Ning; Chen, Xiao-Ming","Effect of the Size of Aromatic Chelate Ligands on the Frameworks of Metal Dicarboxylate Polymers: From Helical Chains to 2-D Networks","Crystal Growth & Design","2005","5","2","695","","10.1021/cg049834+","","","0.71073","MoKα","","0.0489","0.0401","","","0.1101","0.116","","","","","","1.034","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511551","16.2122","0.0014","16.0154","0.0014","20.1031","0.0016","90","","110.772","0.002","90","","4880.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H38 N8 Ni2 O13 -","- C56 H38 N8 Ni2 O13 -","- C224 H152 N32 Ni8 O52 -","4","1","","Han, Zheng-Bo; Cheng, Xiao-Ning; Chen, Xiao-Ming","Effect of the Size of Aromatic Chelate Ligands on the Frameworks of Metal Dicarboxylate Polymers: From Helical Chains to 2-D Networks","Crystal Growth & Design","2005","5","2","695","","10.1021/cg049834+","","","0.71073","MoKα","","0.0772","0.0559","","","0.1391","0.1503","","","","","","1.024","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511552","6.852","0.001","17.012","0.001","17.31","0.001","90","","90","","90","","2017.8","0.3","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","1,7-Phenanthroline + water + HCl","","","- C24 H21 Cl N4 O2 -","- C24 H21 Cl N4 O2 -","- C96 H84 Cl4 N16 O8 -","4","1","","Arora, Kapildev K.; Pedireddi, V. R.","Poly(pseudo)rotaxane-like Network Mediated by Hydrogen Bonds in the Solid-State Structure of 1,7-Phenanthroline","Crystal Growth & Design","2005","5","4","1309","","10.1021/cg050038t","","","0.71073","MoKα","","0.0781","0.0491","","","0.1208","0.1335","","","","","","0.995","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511553","8.926","0.002","9.101","0.002","12.193","0.003","72.56","0.01","72.35","0.01","88.1","0.01","898.7","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,7-Phenanthroline","","","- C24 H16 N4 -","- C24 H16 N4 -","- C48 H32 N8 -","2","1","","Arora, Kapildev K.; Pedireddi, V. R.","Poly(pseudo)rotaxane-like Network Mediated by Hydrogen Bonds in the Solid-State Structure of 1,7-Phenanthroline","Crystal Growth & Design","2005","5","4","1309","","10.1021/cg050038t","","","0.71073","MoKα","","0.0568","0.046","","","0.1059","0.1127","","","","","","1.022","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511554","16.309","0.003","14.636","0.003","13.941","0.004","90","","93.67","0.03","90","","3320.9","1.3","163","2","163","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C22 H25 Ag2 F12 N7 P2 S -","- C22 H25 Ag2 F12 N7 P2 S -","- C88 H100 Ag8 F48 N28 P8 S4 -","4","1","","Amoore, Jarrod J. M.; Black, Cory A.; Hanton, Lyall R.; Spicer, Mark D.","Increasing Structural Dimensionality in Ag(I) Coordination Polymers Formed from the Same Flexible Multimodal Thioether Pyrazine Ligand","Crystal Growth & Design","2005","5","3","1255","","10.1021/cg050011+","","","0.71073","MoKα","","0.1154","0.1027","","","0.2656","0.2704","","","","","","1.186","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511555","9.9188","0.0002","12.8858","0.0005","11.7449","0.0004","90","","100.646","0.002","90","","1475.3","0.08","150","2","150","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","CBC","","","- C10 H10 Ag F6 N4 P S -","- C10 H10 Ag F6 N4 P S -","- C40 H40 Ag4 F24 N16 P4 S4 -","4","1","","Amoore, Jarrod J. M.; Black, Cory A.; Hanton, Lyall R.; Spicer, Mark D.","Increasing Structural Dimensionality in Ag(I) Coordination Polymers Formed from the Same Flexible Multimodal Thioether Pyrazine Ligand","Crystal Growth & Design","2005","5","3","1255","","10.1021/cg050011+","","x-ray","0.71073","MoKα","","0.0404","0.0276","","","0.0575","0.062","","","","","","1.053","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511556","10.7108","0.0001","13.2616","0.0002","20.7926","0.0003","90","","92.5034","0.0004","90","","2950.61","0.07","123","2","123","2","","","","","","","synthesis as described","8","P 1 21/a 1","-P 2yab","14","JAAGB","","","- C21 H23 Ag2 B2 F8 N9 O2 S2 -","- C21 H23 Ag2 B2 F8 N9 O2 S2 -","- C84 H92 Ag8 B8 F32 N36 O8 S8 -","4","1","","Amoore, Jarrod J. M.; Black, Cory A.; Hanton, Lyall R.; Spicer, Mark D.","Increasing Structural Dimensionality in Ag(I) Coordination Polymers Formed from the Same Flexible Multimodal Thioether Pyrazine Ligand","Crystal Growth & Design","2005","5","3","1255","","10.1021/cg050011+","","x-ray","0.71073","MoKα","","0.0299","0.0235","","","0.0505","0.0524","","","","","","1.059","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511557","8.767","0.004","12.523","0.006","10.476","0.005","90","","100.963","0.007","90","","1129.