# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T12:07:56+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Crystal Growth & Design') AND volume = 11 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
"4500013","27.3388","0.001","7.1786","0.0003","19.9614","0.0007","90","","120.433","0.001","90","","3377.8","0.2","200","","200","","","","","","","","Synthesized by the authors. See text","3","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 N6 -","- C8 H8 N6 -","- C128 H128 N96 -","16","2","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0415","0.0408","","","0.0986","0.099","","","","","","1.092","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500014","8.4261","0.0006","10.1297","0.0007","12.2194","0.001","75.928","0.004","87.136","0.004","70.451","0.004","952.79","0.13","100","","100","","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C17 H20 N12 O -","- C17 H20 N12 O -","- C34 H40 N24 O2 -","2","1","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0523","0.0453","","","0.1339","0.1387","","","","","","1.078","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500015","12.063","0.004","19.226","0.005","7.016","0.002","90","","95.029","0.002","90","","1620.9","0.8","100","","100","","","","","","","","Synthesized by the authors. See text","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N6 -","- C8 H8 N6 -","- C64 H64 N48 -","8","2","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0518","0.0516","","","0.1202","0.1203","","","","","","1.096","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500016","6.8585","0.0002","13.2958","0.0004","18.505","0.0005","90","","90","","90","","1687.46","0.08","150","","150","","","","","","","","Synthesized by the authors. See text","3","P b c a","-P 2ac 2ab","61","","","","- C8 H8 N6 -","- C8 H8 N6 -","- C64 H64 N48 -","8","1","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0338","0.0307","","","0.0808","0.0835","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500017","11.9471","0.0009","6.9732","0.0006","21.0822","0.0018","90","","101.59","0.004","90","","1720.5","0.2","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N6 -","- C8 H8 N6 -","- C64 H64 N48 -","8","2","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0538","0.0514","","","0.1569","0.1586","","","","","","1.078","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500018","11.7704","0.0001","9.0941","0.0001","11.8294","0.0001","90","","97.16","0.001","90","","1256.36","0.02","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 N6 O S -","- C10 H14 N6 O S -","- C40 H56 N24 O4 S4 -","4","1","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0371","0.036","","","0.0992","0.0963","","","","","","1.046","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500019","9.5053","0.0005","14.2146","0.0007","19.4909","0.0009","98.831","0.002","94.263","0.002","104.765","0.002","2498.5","0.2","150","","150","","","","","","","","Synthesized by the authors. See text","3","P -1","-P 1","2","","","","- C14 H12 N6 -","- C14 H12 N6 -","- C112 H96 N48 -","8","4","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.1026","0.0721","","","0.1876","0.205","","","","","","1.029","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500020","16.915","0.0007","8.6926","0.0004","17.8433","0.0007","90","","109.956","0.002","90","","2466.06","0.18","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N6 -","- C14 H12 N6 -","- C112 H96 N48 -","8","2","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0391","0.0383","","","0.1104","0.1113","","","","","","1.032","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500021","9.31","0.001","9.719","0.001","15.859","0.002","96.589","0.002","99.854","0.002","111.024","0.003","1295.3","0.3","100","","100","","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C14 H14 N6 O -","- C14 H14 N6 O -","- C56 H56 N24 O4 -","4","2","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0372","0.0371","","","0.088","0.0881","","","","","","1.087","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500022","7.2112","0.0002","49.9305","0.0013","11.9101","0.0003","90","","103.679","0.001","90","","4166.7","0.19","100","","100","","","","","","","","Synthesized by the authors. See text","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N6 O2 -","- C14 H16 N6 O2 -","- C168 H192 N72 O24 -","12","3","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.075","0.0549","","","0.135","0.147","","","","","","1.04","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500023","7.0142","0.0002","18.5089","0.0004","18.5309","0.0004","90","","90","","90","","2405.78","0.1","100","2","100","2","","","","","","","Synthesized by the authors. See text","3","P b c a","-P 2ac 2ab","61","","","","- C14 H12 N6 -","- C14 H12 N6 -","- C112 H96 N48 -","8","1","","Duong, Adam; Maris, Thierry; Wuest,James D","Structural Similarity of Hydrogen-Bonded Networks in Crystals of Isomeric Pyridyl-Substituted Diaminotriazines","Cryst. Growth & Design","2011","11","","287","294","10.1021/cg101290r","","","1.54178","CuKα","","0.0322","0.0314","","","0.0845","0.0855","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500024","10.5537","0.0008","7.544","0.0006","18.6318","0.0014","90","","115.3","0.004","90","","1341.13","0.18","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 2/c 1","-P 2yc","13","","","","- C20 H22 Ag Cl N14 O4 -","- C20 H22 Ag Cl N14 O4 -","- C40 H44 Ag2 Cl2 N28 O8 -","2","0.5","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0658","0.0652","","","0.1555","0.1558","","","","","","1.099","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500025","9.0902","0.0006","6.8526","0.0004","12.999","0.0008","90","","103.304","0.003","90","","788","0.09","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 1 21/n 1","-P 2yn","14","","","","- C7 H7 N7 -","- C7 H7 N7 -","- C28 H28 N28 -","4","1","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0423","0.0359","","","0.1021","0.1178","","","","","","1.111","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500026","7.7","0.0004","16.4473","0.0009","15.7512","0.0008","90","","93.649","0.003","90","","1990.75","0.18","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 Ag Cl N14 O4 -","- C14 H14 Ag Cl N14 O4 -","- C56 H56 Ag4 Cl4 N56 O16 -","4","1","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0324","0.0293","","","0.0808","0.0846","","","","","","1.083","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500027","7.8","0.0002","7.8","0.0002","13.6369","0.0003","90","","90","","90","","829.67","0.04","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 43 21 2","P 4nw 2abw","96","","","","- C7 H7 N7 -","- C7 H7 N7 -","- C28 H28 N28 -","4","0.5","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0274","0.0274","","","0.0735","0.0735","","","","","","1.071","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500028","7.3464","0.0003","15.6714","0.0005","16.961","0.0006","90","","91.854","0.002","90","","1951.67","0.12","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 21 1","P 2yb","4","","","","- C14 H14 Ag B F4 N14 -","- C14 H14 Ag B F4 N14 -","- C56 H56 Ag4 B4 F16 N56 -","4","2","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0253","0.025","","","0.0635","0.0641","","","","","","1.028","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500029","8.5605","0.0005","11.7582","0.0006","11.9111","0.0007","90","","103.195","0.002","90","","1167.27","0.11","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Ag Cl N7 O4 -","- C7 H7 Ag Cl N7 O4 -","- C28 H28 Ag4 Cl4 N28 O16 -","4","1","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0358","0.0357","","","0.0978","0.0979","","","","","","1.034","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500030","11.6531","0.0003","14.1616","0.0003","12.6255","0.0003","90","","93.576","0.001","90","","2079.49","0.09","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 Ag Cl N12 O4 -","- C16 H16 Ag Cl N12 O4 -","- C64 H64 Ag4 Cl4 N48 O16 -","4","1","","Duong, Adam; Valérie Métivaud; Maris, Thierry; Wuest,James D","Surrogates of 2,2'-Bipyridine Designed to Chelate Ag(I) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals","Cryst. Growth & Design","2011","11","","2026","2034","10.1021/cg2003194","","","1.54178","CuKα","","0.0459","0.0402","","","0.1071","0.1122","","","","","","1.028","","","","has coordinates,has disorder","179531","2020-10-21","18:00:00",""