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 Cd N14 O8 -","- C12 H20 Cd N14 O8 -","- C24 H40 Cd2 N28 O16 -","2","0.5","","Yi, Long; Yang, Xing; Lu, Tongbu; Cheng, Peng","Self-Assembly of Right-Handed Helical Infinite Chain, One- and Two-Dimensional Coordination Polymers Tuned via Anions","Crystal Growth & Design","2005","5","3","1215","","10.1021/cg049587+","","","0.71073","MoKα","","0.0517","0.0356","","","0.0888","0.0988","","","","","","0.997","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511558","8.661","0.004","12.412","0.005","10.288","0.004","90","","100.717","0.007","90","","1086.7","0.8","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 N14 O8 Zn -","- C12 H20 N14 O8 Zn -","- C24 H40 N28 O16 Zn2 -","2","0.5","","Yi, Long; Yang, Xing; Lu, Tongbu; Cheng, Peng","Self-Assembly of Right-Handed Helical Infinite Chain, One- and Two-Dimensional Coordination Polymers Tuned via Anions","Crystal Growth & Design","2005","5","3","1215","","10.1021/cg049587+","","","0.71073","MoKα","","0.0385","0.0304","","","0.0777","0.0825","","","","","","1.041","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511559","9.631","0.003","9.631","0.003","12.325","0.004","90","","90","","90","","1143.2","0.6","273","2","273","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C6 H8 Cl2 N6 Zn -","- C6 H8 Cl2 N6 Zn -","- C24 H32 Cl8 N24 Zn4 -","4","0.5","","Yi, Long; Yang, Xing; Lu, Tongbu; Cheng, Peng","Self-Assembly of Right-Handed Helical Infinite Chain, One- and Two-Dimensional Coordination Polymers Tuned via Anions","Crystal Growth & Design","2005","5","3","1215","","10.1021/cg049587+","","","0.71073","MoKα","","0.0571","0.0493","","","0.162","0.1685","","","","","","1.125","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511560","8.404","0.003","8.618","0.003","10.385","0.003","66.379","0.004","76.161","0.005","77.081","0.004","662.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H24 Cd Cl2 N12 O12 -","- C12 H24 Cd Cl2 N12 O12 -","- C12 H24 Cd Cl2 N12 O12 -","1","0.5","","Yi, Long; Yang, Xing; Lu, Tongbu; Cheng, Peng","Self-Assembly of Right-Handed Helical Infinite Chain, One- and Two-Dimensional Coordination Polymers Tuned via Anions","Crystal Growth & Design","2005","5","3","1215","","10.1021/cg049587+","","","0.71073","MoKα","","0.0577","0.0518","","","0.1387","0.1451","","","","","","1.11","","","","has coordinates,has disorder","179662","2020-10-21","18:00:00",""
"4511561","7.604","0.008","13.403","0.004","16.366","0.008","109.47","0.03","98.36","0.06","99.17","0.05","1516.8","1.9","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H25 N11 O16 -","- C23 H25 N11 O16 -","- C46 H50 N22 O32 -","2","1","","MacDonald, John C.; Yigit, Mehmet V.; Mychajlonka, Kyle","Two Concomitant Polymorphs of a Supramolecular Model of the Asp···His···Ser Catalytic Triad","Crystal Growth & Design","2005","5","6","2248","","10.1021/cg050092+","","","0.71069","MoKα","","0.1103","0.0778","","","0.2249","0.2537","","","","","","1.056","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511562","33.908","0.007","7.765","0.001","25.389","0.006","90","","114.74","0.02","90","","6071","2","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H25 N11 O16 -","- C23 H25 N11 O16 -","- C184 H200 N88 O128 -","8","1","","MacDonald, John C.; Yigit, Mehmet V.; Mychajlonka, Kyle","Two Concomitant Polymorphs of a Supramolecular Model of the Asp···His···Ser Catalytic Triad","Crystal Growth & Design","2005","5","6","2248","","10.1021/cg050092+","","","0.71069","MoKα","","0.0735","0.0506","","","0.1322","0.1458","","","","","","1.033","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511563","12.6912","0.0018","13.367","0.003","16.295","0.003","97","0.02","102.73","0.013","117.685","0.015","2305.8","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H43 Mn2 N5 O16 -","- C50 H43 Mn2 N5 O16 -","- C100 H86 Mn4 N10 O32 -","2","1","","Dobrzyńska, Danuta; Jerzykiewicz, Lucjan B.; Jezierska, Julia; Duczmal, Marek","Crystal Structure and Characterization of Manganese(II) Carboxylates: 3D Metal−Organic Frameworks","Crystal Growth & Design","2005","5","5","1945","","10.1021/cg050169u","","","0.71073","MoKα","","0.0457","0.0354","","","0.0895","0.0968","","","","","","0.849","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511564","11.3931","0.0005","15.4265","0.0007","7.6611","0.0003","90","","106.208","0.001","90","","1292.97","0.1","324","0.1","324","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-2-(2',4'-dinitrobenzyl)pyridine","","- C12 H11 N3 O4 -","- C13 H11 N3 O4 -","- C52 H44 N12 O16 -","4","1","","Naumov, Panče; Sakurai, Kenji","Reversible Thermal Gating of the Photochromic Properties of 3-Methyl-2-(2‘,4‘-dinitrobenzyl)pyridine in a Single Crystal","Crystal Growth & Design","2005","5","5","1699","","10.1021/cg050328+","","","0.71073","MoKα","","0.0844","0.0457","","","0.1221","0.1402","","","","","","0.894","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511565","11.5668","0.0007","15.3271","0.001","7.6407","0.0005","90","","105.885","0.002","90","","1302.86","0.14","328.9","0.2","329","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-2-(2',4'-dinitrobenzyl)pyridine","","- C12 H11 N3 O4 -","- C13 H11 N3 O4 -","- C52 H44 N12 O16 -","4","1","","Naumov, Panče; Sakurai, Kenji","Reversible Thermal Gating of the Photochromic Properties of 3-Methyl-2-(2‘,4‘-dinitrobenzyl)pyridine in a Single Crystal","Crystal Growth & Design","2005","5","5","1699","","10.1021/cg050328+","","","0.71073","MoKα","","0.1537","0.0463","","","0.1219","0.1447","","","","","","0.713","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511566","11.386","0.0007","15.422","0.001","7.658","0.0005","90","","106.188","0.002","90","","1291.39","0.14","319.7","0.2","320","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-2-(2',4'-dinitrobenzyl)pyridine","","- C12 H11 N3 O4 -","- C13 H11 N3 O4 -","- C52 H44 N12 O16 -","4","1","","Naumov, Panče; Sakurai, Kenji","Reversible Thermal Gating of the Photochromic Properties of 3-Methyl-2-(2‘,4‘-dinitrobenzyl)pyridine in a Single Crystal","Crystal Growth & Design","2005","5","5","1699","","10.1021/cg050328+","","","0.71073","MoKα","","0.0841","0.0459","","","0.1211","0.1359","","","","","","0.915","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511567","11.62","0.0002","15.38","0.0005","7.668","0.0003","90","","105.948","0.002","90","","1317.65","0.07","337","2","337","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-2-(2',4'-dinitrobenzyl)pyridine","","- C12 H11 N3 O4 -","- C13 H11 N3 O4 -","- C52 H44 N12 O16 -","4","1","","Naumov, Panče; Sakurai, Kenji","Reversible Thermal Gating of the Photochromic Properties of 3-Methyl-2-(2‘,4‘-dinitrobenzyl)pyridine in a Single Crystal","Crystal Growth & Design","2005","5","5","1699","","10.1021/cg050328+","","","0.71073","MoKα","","0.1084","0.055","","","0.1413","0.1671","","","","","","0.894","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511568","11.385","0.0007","15.422","0.001","7.659","0.0005","90","","106.176","0.001","90","","1291.52","0.14","316","0.3","316","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-2-(2',4'-dinitrobenzyl)pyridine","","- C12 H11 N3 O4 -","- C13 H11 N3 O4 -","- C52 H44 N12 O16 -","4","1","","Naumov, Panče; Sakurai, Kenji","Reversible Thermal Gating of the Photochromic Properties of 3-Methyl-2-(2‘,4‘-dinitrobenzyl)pyridine in a Single Crystal","Crystal Growth & Design","2005","5","5","1699","","10.1021/cg050328+","","","0.71073","MoKα","","0.0616","0.0473","","","0.1241","0.1317","","","","","","0.995","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511569","15.796","0.003","13.704","0.003","24.555","0.004","90","","92.42","0.005","90","","5310.6","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H58 