"4500088","14.572","0.004","5.3275","0.0016","19.39","0.005","90","","99.986","0.007","90","","1482.5","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H12 N4 O6 S2 -","- C11 H12 N4 O6 S2 -","- C44 H48 N16 O24 S8 -","4","0.5","","Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride","Crystal Growth & Design","2011","11","1","59","","10.1021/cg1004566","","","0.71073","MoKα","","0.1843","0.053","","","0.0622","0.0823","","","","","","0.731","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500089","28.535","0.003","7.8893","0.0009","15.4803","0.0017","90","","104.618","0.002","90","","3372.1","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H24 Cl8 Cu2 N4 S4 -","- C22 H24 Cl8 Cu2 N4 S4 -","- C88 H96 Cl32 Cu8 N16 S16 -","4","0.5","","Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride","Crystal Growth & Design","2011","11","1","59","","10.1021/cg1004566","","","0.71073","MoKα","","0.072","0.0367","","","0.0815","0.0985","","","","","","1.017","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500090","8.2421","0.0008","25.079","0.002","13.4368","0.0012","90","","97.209","0.002","90","","2755.5","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cl3 Cu N4 S4 -","- C22 H21 Cl3 Cu N4 S4 -","- C88 H84 Cl12 Cu4 N16 S16 -","4","0.5","","Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride","Crystal Growth & Design","2011","11","1","59","","10.1021/cg1004566","","","0.71073","MoKα","","0.1048","0.0396","","","0.0604","0.0697","","","","","","0.83","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500091","10.458","0.0016","14.53","0.002","18.41","0.003","90","","92.112","0.003","90","","2795.6","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 Cl4 Cu N4 O0 S4 -","- C22 H22 Cl4 Cu N4 S4 -","- C88 H88 Cl16 Cu4 N16 S16 -","4","0.5","","Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride","Crystal Growth & Design","2011","11","1","59","","10.1021/cg1004566","","","0.71073","MoKα","","0.1748","0.054","","","0.1187","0.1723","","","","","","0.976","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500092","17.659","0.004","13.109","0.003","12.019","0.002","90","","122.62","0.03","90","","2343.4","1.2","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C17 H24 Cl2 Cu N4 O2 S2 -","- C17 H24 Cl2 Cu N4 O2 S2 -","- C68 H96 Cl8 Cu4 N16 O8 S8 -","4","0.5","","Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride","Crystal Growth & Design","2011","11","1","59","","10.1021/cg1004566","","","0.71073","MoKα","","0.1129","0.0658","","","0.13","0.1452","","","","","","1.084","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500093","18.746","0.002","11.9969","0.0015","11.619","0.0016","90","","121.424","0.002","90","","2229.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H10 Cl2 Cu N2 S2 -","- C11 H10 Cl2 Cu N2 S2 -","- C44 H40 Cl8 Cu4 N8 S8 -","4","0.5","","Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M.","Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride","Crystal Growth & Design","2011","11","1","59","","10.1021/cg1004566","","","0.71073","MoKα","","0.1469","0.0634","","","0.1441","0.1592","","","","","","0.765","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500094","7.9828","0.0004","10.9899","0.0008","14.7699","0.0011","68.585","0.003","87.3","0.004","79.219","0.004","1184.7","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(isonicotinamide).(nicotinamide)","","- C6 H6 N2 O -","- C6 H6 N2 O -","- C48 H48 N16 O8 -","8","4","","Báthori, Nikoletta B.; Lemmerer, Andreas; Venter, Gerhard A.; Bourne, Susan A.; Caira, Mino R.","Pharmaceutical Co-crystals with Isonicotinamide—Vitamin B3, Clofibric Acid, and Diclofenac—and Two Isonicotinamide Hydrates","Crystal Growth & Design","2011","11","1","75","","10.1021/cg100670k","","","0.71073","MoKα","","0.0542","0.0366","","","0.086","0.095","","","","","","1.021","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500095","6.9843","0.0002","15.8948","0.0005","16.2722","0.0005","110.079","0.002","99.792","0.002","95.324","0.002","1649.48","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(isonicotinamide).(clofibric acid)","","- C16 H17 Cl N2 O4 -","- C16 H17 Cl N2 O4 -","- C64 H68 Cl4 N8 O16 -","4","2","","Báthori, Nikoletta B.; Lemmerer, Andreas; Venter, Gerhard A.; Bourne, Susan A.; Caira, Mino R.","Pharmaceutical Co-crystals with Isonicotinamide—Vitamin B3, Clofibric Acid, and Diclofenac—and Two Isonicotinamide Hydrates","Crystal Growth & Design","2011","11","1","75","","10.1021/cg100670k","","","0.71073","MoKα","","0.0389","0.0324","","","0.0847","0.0896","","","","","","1.02","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500096","7.4641","0.0003","8.8223","0.0002","14.8006","0.0006","89.144","0.002","87.628","0.002","82.788","0.002","966.04","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(isonicotinamide).(diclofenac)","","- C20 H17 Cl2 N3 O3 -","- C20 H17 Cl2 N3 O3 -","- C40 H34 Cl4 N6 O6 -","2","1","","Báthori, Nikoletta B.; Lemmerer, Andreas; Venter, Gerhard A.; Bourne, Susan A.; Caira, Mino R.","Pharmaceutical Co-crystals with Isonicotinamide—Vitamin B3, Clofibric Acid, and Diclofenac—and Two Isonicotinamide Hydrates","Crystal Growth & Design","2011","11","1","75","","10.1021/cg100670k","","","0.71073","MoKα","","0.0548","0.0456","","","0.12","0.1281","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500097","7.418","0.002","10.774","0.003","16.608","0.005","90","","92.686","0.007","90","","1325.9","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(isonicotinamide) hydrate Form I","","- C6 H8 N2 O2 -","- C6 H8 N2 O2 -","- C48 H64 N16 O16 -","8","2","","Báthori, Nikoletta B.; Lemmerer, Andreas; Venter, Gerhard A.; Bourne, Susan A.; Caira, Mino R.","Pharmaceutical Co-crystals with Isonicotinamide—Vitamin B3, Clofibric Acid, and Diclofenac—and Two Isonicotinamide Hydrates","Crystal Growth & Design","2011","11","1","75","","10.1021/cg100670k","","","0.71073","MoKα","","0.0414","0.0362","","","0.1136","0.1226","","","","","","1.119","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500098","19.0991","0.0017","7.4858","0.0007","22.7304","0.0015","90","","123.792","0.005","90","","2700.8","0.4","173","2","173","2","","","","","","","","4","P 1 c 1","P -2yc","7","","(isonicotinamide) hydrate Form II","","- C6 H8 N2 O2 -","- C6 H8 N2 O2 -","- C96 H128 N32 O32 -","16","8","","Báthori, Nikoletta B.; Lemmerer, Andreas; Venter, Gerhard A.; Bourne, Susan A.; Caira, Mino R.","Pharmaceutical Co-crystals with Isonicotinamide—Vitamin B3, Clofibric Acid, and Diclofenac—and Two Isonicotinamide Hydrates","Crystal Growth & Design","2011","11","1","75","","10.1021/cg100670k","","","0.71073","MoKα","","0.0632","0.035","","","0.0916","0.1108","","","","","","1.033","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500099","9.733","0.003","5.7183","0.0017","10.359","0.003","90","","93.193","0.004","90","","575.6","0.3","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H12 N2 O4 S2 Zn -","- C8 H12 N2 O4 S2 Zn -","- C16 H24 N4 O8 S4 Zn2 -","2","1","","Dong, Lanjun; Chu, Wei; Zhu, Qinlei; Huang, Rudan","Three Novel Homochiral Helical Metal−Organic Frameworks Based on Amino Acid Ligand: Syntheses, Crystal Structures, and Properties","Crystal Growth & Design","2011","11","1","93","","10.1021/cg1009175","","","0.71073","MoKα","","0.0506","0.039","","","0.0887","0.0979","","","","","","0.867","","","","has coordinates","179531","2020-10-21","18:00:00",""
"4500100","21.746","0.004","8.954","0.0018","6.159","0.0012","90","","90","","90","","1199.2","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C8 H12 Cd N2 O4 S2 -","- C8 H12 Cd N2 O4 S2 -","- C32 H48 Cd4 N8 O16 S8 -","4","1","","Dong, Lanjun; Chu, Wei; Zhu, Qinlei; Huang, Rudan","Three Novel Homochiral Helical Metal−Organic Frameworks Based on Amino Acid Ligand: Syntheses, Crystal Structures, and Properties","Crystal Growth & Design","2011","11","1","93","","10.1021/cg1009175","","","0.71073","MoKα","","0.036","0.0316","","","0.0672","0.0699","","","","","","1.007","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500101","5.897","0.006","10.146","0.011","10.077","0.01","90","","90.165","0.006","90","","602.9","1.1","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H12 N2 Ni O4 S2 -","- C8 H12 N2 Ni O4 S2 -","- C16 H24 N4 Ni2 O8 S4 -","2","1","","Dong, Lanjun; Chu, Wei; Zhu, Qinlei; Huang, Rudan","Three Novel Homochiral Helical Metal−Organic Frameworks Based on Amino Acid Ligand: Syntheses, Crystal Structures, and Properties","Crystal Growth & Design","2011","11","1","93","","10.1021/cg1009175","","","0.71073","MoKα","","0.1743","0.0646","","","0.106","0.1346","","","","","","0.997","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500102","22.2229","0.0011","16.1021","0.0008","26.9252","0.0014","90","","90.062","0.001","90","","9634.8","0.8","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C94 H80 N2 S15 Zn8 -","- C94 H80 N2 S15 Zn8 -","- C376 H320 N8 S60 Zn32 -","4","1","","Xie, Jingli; Batten, Stuart R.; Zou, Yang; Ren, Xiaoming","Observation of in Situ Ligand Reactions during the Assembly of Crystalline Zn−S Clusters","Crystal Growth & Design","2011","11","1","16","","10.1021/cg100926g","","","0.71073","MoKα","","0.0654","0.0543","","","0.1367","0.1455","","","","","","1.021","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500103","20.663","0.003","16.514","0.002","31.871","0.004","90","","106.104","0.002","90","","10449","2","130","2","130","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C106 H88 N2 S17 Zn8 -","- C106 H88 N2 S17 Zn8 -","- C424 H352 N8 S68 Zn32 -","4","1","","Xie, Jingli; Batten, Stuart R.; Zou, Yang; Ren, Xiaoming","Observation of in Situ Ligand Reactions during the Assembly of Crystalline Zn−S Clusters","Crystal Growth & Design","2011","11","1","16","","10.1021/cg100926g","","","0.71073","MoKα","","0.0949","0.0832","","","0.1741","0.1804","","","","","","1.178","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500104","60.797","0.016","19.604","0.005","18.548","0.005","90","","102.58","0.005","90","","21576","10","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C106 H88 N2 S17 Zn8 -","- C106 H83 N2 S17 Zn8 -","- C848 H664 N16 S136 Zn64 -","8","1","","Xie, Jingli; Batten, Stuart R.; Zou, Yang; Ren, Xiaoming","Observation of in Situ Ligand Reactions during the Assembly of Crystalline Zn−S Clusters","Crystal Growth & Design","2011","11","1","16","","10.1021/cg100926g","","","0.71073","MoKα","","0.1144","0.0968","","","0.1835","0.1911","","","","","","1.266","","","","has coordinates,has disorder","179532","2020-10-21","18:00:00",""
"4500105","26.183","0.012","12.963","0.006","28.952","0.013","90","","91.984","0.009","90","","9821","8","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C94 H78 I2 N2 S15 Zn8 -","- C94 H78 I2 N2 S15 Zn8 -","- C376 H312 I8 N8 S60 Zn32 -","4","1","","Xie, Jingli; Batten, Stuart R.; Zou, Yang; Ren, Xiaoming","Observation of in Situ Ligand Reactions during the Assembly of Crystalline Zn−S Clusters","Crystal Growth & Design","2011","11","1","16","","10.1021/cg100926g","","","0.71073","MoKα","","0.1176","0.0683","","","0.1513","0.1677","","","","","","1.05","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500106","25.9261","0.0014","13.2222","0.0007","31.9549","0.0016","90","","101.894","0.001","90","","10719","1","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C102 H96 N2 S15 Zn8 -","- C102 H96 N2 S15 Zn8 -","- C408 H384 N8 S60 Zn32 -","4","1","","Xie, Jingli; Batten, Stuart R.; Zou, Yang; Ren, Xiaoming","Observation of in Situ Ligand Reactions during the Assembly of Crystalline Zn−S Clusters","Crystal Growth & Design","2011","11","1","16","","10.1021/cg100926g","","","0.71073","MoKα","","0.1022","0.0481","","","0.0839","0.0951","","","","","","1.06","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500107","13.4355","0.0013","27.915","0.003","55.873","0.005","90","","91.919","0.002","90","","20944","4","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C110 H88 N2 S15 Zn8 -","- C110 H88 N2 S15 Zn8 -","- C880 H704 N16 S120 Zn64 -","8","2","","Xie, Jingli; Batten, Stuart R.; Zou, Yang; Ren, Xiaoming","Observation of in Situ Ligand Reactions during the Assembly of Crystalline Zn−S Clusters","Crystal Growth & Design","2011","11","1","16","","10.1021/cg100926g","","","0.71073","MoKα","","0.2064","0.1143","","","0.2402","0.2695","","","","","","0.973","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500108","8.6109","0.0006","9.0319","0.0006","9.9523","0.0007","84.481","0.002","83.279","0.002","74.652","0.002","739.56","0.09","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","catena-{L-histidinium-κO-(μ~3~hydrogenphosphato)(μ~4~phosphato)- dizinc(II)} hydrate","","- C6 H13 N3 O11 P2 Zn2 -","- C6 H13 N3 O11 P2 Zn2 -","- C12 H26 N6 O22 P4 Zn4 -","2","1","","Mekhatria, Djilali; Rigolet, Séverinne; Janiak, Christoph; Simon-Masseron, Angélique; Hasnaoui, Mohammed Abdelkrim; Bengueddach, Abdelkader","A New Inorganic−Organic Hybrid Zinc Phosphate Prepared withl-Histidine with an Unusual Stability in Water","Crystal Growth & Design","2011","11","2","396","","10.1021/cg100952q","","","0.71073","MoKα","","0.0364","0.033","","","0.0665","0.0679","","","","","","1.089","","","","has coordinates,has disorder","179532","2020-10-21","18:00:00",""
"4500109","10.1155","0.0009","21.3388","0.0018","27.37","0.002","90","","90","","90","","5907.9","0.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C66 H60 Cd2 N8 O8 -","- C66 H60 Cd2 N8 O8 -","- C264 H240 Cd8 N32 O32 -","4","1","","Farnum, Gregory A.; Pochodylo, Amy L.; LaDuca, Robert L.","Tether Length Control of Topology in Cadmium 4-Methylphthalate Two-Dimensional Coordination Polymers: An Acentric Buckled Grid and a Rare Self-Catenated Layer","Crystal Growth & Design","2011","11","3","678","","10.1021/cg100972s","","","0.71073","MoKα","","0.0325","0.0281","","","0.0664","0.0688","","","","","","1.042","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500110","22.0525","0.0017","23.1373","0.0018","10.1729","0.0008","90","","90","","90","","5190.6","0.7","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C57 H54 Cd2 N6 O8 -","- C57 H54 Cd2 N6 O8 -","- C228 H216 Cd8 N24 O32 -","4","0.5","","Farnum, Gregory A.; Pochodylo, Amy L.; LaDuca, Robert L.","Tether Length Control of Topology in Cadmium 4-Methylphthalate Two-Dimensional Coordination Polymers: An Acentric Buckled Grid and a Rare Self-Catenated Layer","Crystal Growth & Design","2011","11","3","678","","10.1021/cg100972s","","","0.71073","MoKα","","0.0571","0.0405","","","0.0912","0.1001","","","","","","1.061","","","","has coordinates,has disorder","179532","2020-10-21","18:00:00",""
"4500111","13.5715","0.0017","13.5715","0.0017","8.7125","0.0012","90","","90","","120","","1389.7","0.3","213","2","213","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","","","- C15 H36 Cu3 Mo N7 O4 S3 -","- C15 H36 Cu3 Mo N7 O4 S3 -","- C30 H72 Cu6 Mo2 N14 O8 S6 -","2","0.166667","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Zhou, Yimeng; Cao, Yuan; Li, Jianghua; Zhao, Huajian; Hu, Jingchun; Wu, Jinhua; Humphrey, Mark G.; Zhang, Chi","Syntheses, Structural, Theoretical, and Nonlinear Optical Studies of Non-Interpenetrating Three-Dimensional Nest-Shaped-Cluster [MoOS3Cu3]-Based Coordination Polymers","Crystal Growth & Design","2011","11","1","100","","10.1021/cg1009779","","","0.7107","MoKα","","0.0292","0.0291","","","0.0785","0.0785","","","","","","1.117","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500112","27.543","0.004","13.7619","0.0018","17.35","0.002","90","","99.34","0.004","90","","6489.2","1.5","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49 H50 Cu6 Mo2 N14 O4 S6 -","- C43 H32 Cu6 Mo2 N11 O2 S6 -","- C172 H128 Cu24 Mo8 N44 O8 S24 -","4","0.5","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Zhou, Yimeng; Cao, Yuan; Li, Jianghua; Zhao, Huajian; Hu, Jingchun; Wu, Jinhua; Humphrey, Mark G.; Zhang, Chi","Syntheses, Structural, Theoretical, and Nonlinear Optical Studies of Non-Interpenetrating Three-Dimensional Nest-Shaped-Cluster [MoOS3Cu3]-Based Coordination Polymers","Crystal Growth & Design","2011","11","1","100","","10.1021/cg1009779","","","0.7107","MoKα","","0.0939","0.076","","","0.1536","0.1623","","","","","","1.226","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500113","27.55","0.005","13.281","0.003","20.356","0.004","90","","97.03","0.03","90","","7392","3","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C57 H58 Cu6 Mo2 N14 O4 S6 -","- C51 Cu6 Mo2 N11 O2 S6 -","- C204 Cu24 Mo8 N44 O8 S24 -","4","0.5","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Zhou, Yimeng; Cao, Yuan; Li, Jianghua; Zhao, Huajian; Hu, Jingchun; Wu, Jinhua; Humphrey, Mark G.; Zhang, Chi","Syntheses, Structural, Theoretical, and Nonlinear Optical Studies of Non-Interpenetrating Three-Dimensional Nest-Shaped-Cluster [MoOS3Cu3]-Based Coordination Polymers","Crystal Growth & Design","2011","11","1","100","","10.1021/cg1009779","","","0.71073","MoKα","","0.0807","0.0653","","","0.14","0.1488","","","","","","1.148","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500114","7.943","0.002","23.633","0.006","4.8675","0.0012","90","","104.864","0.006","90","","883.