N12 O16 S2 Zn2 -","- C42 H42 N12 O16 S2 Zn2 -","- C168 H168 N48 O64 S8 Zn8 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Parallel and Inclined (1D →2D) Interlacing Modes in New Polyrotaxane Frameworks [M2(bix)3(SO4)2] [M = Zn(II), Cd(II); Bix = 1,4-Bis(imidazol-1-ylmethyl)benzene]","Crystal Growth & Design","2005","5","1","37","","10.1021/cg049794+","","","0.71073","MoKα","","0.1816","0.0884","","0.3106","0.2376","","","","1.02","","","","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511570","13.8132","0.0012","11.1759","0.0009","14.4009","0.0012","90","","96.37","0.002","90","","2209.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 Cd N6 O4 S -","- C21 H21 Cd N6 O4 S -","- C84 H84 Cd4 N24 O16 S4 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Parallel and Inclined (1D →2D) Interlacing Modes in New Polyrotaxane Frameworks [M2(bix)3(SO4)2] [M = Zn(II), Cd(II); Bix = 1,4-Bis(imidazol-1-ylmethyl)benzene]","Crystal Growth & Design","2005","5","1","37","","10.1021/cg049794+","","","0.71073","MoKα","","0.0298","0.0234","","0.0633","0.0595","","","","1.041","","","","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511571","10.1323","0.0008","18.6237","0.0015","12.6038","0.001","90","","100.3","0.002","90","","2340","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 Cd N6 O6 S -","- C21 H25 Cd N6 O6 S -","- C84 H100 Cd4 N24 O24 S4 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Parallel and Inclined (1D →2D) Interlacing Modes in New Polyrotaxane Frameworks [M2(bix)3(SO4)2] [M = Zn(II), Cd(II); Bix = 1,4-Bis(imidazol-1-ylmethyl)benzene]","Crystal Growth & Design","2005","5","1","37","","10.1021/cg049794+","","","0.71073","MoKα","","0.051","0.0286","","0.0763","0.067","","","","1.069","","","","","","","has coordinates","179662","2020-10-21","18:00:00",""
"4511572","8.6613","0.0006","10.5768","0.0008","11.0798","0.0008","81.366","0.001","80.022","0.001","69.272","0.001","930.59","0.12","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H40 Cl2 Cu2 N6 O12 -","- C32 H30 Cl2 Cu2 N6 O12 -","- C32 H30 Cl2 Cu2 N6 O12 -","1","0.5","","Marin, Geanina; Tudor, Violeta; Kravtsov, Victor Ch.; Schmidtmann, Marc; Simonov, Yurii A.; Müller, Achim; Andruh, Marius","Extended Structures Constructed from Alkoxo-Bridged Binuclear Complexes as Nodes and Bis(4-pyridyl)ethylene as a Spacer","Crystal Growth & Design","2005","5","1","279","","10.1021/cg049920+","","","0.71073","MoKα","","0.0704","0.0552","","","0.1486","0.1611","","","","","","1.065","","","","has coordinates,has disorder","179662","2020-10-21","18:00:00",""
"4511573","10.238","0.002","11.749","0.002","14.548","0.003","90","","95.35","0.03","90","","1742.3","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Cl Cu N3 O5 -","- C14 H16 Cl Cu N3 O5 -","- C56 H64 Cl4 Cu4 N12 O20 -","4","1","","Marin, Geanina; Tudor, Violeta; Kravtsov, Victor Ch.; Schmidtmann, Marc; Simonov, Yurii A.; Müller, Achim; Andruh, Marius","Extended Structures Constructed from Alkoxo-Bridged Binuclear Complexes as Nodes and Bis(4-pyridyl)ethylene as a Spacer","Crystal Growth & Design","2005","5","1","279","","10.1021/cg049920+","","","0.71073","MoKα","","0.0749","0.0366","","","0.08","0.089","","","","","","0.826","","","","has coordinates,has disorder","179662","2020-10-21","18:00:00",""
"4511574","5.6334","0.0005","39.286","0.003","9.6819","0.0006","90","","91.276","0.007","90","","2142.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H42 N2 O2 S -","- C19 H42 N2 O2 S -","- C76 H168 N8 O8 S4 -","4","1","","Morris, David G.; Ryder, Karl S.; Muir, Kenneth W.","A Model for a Lipid Membrane Stabilized by C−H···X Bonds: The Crystal Structure of the Paraffinic Ylide Trimethylammonion-Hexadecylsulfonamidate CH3(CH2)15SO2N(−)N(+)Me3","Crystal Growth & Design","2005","5","1","361","","10.1021/cg049851z","","","0.71073","MoKα","","0.1743","0.1115","","","0.2968","0.351","","","","","","1.1","","","","has coordinates","179662","2020-10-21","18:00:00",""