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 N3 O3 -","- C8 H9 N3 O3 -","- C32 H36 N12 O12 -","4","1","","Pindelska, Edyta; Dobrzycki, Lukasz; Woźniak, Krzysztof; Kolodziejski, Waclaw","Polymorphism of Crystalline 4-Amino-2-Nitroacetanilide","Crystal Growth & Design","2011","11","6","2074","","10.1021/cg100989t","","","0.71073","MoKα","","0.0374","0.0316","","","0.0791","0.083","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500115","7.962","0.003","24.157","0.009","4.8805","0.0018","90","","104.597","0.009","90","","908.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 N3 O3 -","- C8 H9 N3 O3 -","- C32 H36 N12 O12 -","4","1","","Pindelska, Edyta; Dobrzycki, Lukasz; Woźniak, Krzysztof; Kolodziejski, Waclaw","Polymorphism of Crystalline 4-Amino-2-Nitroacetanilide","Crystal Growth & Design","2011","11","6","2074","","10.1021/cg100989t","","","0.71073","MoKα","","0.0507","0.0361","","","0.0884","0.0976","","","","","","1.032","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500116","12.7022","0.0011","3.8175","0.0002","17.3647","0.0016","90","","91.632","0.007","90","","841.68","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 N3 O3 -","- C8 H9 N3 O3 -","- C32 H36 N12 O12 -","4","1","","Pindelska, Edyta; Dobrzycki, Lukasz; Woźniak, Krzysztof; Kolodziejski, Waclaw","Polymorphism of Crystalline 4-Amino-2-Nitroacetanilide","Crystal Growth & Design","2011","11","6","2074","","10.1021/cg100989t","","","0.71073","MoKα","","0.0623","0.0448","","","0.1545","0.1597","","","","","","1.176","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500117","22.6561","0.0014","11.7274","0.0007","7.3264","0.0004","90","","102.933","0.005","90","","1897.2","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H11 N3 O4 -","- C8 H11 N3 O4 -","- C64 H88 N24 O32 -","8","1","","Pindelska, Edyta; Dobrzycki, Lukasz; Woźniak, Krzysztof; Kolodziejski, Waclaw","Polymorphism of Crystalline 4-Amino-2-Nitroacetanilide","Crystal Growth & Design","2011","11","6","2074","","10.1021/cg100989t","","","0.71073","MoKα","","0.0521","0.0319","","","0.0737","0.0773","","","","","","0.877","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500118","9.1295","0.0002","18.6869","0.0005","9.7902","0.0002","90","","90","","90","","1670.23","0.07","120","","120","","","","","","","","","4","P c a 21","P 2c -2ac","29","","picric acid","","- C6 H3 N3 O7 -","- C6 H3 N3 O7 -","- C48 H24 N24 O56 -","8","2","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0526","0.0401","","","0.0899","0.0963","","","","","","1.026","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500119","13.5569","0.0003","20.4528","0.0005","9.4315","0.0002","90","","110.883","0.0012","90","","2443.34","0.1","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","acetamidinium picrate","","- C8 H9 N5 O7 -","- C8 H9 N5 O7 -","- C64 H72 N40 O56 -","8","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0737","0.0543","","","0.1556","0.1708","","","","","","1.063","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500120","5.9114","0.0001","13.7255","0.0004","20.7588","0.0007","90","","90","","90","","1684.31","0.08","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-phenylpyridinium picrate","","- C17 H12 N4 O7 -","- C17 H12 N4 O7 -","- C68 H48 N16 O28 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0615","0.0415","","","0.0989","0.1093","","","","","","1.043","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500121","8.2179","0.0001","13.5852","0.0003","11.8314","0.0002","90","","102.024","0.0009","90","","1291.9","0.04","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-aminopyridinium picrate","","- C11 H9 N5 O7 -","- C11 H9 N5 O7 -","- C44 H36 N20 O28 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0716","0.0569","","","0.1611","0.1741","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500122","8.5133","0.0002","11.3464","0.0002","14.3375","0.0003","90","","104.199","0.0008","90","","1342.62","0.05","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-aminopyridinium picrate","","- C11 H9 N5 O7 -","- C11 H9 N5 O7 -","- C44 H36 N20 O28 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0605","0.0427","","","0.1098","0.1197","","","","","","1.03","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500123","5.9086","0.0002","8.043","0.0003","13.868","0.0007","88.8722","0.0016","81.3468","0.0014","89.619","0.003","651.41","0.05","295","","295","","","","","","","","","4","P -1","-P 1","2","","2-aminopyrimidinium picrate","","- C10 H8 N6 O7 -","- C10 H8 N6 O7 -","- C20 H16 N12 O14 -","2","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0732","0.0466","","","0.1215","0.1392","","","","","","1.021","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500124","7.4694","0.0004","8.0532","0.0004","13.7314","0.0008","81.205","0.002","78.66","0.002","90.01","0.003","799.94","0.08","295","","295","","","","","","","","","4","P 1","P 1","1","","8-aminoquinolinium picrate","","- C15 H11 N5 O7 -","- C15 H11 N5 O7 -","- C30 H22 N10 O14 -","2","2","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0917","0.0886","","","0.2379","0.2427","","","","","","1.039","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500125","7.5976","0.0001","27.1229","0.0005","8.2111","0.0001","90","","110.502","0.0009","90","","1584.88","0.04","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,6-dimethyl-3,4-dihydropyrimidinium picrate hydrate","","- C12 H13 N5 O9 -","- C12 H13 N5 O9 -","- C48 H52 N20 O36 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0676","0.0479","","","0.1271","0.1397","","","","","","1.065","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500126","11.2042","0.0003","8.3035","0.0002","15.9837","0.0004","90","","90.1988","0.001","90","","1487.02","0.07","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-oxo-3,4-dihydroquinazolium picrate","","- C14 H9 N5 O8 -","- C14 H9 N5 O8 -","- C56 H36 N20 O32 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0748","0.0537","","","0.1406","0.158","","","","","","1.028","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500127","8.1074","0.0002","13.306","0.0003","24.6747","0.0007","90","","96.6479","0.0008","90","","2643.94","0.12","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-hydroxy-5-methyl-1H-pyrazol-2-ium picrate","","- C10 H9 N5 O8 -","- C10 H9 N5 O8 -","- C80 H72 N40 O64 -","8","2","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.1158","0.0746","","","0.1978","0.2263","","","","","","1.057","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500128","12.3573","0.0003","3.7312","0.0001","27.6064","0.0007","90","","93.0759","0.0009","90","","1271.03","0.06","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-hydroxypyridinium picrate","","- C11 H8 N4 O8 -","- C11 H8 N4 O8 -","- C44 H32 N16 O32 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0679","0.0452","","","0.1158","0.1283","","","","","","1.034","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500129","7.3174","0.0002","15.2404","0.0004","12.6802","0.0004","90","","96.9655","0.001","90","","1403.66","0.07","295","","295","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2-hydroxy-6-methylpyridinium picrate","","- C12 H10 N4 O8 -","- C12 H10 N4 O8 -","- C48 H40 N16 O32 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0967","0.084","","","0.23","0.2433","","","","","","1.106","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500130","11.0933","0.0005","11.2083","0.0006","11.6431","0.0007","93.833","0.002","102.105","0.002","98.328","0.003","1393.46","0.13","295","","295","","","","","","","","","4","P -1","-P 1","2","","2-hydroxy-4-methylpyridinium picrate","","- C12 H10 N4 O8 -","- C12 H10 N4 O8 -","- C48 H40 N16 O32 -","4","2","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.1373","0.0835","","","0.2125","0.2646","","","","","","1.029","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500131","10.5264","0.0003","5.1071","0.0001","37.6367","0.0014","90","","90.169","0.001","90","","2023.32","0.1","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-hydroxy-4-methylpyridinium picrate, 4-methylpyridin-2(1H)-one","","- C18 H17 N5 O9 -","- C18 H17 N5 O9 -","- C72 H68 N20 O36 -","4","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.1411","0.0463","","","0.0808","0.1032","","","","","","0.903","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500132","15.214","0.0004","8.2542","0.0002","23.416","0.0007","90","","97.4066","0.001","90","","2916.03","0.14","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-nitropyridine-N-oxide, picric acid","","- C11 H7 N5 O10 -","- C11 H7 N5 O10 -","- C88 H56 N40 O80 -","8","1","","Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone","Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts","Crystal Growth & Design","2011","11","7","2724","","10.1021/cg101007a","","","0.71073","MoKα","","0.0689","0.0427","","","0.1029","0.1188","","","","","","1.051","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500133","14.2726","0.0004","8.647","0.0003","21.3133","0.0008","90","","95.9812","0.0014","90","","2616.07","0.15","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C120 H128 N16 O16 -","8","2","","Long, Sihui; Siegler, Maxime A.; Mattei, Alessandra; Li, Tonglei","Phase Transition from TwoZ′ = 1 Forms to aZ′ = 2 Form of a Concomitant Conformational Polymorphic System","Crystal Growth & Design","2011","11","2","414","","10.1021/cg101009g","","","0.71073","MoKα","","0.1147","0.0536","","","0.1243","0.1524","","","","","","0.951","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500134","7.5301","0.0002","7.5301","0.0002","20.6215","0.001","90","","90","","120","","1012.63","0.06","90","0.2","90","0.2","","","","","","","","4","P 32","P 32","145","","","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C45 H48 N6 O6 -","3","1","","Long, Sihui; Siegler, Maxime A.; Mattei, Alessandra; Li, Tonglei","Phase Transition from TwoZ′ = 1 Forms to aZ′ = 2 Form of a Concomitant Conformational Polymorphic System","Crystal Growth & Design","2011","11","2","414","","10.1021/cg101009g","","","0.71073","MoKα","","0.1048","0.051","","","0.1128","0.136","","","","","","0.976","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500135","9.2035","0.0003","14.083","0.0004","10.6939","0.0004","90","","100.741","0.0012","90","","1361.78","0.08","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","","Long, Sihui; Siegler, Maxime A.; Mattei, Alessandra; Li, Tonglei","Phase Transition from TwoZ′ = 1 Forms to aZ′ = 2 Form of a Concomitant Conformational Polymorphic System","Crystal Growth & Design","2011","11","2","414","","10.1021/cg101009g","","","0.71073","MoKα","","0.0884","0.051","","","0.1211","0.1386","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500136","20.027","0.004","12.024","0.002","22.675","0.005","90","","107.23","0.03","90","","5215","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Anhydrous Lithium Acetate","Anhydrous Lithium Acetate","","- C30 H45 Li15 O30 -","- C30 H45 Li15 O30 -","- C120 H180 Li60 O120 -","4","1","","Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez","Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers","Crystal Growth & Design","2011","11","4","1021","","10.1021/cg1010133","","","0.7379","Synchrotron","","0.0372","0.0354","","","0.0961","0.0977","","","","","","1.023","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500137","20.424","0.004","12.081","0.002","22.735","0.005","90","","107.92","0.03","90","","5338","2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Anhydrous Lithium Acetate","Anhydrous Lithium Acetate","","- C30 H45 Li15 O30 -","- C30 H45 Li15 O30 -","- C120 H180 Li60 O120 -","4","1","","Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez","Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers","Crystal Growth & Design","2011","11","4","1021","","10.1021/cg1010133","","","0.7379","Synchrotron","","0.0557","0.0504","","","0.1415","0.1471","","","","","","1.051","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500138","23.488","0.005","27.709","0.006","29.963","0.006","99.59","0.03","91.8","0.03","106.93","0.03","18329","8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Anhydrous Lithium Acetate","Anhydrous Lithium Acetate","","- C216 H324 Li108 O216 -","- C216 H324 Li108 O216 -","- C432 H648 Li216 O432 -","2","1","","Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez","Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers","Crystal Growth & Design","2011","11","4","1021","","10.1021/cg1010133","","","0.9803","Synchrotron","","0.0877","0.0749","","","0.2071","0.2231","","","","","","1.01","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500139","7.689","0.0015","11.959","0.002","13.881","0.003","72.28","0.03","88.93","0.03","89.08","0.03","1215.6","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","hepta-lithium acetate trihydrate","Lithium acetate hydrate (0.429)","","- C14 H26 Li7 O17 -","- C14 H26 Li7 O17 -","- C28 H52 Li14 O34 -","2","1","","Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez","Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers","Crystal Growth & Design","2011","11","4","1021","","10.1021/cg1010133","","","0.7293","Synchrotron","","0.0391","0.0383","","","0.1083","0.1094","","","","","","0.918","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500140","7.087","0.0014","14.514","0.003","15.298","0.003","90","","99.8","0.03","90","","1550.6","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Lithium acetate monohydrate","Lithium acetate monohydrate","","- C8 H20 Li4 O12 -","- C8 H20 Li4 O12 -","- C32 H80 Li16 O48 -","4","1","","Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez","Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers","Crystal Growth & Design","2011","11","4","1021","","10.1021/cg1010133","","","0.7293","Synchrotron","","0.048","0.0449","","","0.1233","0.1282","","","","","","0.996","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500141","6.734","0.0013","10.885","0.002","6.565","0.0013","90","","90","","90","","481.21","0.16","100","2","100","2","","","","","","","","4","C m m m","-C 2 2","65","Lithium acetate dihydrate","Lithium acetate dihydrate","","- C2 H7 Li O4 -","- C2 H7.08 Li O4 -","- C8 H28.32 Li4 O16 -","4","0.25","","Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez","Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers","Crystal Growth & Design","2011","11","4","1021","","10.1021/cg1010133","","","0.7293","Synchrotron","","0.0356","0.0354","","","0.079","0.0792","","","","","","1.112","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500142","8.8195","0.0011","5.0838","0.0006","11.78","0.0015","90","","109.4","0.001","90","","498.19","0.11","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C3 H4 Cu N3 S -","- C3 H4 Cu N3 S -","- C12 H16 Cu4 N12 S4 -","4","1","","Wang, Yu-Ling; Zhang, Na; Liu, Qing-Yan; Shan, Zeng-Mei; Cao, Rong; Wang, Ming-Sheng; Luo, Jun-Jian; Yang, Er-Lei","Diversity of Architecture of Copper(I) Coordination Polymers Constructed of Copper(I) Halides and 4-Methyl-1,2,4-Triazole-3-Thiol (Hmptrz) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","1","130","","10.1021/cg101018b","","","0.71073","MoKα","","0.035","0.033","","","0.091","0.093","","","","","","1.008","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500143","5.871","0.003","13.107","0.006","10.051","0.005","90","","96.792","0.008","90","","768","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C3 H5 Cu I N3 S -","- C3 H5 Cu I N3 S -","- C12 H20 Cu4 I4 N12 S4 -","4","1","","Wang, Yu-Ling; Zhang, Na; Liu, Qing-Yan; Shan, Zeng-Mei; Cao, Rong; Wang, Ming-Sheng; Luo, Jun-Jian; Yang, Er-Lei","Diversity of Architecture of Copper(I) Coordination Polymers Constructed of Copper(I) Halides and 4-Methyl-1,2,4-Triazole-3-Thiol (Hmptrz) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","1","130","","10.1021/cg101018b","","","0.71073","MoKα","","0.0695","0.0525","","","0.1284","0.1908","","","","","","1.079","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500144","15.6513","0.0015","16.1222","0.0015","16.0671","0.0015","90","","90","","90","","4054.3","0.7","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H8 Cu6 I4 N6 S2 -","- C6 H8 Cu6 I4 N6 S2 -","- C48 H64 Cu48 I32 N48 S16 -","8","1","","Wang, Yu-Ling; Zhang, Na; Liu, Qing-Yan; Shan, Zeng-Mei; Cao, Rong; Wang, Ming-Sheng; Luo, Jun-Jian; Yang, Er-Lei","Diversity of Architecture of Copper(I) Coordination Polymers Constructed of Copper(I) Halides and 4-Methyl-1,2,4-Triazole-3-Thiol (Hmptrz) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","1","130","","10.1021/cg101018b","","","0.71073","MoKα","","0.0607","0.038","","","0.0805","0.0899","","","","","","1.031","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500145","7.1138","0.0007","11.0894","0.0011","11.8195","0.0012","104.967","0.001","92.262","0.001","100.764","0.001","881.15","0.15","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H13 Cu I N9 S3 -","- C9 H13 Cu I N9 S3 -","- C18 H26 Cu2 I2 N18 S6 -","2","1","","Wang, Yu-Ling; Zhang, Na; Liu, Qing-Yan; Shan, Zeng-Mei; Cao, Rong; Wang, Ming-Sheng; Luo, Jun-Jian; Yang, Er-Lei","Diversity of Architecture of Copper(I) Coordination Polymers Constructed of Copper(I) Halides and 4-Methyl-1,2,4-Triazole-3-Thiol (Hmptrz) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","1","130","","10.1021/cg101018b","","","0.71073","MoKα","","0.0699","0.0409","","","0.0792","0.0901","","","","","","1.002","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500146","10.9375","0.0014","6.7299","0.0009","18.584","0.002","90","","90","","90","","1367.9","0.3","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C11 H11 Ca N O6 -","- C11 H11 Ca N O6 -","- C44 H44 Ca4 N4 O24 -","4","0.5","","Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav","Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations","Crystal Growth & Design","2011","11","3","699","","10.1021/cg101114h","","","0.71073","MoKα","","0.097","0.0666","","","0.1898","0.2037","","","","","","1.044","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500147","6.9707","0.0002","17.9921","0.0007","10.008","0.0004","90","","90","","90","","1255.18","0.08","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C11 H12 Ca N2 O5 -","- C11 H12 Ca N2 O5 -","- C44 H48 Ca4 N8 O20 -","4","0.5","","Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav","Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations","Crystal Growth & Design","2011","11","3","699","","10.1021/cg101114h","","","0.71073","MoKα","","0.0591","0.0466","","","0.1328","0.141","","","","","","1.058","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500148","16.614","0.002","13.1785","0.0017","15.63","0.002","90","","91.528","0.003","90","","3420.9","0.7","295","2","295","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C24 H30 Ca3 N2 O19 -","- C24 H30 Ca3 N2 O19 -","- C96 H120 Ca12 N8 O76 -","4","1","","Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav","Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations","Crystal Growth & Design","2011","11","3","699","","10.1021/cg101114h","","","0.71073","MoKα","","0.0666","0.0635","","","0.1707","0.1725","","","","","","1.194","","","","has coordinates,has disorder","179532","2020-10-21","18:00:00",""
"4500149","8.3328","0.0004","8.6794","0.0004","9.9393","0.0005","70.52","0.002","84.459","0.003","73.722","0.002","650.53","0.06","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 Ca N O7 -","- C11 H11 Ca N O7 -","- C22 H22 Ca2 N2 O14 -","2","1","","Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav","Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations","Crystal Growth & Design","2011","11","3","699","","10.1021/cg101114h","","","0.71073","MoKα","","0.0703","0.057","","","0.1607","0.1755","","","","","","1.079","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500150","17.9698","0.0006","10.2569","0.0003","9.665","0.0003","90","","95.204","0.002","90","","1774.06","0.1","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Ca N2 O8 -","- C14 H18 Ca N2 O8 -","- C56 H72 Ca4 N8 O32 -","4","0.5","","Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav","Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations","Crystal Growth & Design","2011","11","3","699","","10.1021/cg101114h","","","0.71073","MoKα","","0.0678","0.0641","","","0.1889","0.1946","","","","","","1.051","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500151","6.0146","0.0002","7.6214","0.0003","11.0855","0.0005","104.367","0.002","93.316","0.002","91.769","0.002","490.9","0.03","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H8 Ca O8 -","- C8 H8 Ca O8 -","- C16 H16 Ca2 O16 -","2","1","","Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav","Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations","Crystal Growth & Design","2011","11","3","699","","10.1021/cg101114h","","","0.71073","MoKα","","0.0261","0.025","","","0.0716","0.0726","","","","","","1.099","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500152","20.5194","0.0019","8.6326","0.0008","17.3333","0.0016","90","","115.009","0.001","90","","2782.5","0.4","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 Br2 N2 O11 Zn2 -","- C26 H20 Br2 N2 O11 Zn2 -","- C104 H80 Br8 N8 O44 Zn8 -","4","0.5","","Ma, Lu-Fang; Li, Xiu-Qin; Meng, Qing-Lei; Wang, Li-Ya; Du, Miao; Hou, Hong-Wei","Significant Positional Isomeric Effect on Structural Assemblies of Zn(II) and Cd(II) Coordination Polymers Based on Bromoisophthalic Acids and Various Dipyridyl-Type Coligands","Crystal Growth & Design","2011","11","1","175","","10.1021/cg101123y","","","0.71073","MoKα","","0.0304","0.0261","","","0.0607","0.0629","","","","","","1.036","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500153","14.3379","0.0015","18.9193","0.0019","16.5885","0.0017","90","","100.739","0.001","90","","4421","0.8","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H19 Br Cd N2 O5 -","- C21 H19 Br Cd N2 O5 -","- C168 H152 Br8 Cd8 N16 O40 -","8","1","","Ma, Lu-Fang; Li, Xiu-Qin; Meng, Qing-Lei; Wang, Li-Ya; Du, Miao; Hou, Hong-Wei","Significant Positional Isomeric Effect on Structural Assemblies of Zn(II) and Cd(II) Coordination Polymers Based on Bromoisophthalic Acids and Various Dipyridyl-Type Coligands","Crystal Growth & Design","2011","11","1","175","","10.1021/cg101123y","","","0.71073","MoKα","","0.0655","0.0355","","","0.0673","0.078","","","","","","1.002","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500154","10.0154","0.0016","14.546","0.002","9.2314","0.0015","90","","97.496","0.002","90","","1333.4","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H16 Br2 N2 O9 Zn2 -","- C26 H16 Br2 N2 O9 Zn2 -","- C52 H32 Br4 N4 O18 Zn4 -","2","0.5","","Ma, Lu-Fang; Li, Xiu-Qin; Meng, Qing-Lei; Wang, Li-Ya; Du, Miao; Hou, Hong-Wei","Significant Positional Isomeric Effect on Structural Assemblies of Zn(II) and Cd(II) Coordination Polymers Based on Bromoisophthalic Acids and Various Dipyridyl-Type Coligands","Crystal Growth & Design","2011","11","1","175","","10.1021/cg101123y","","","0.71073","MoKα","","0.05","0.0406","","","0.1053","0.1116","","","","","","1.038","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500155","10.997","0.006","14.578","0.008","12.963","0.007","90","","105.993","0.006","90","","1997.7","1.9","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 Br N2 O5 Zn -","- C20 H17 Br N2 O5 Zn -","- C80 H68 Br4 N8 O20 Zn4 -","4","1","","Ma, Lu-Fang; Li, Xiu-Qin; Meng, Qing-Lei; Wang, Li-Ya; Du, Miao; Hou, Hong-Wei","Significant Positional Isomeric Effect on Structural Assemblies of Zn(II) and Cd(II) Coordination Polymers Based on Bromoisophthalic Acids and Various Dipyridyl-Type Coligands","Crystal Growth & Design","2011","11","1","175","","10.1021/cg101123y","","","0.71073","MoKα","","0.0458","0.0309","","","0.0698","0.0749","","","","","","1.045","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500156","10.173","0.002","17.211","0.003","11.681","0.002","90","","99.371","0.002","90","","2017.9","0.6","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H17 Br Cd N2 O4 -","- C21 H17 Br Cd N2 O4 -","- C84 H68 Br4 Cd4 N8 O16 -","4","1","","Ma, Lu-Fang; Li, Xiu-Qin; Meng, Qing-Lei; Wang, Li-Ya; Du, Miao; Hou, Hong-Wei","Significant Positional Isomeric Effect on Structural Assemblies of Zn(II) and Cd(II) Coordination Polymers Based on Bromoisophthalic Acids and Various Dipyridyl-Type Coligands","Crystal Growth & Design","2011","11","1","175","","10.1021/cg101123y","","","0.71073","MoKα","","0.0829","0.0566","","","0.1532","0.1728","","","","","","1.105","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500157","4.092","0.0004","4.092","0.0004","9.91","0.001","90","","90","","90","","165.94","0.03","198","2","198","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ce Cu2 Si2 -","- Ce Cu2 Si2 -","- Ce2 Cu4 Si4 -","2","0.0625","","Cao, Chongde; Deppe, Micha; Behr, Günter; Löser, Wolfgang; Wizent, Nadja; Kataeva, Olga; Büchner, Bernd","Single Crystal Growth of the CeCu2Si2Intermetallic Compound by a Vertical Floating Zone Method","Crystal Growth & Design","2011","11","2","431","","10.1021/cg101128w","","","0.71073","MoKα","","0.0199","0.0194","","","0.0479","0.0481","","","","","","1.292","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500158","23.1978","0.0004","5.5469","0.0001","5.198","0.0001","90","","92.215","0.001","90","","668.36","0.02","","","298","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","beta resoryclic acid form I","2,4-hidyroxybenzoic acid form I","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Braun, Doris E.; Karamertzanis, Panagiotis G.; Arlin, Jean-Baptiste; Florence, Alastair J.; Kahlenberg, Volker; Tocher, Derek A.; Griesser, Ulrich J.; Price, Sarah L.","Solid-State Forms of β-Resorcylic Acid: How Exhaustive Should a Polymorph Screen Be?","Crystal growth & design","2011","11","1","210","220","10.1021/cg101162a","powder diffraction","","","","","","","","","","","","","2.877","","","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500159","7.027","0.0004","9.5449","0.0004","11.1763","0.0005","96.684","0.004","104.319","0.005","98.903","0.004","708.15","0.06","173","2","173","2","","","","","","","","3","P -1","-P 1","2","beta resoryclic acid hemihydrate","2,4-hidyroxybenzoic acid hemihydrate","","- C14 H14 O9 -","- C14 H14 O9 -","- C28 H28 O18 -","2","1","","Braun, Doris E.; Karamertzanis, Panagiotis G.; Arlin, Jean-Baptiste; Florence, Alastair J.; Kahlenberg, Volker; Tocher, Derek A.; Griesser, Ulrich J.; Price, Sarah L.","Solid-State Forms of β-Resorcylic Acid: How Exhaustive Should a Polymorph Screen Be?","Crystal growth & design","2011","11","1","210","220","10.1021/cg101162a","","","0.71073","MoKα","","0.0527","0.0382","","","0.0941","0.0996","","","","","","0.966","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500160","11.7363","0.0004","8.5691","0.0002","11.831","0.0004","90","","115.973","0.005","90","","1069.67","0.07","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","beta resoryclate pyridinium salt","2,4-dihydroxybenzoate pyridinium salt","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","","Braun, Doris E.; Karamertzanis, Panagiotis G.; Arlin, Jean-Baptiste; Florence, Alastair J.; Kahlenberg, Volker; Tocher, Derek A.; Griesser, Ulrich J.; Price, Sarah L.","Solid-State Forms of β-Resorcylic Acid: How Exhaustive Should a Polymorph Screen Be?","Crystal growth & design","2011","11","1","210","220","10.1021/cg101162a","","","0.71073","MoKα","","0.0436","0.0337","","","0.0839","0.0874","","","","","","1.033","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500161","6.39832","0.00012","11.7099","0.0003","23.2362","0.0005","90","","90","","90","","1740.94","0.07","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","beta resoryclic DMSO hemisolvate","2,4-hidyroxybenzoic acid DMSO hemisolvate","","- C16 H18 O9 S -","- C16 H18 O9 S -","- C64 H72 O36 S4 -","4","1","","Braun, Doris E.; Karamertzanis, Panagiotis G.; Arlin, Jean-Baptiste; Florence, Alastair J.; Kahlenberg, Volker; Tocher, Derek A.; Griesser, Ulrich J.; Price, Sarah L.","Solid-State Forms of β-Resorcylic Acid: How Exhaustive Should a Polymorph Screen Be?","Crystal growth & design","2011","11","1","210","220","10.1021/cg101162a","","","0.71073","MoKα","","0.0431","0.0367","","","0.0863","0.0887","","","","","","1.019","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500162","5.0643","0.0002","8.3299","0.0003","7.4469","0.0003","90","","107.585","0.002","90","","299.47","0.02","120","","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","Lithium hydrogen L-tartrate","","","- C4 H5 Li O6 -","- C4 H5 Li O6 -","- C8 H10 Li2 O12 -","2","1","","Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K.","Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues","Crystal Growth & Design","2011","11","1","221","","10.1021/cg101170k","","","0.71073","MoKα","","0.0356","0.0326","","","0.0683","0.0704","","","","","","1.109","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500163","5.0445","0.0003","14.93","0.0012","16.1053","0.0012","90","","90","","90","","1212.96","0.15","120","","120","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Dilithium L-tartrate","","","- C4 H4 Li2 O6 -","- C4 H4 Li2 O6 -","- C32 H32 Li16 O48 -","8","2","","Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K.","Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues","Crystal Growth & Design","2011","11","1","221","","10.1021/cg101170k","","","1.5418","CuKα","","0.0517","0.0402","","","0.1005","0.1049","","","","","","0.946","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500164","5.58","0.0006","9.1055","0.0006","12.018","0.0011","90","","90","","90","","610.62","0.1","120","2","120","2","","","","","","","","4","C 2 2 21","C 2c 2","20","Dilithium L-tartrate","","","- C4 H4 Li2 O6 -","- C4 H4 Li2 O6 -","- C16 H16 Li8 O24 -","4","0.5","","Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K.","Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues","Crystal Growth & Design","2011","11","1","221","","10.1021/cg101170k","","","0.71073","MoKα","","0.0644","0.0462","","","0.1193","0.1337","","","","","","0.916","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500165","6.0522","0.0009","5.3351","0.0008","9.8636","0.0014","90","","100.474","0.009","90","","313.18","0.08","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Dilithium meso-tartrate","","","- C4 H4 Li2 O6 -","- C4 H4 Li2 O6 -","- C8 H8 Li4 O12 -","2","0.5","","Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K.","Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues","Crystal Growth & Design","2011","11","1","221","","10.1021/cg101170k","","","0.71073","MoKα","","0.1059","0.081","","","0.1736","0.1906","","","","","","1.014","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500166","15.988","0.01","5.0193","0.0014","15.02","0.008","90","","101.5","0.05","90","","1181.1","1","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Dilithium D,L-tartrate","","","- C4 H4 Li2 O6 -","- C4 H4 Li2 O6 -","- C32 H32 Li16 O48 -","8","1","","Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K.","Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues","Crystal Growth & Design","2011","11","1","221","","10.1021/cg101170k","","","0.7709","synchrotron","","0.093","0.0673","","","0.1886","0.2069","","","","","","1.062","","","","has coordinates,has disorder","179532","2020-10-21","18:00:00",""
"4500167","27.042","0.004","15.42","0.003","8.98","0.0015","90","","104.943","0.003","90","","3617.9","1.1","291","2","291","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C27 H31 Cd N9 O11 -","- C27 H31 Cd N9 O11 -","- C108 H124 Cd4 N36 O44 -","4","1","","Yao, Xiao-Qiang; Cao, Da-Peng; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Chiral and Porous Coordination Polymers Based on an N-Centered Triangular Rigid Ligand","Crystal Growth & Design","2011","11","1","231","","10.1021/cg1011764","","","0.71073","MoKα","","0.0718","0.0571","","","0.1154","0.1178","","","","","","1.068","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500168","16.0155","0.001","16.0155","0.001","26.675","0.003","90","","90","","120","","5925.4","0.8","291","2","291","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C54 H66 Cl2 Co N14 O12 -","- C54 H66 Cl2 Co N14 O11.9998 -","- C162 H198 Cl6 Co3 N42 O35.9994 -","3","0.166667","","Yao, Xiao-Qiang; Cao, Da-Peng; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Chiral and Porous Coordination Polymers Based on an N-Centered Triangular Rigid Ligand","Crystal Growth & Design","2011","11","1","231","","10.1021/cg1011764","","","0.71073","MoKα","","0.0713","0.0529","","","0.1162","0.1203","","","","","","1.056","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500169","9.731","0.002","18.145","0.005","18.588","0.005","90","","96.984","0.005","90","","3257.7","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H29 Co N7 O7 -","- C35 H29 Co N7 O7 -","- C140 H116 Co4 N28 O28 -","4","1","","Yao, Xiao-Qiang; Cao, Da-Peng; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Chiral and Porous Coordination Polymers Based on an N-Centered Triangular Rigid Ligand","Crystal Growth & Design","2011","11","1","231","","10.1021/cg1011764","","","0.71073","MoKα","","0.0652","0.0504","","","0.1327","0.1398","","","","","","1.001","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500170","18.1535","0.0012","18.3033","0.0014","25.2354","0.0019","90","","90","","90","","8384.9","1.1","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C140 H122 Cd4 N28 O31 -","- C140 H122 Cd4 N28 O31 -","- C280 H244 Cd8 N56 O62 -","2","0.5","","Yao, Xiao-Qiang; Cao, Da-Peng; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Chiral and Porous Coordination Polymers Based on an N-Centered Triangular Rigid Ligand","Crystal Growth & Design","2011","11","1","231","","10.1021/cg1011764","","","0.71073","MoKα","","0.0713","0.054","","","0.1019","0.1054","","","","","","1.005","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500171","10.198","0.004","12.33","0.005","19.818","0.008","81.068","0.006","86.281","0.006","84.809","0.007","2448.4","1.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","CoMo8-DMF","","","- C18 H57 Cl Co Mo8 N10 O32 -","- C18 H57 Cl Co Mo8 N10 O32 -","- C36 H114 Cl2 Co2 Mo16 N20 O64 -","2","1","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.0413","0.0335","","","0.0944","0.1231","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500172","14.395","0.003","19.836","0.004","28.009","0.005","90","","90","","90","","7998","3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","CoMo12P-DEF","","","- C36 H90 Co Mo12 N12 O46 P -","- C36 H90 Co Mo12 N12 O46 P -","- C144 H360 Co4 Mo48 N48 O184 P4 -","4","1","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.0886","0.0604","","","0.1041","0.1125","","","","","","0.944","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500173","12.1","0.002","23.4858","0.0013","24.259","0.003","83.935","0.003","79.012","0.003","86.859","0.003","6725.4","1.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","CoMo12P-DMF","","","- C45 H112 Co2 Mo24 N23 O91 P2 -","- C45 H112 Co2 Mo24 N23 O91 P2 -","- C90 H224 Co4 Mo48 N46 O182 P4 -","2","1","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.079","0.0704","","","0.1696","0.1746","","","","","","1.127","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500174","14.538","0.003","19.929","0.004","28.151","0.006","90","","90","","90","","8156","3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","CoW12P-DEF","","","- C31 H24 Co N12 O46 P W12 -","- C31 H24 Co N12 O46 P W12 -","- C124 H96 Co4 N48 O184 P4 W48 -","4","1","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.1062","0.0907","","","0.2071","0.2201","","","","","","1.021","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500175","15.55","0.003","19.059","0.003","23.026","0.004","90","","97.121","0.003","90","","6772","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","CoW12P-DMF","","","- C24 H66 Co N12 O46 P W12 -","- C24 H66 Co N12 O46 P W12 -","- C96 H264 Co4 N48 O184 P4 W48 -","4","1","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.1127","0.0984","","","0.2309","0.2423","","","","","","1.185","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500176","14.0765","0.0011","41.183","0.003","22.7696","0.0018","90","","93.713","0.001","90","","13172.1","1.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","CoW12Si-DEF","","","- C98 H232 Co4 N38 O139 Si3 W36 -","- C98 H232 Co4 N38 O139 Si3 W36 -","- C196 H464 Co8 N76 O278 Si6 W72 -","2","0.5","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.0964","0.0804","","","0.1893","0.1987","","","","","","1.185","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500177","13.1948","0.0011","20.9672","0.0018","29.02","0.003","93.34","0.001","95.474","0.001","97.373","0.002","7905.7","1.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","CoW12Si-DMF","","","- C54 H156 Cl Co3 N30 O95 Si2 W24 -","- C54 H156 Cl Co3 N30 O95 Si2 W24 -","- C108 H312 Cl2 Co6 N60 O190 Si4 W48 -","2","1","","Dey, Chandan; Das, Raja; Pachfule, Pradip; Poddar, Pankaj; Banerjee, Rahul","Structural and Selective Gas Adsorption Studies of Polyoxometalate and Tris(ethylenediamine) Cobalt(III) Based Ionic Crystals","Crystal Growth & Design","2011","11","1","139","","10.1021/cg101201b","","","0.71073","MoKα","","0.0933","0.0782","","","0.2046","0.2179","","","","","","1.027","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500178","7.5822","0.0012","25.215","0.006","10.554","0.003","90","","105.878","0.008","90","","1940.8","0.8","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","dihydrocarbamazepine saccharin","","","- C22 H19 N3 O4 S -","- C22 H19 N3 O4 S -","- C88 H76 N12 O16 S4 -","4","1","","Oliveira, Mark A.; Peterson, Matthew L.; Davey, Roger J.","Relative Enthalpy of Formation for Co-Crystals of Small Organic Molecules","Crystal Growth & Design","2011","11","2","449","","10.1021/cg101214m","","x-ray","0.71073","MoKα","","0.0524","0.0426","","","0.1385","0.15","","","","","","1.203","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500179","7.7883","0.0003","24.709","0.0009","10.5827","0.0004","90","","106.951","0.002","90","","1948.07","0.13","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cyheptamide saccharin","","","- C23 H20 N2 O4 S -","- C23 H20 N2 O4 S -","- C92 H80 N8 O16 S4 -","4","1","","Oliveira, Mark A.; Peterson, Matthew L.; Davey, Roger J.","Relative Enthalpy of Formation for Co-Crystals of Small Organic Molecules","Crystal Growth & Design","2011","11","2","449","","10.1021/cg101214m","","x-ray","0.71073","MoKα","","0.0486","0.0399","","","0.1251","0.1339","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500180","28.057","0.006","30.504","0.006","23.961","0.005","90","","90","","90","","20507","7","150","2","150","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C24 H48 N7 O65 P2 W18 -","- C24 H48 N7 O65.02 P2 W18 -","- C192 H384 N56 O520.16 P16 W144 -","8","1","","Fu, Hai; Li, Yangguang; Lu, Ying; Chen, Weilin; Wu, Qiong; Meng, Jingxin; Wang, Xiaolan; Zhang, Zhiming; Wang, Enbo","Polyoxometalate-Based Metal−Organic Frameworks Assembled under the Ionothermal Conditions","Crystal Growth & Design","2011","11","2","458","","10.1021/cg101224r","","","0.71073","MoKα","","0.1986","0.0816","","","0.164","0.2062","","","","","","0.957","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500181","14.661","0.003","26.008","0.005","25.117","0.007","90","","122.75","0.02","90","","8055","4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H49 Cu N14 O62 P2 W18 -","- C35 H49 Cu N14 O62 P2 W18 -","- C140 H196 Cu4 N56 O248 P8 W72 -","4","1","","Fu, Hai; Li, Yangguang; Lu, Ying; Chen, Weilin; Wu, Qiong; Meng, Jingxin; Wang, Xiaolan; Zhang, Zhiming; Wang, Enbo","Polyoxometalate-Based Metal−Organic Frameworks Assembled under the Ionothermal Conditions","Crystal Growth & Design","2011","11","2","458","","10.1021/cg101224r","","","0.71073","MoKα","","0.0674","0.0488","","","0.087","0.0941","","","","","","1.046","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500182","18.54","0.004","13.302","0.003","43.6","0.012","90","","113.68","0.03","90","","9847","5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C76 H108 Cu5 N32 O130 P4 W36 -","- C76 H108 Cu5 N32 O130 P4 W36 -","- C152 H216 Cu10 N64 O260 P8 W72 -","2","0.5","","Fu, Hai; Li, Yangguang; Lu, Ying; Chen, Weilin; Wu, Qiong; Meng, Jingxin; Wang, Xiaolan; Zhang, Zhiming; Wang, Enbo","Polyoxometalate-Based Metal−Organic Frameworks Assembled under the Ionothermal Conditions","Crystal Growth & Design","2011","11","2","458","","10.1021/cg101224r","","","0.71073","MoKα","","0.1376","0.0873","","","0.1598","0.1822","","","","","","1.055","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500183","13.042","0.003","14.212","0.003","28.03","0.006","96.1","0.03","90.76","0.03","117.09","0.03","4588","2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H30 Cu N16 O62 P2 W18 -","- C29 H30 Cu N16 O62 P2 W18 -","- C58 H60 Cu2 N32 O124 P4 W36 -","2","1","","Fu, Hai; Li, Yangguang; Lu, Ying; Chen, Weilin; Wu, Qiong; Meng, Jingxin; Wang, Xiaolan; Zhang, Zhiming; Wang, Enbo","Polyoxometalate-Based Metal−Organic Frameworks Assembled under the Ionothermal Conditions","Crystal Growth & Design","2011","11","2","458","","10.1021/cg101224r","","","0.71073","MoKα","","0.107","0.0645","","","0.1661","0.1816","","","","","","0.86","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500184","12.5852","0.0006","8.8884","0.0004","17.8848","0.0006","90","","124.586","0.002","90","","1647.07","0.13","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 N O4 -","- C17 H21 N O4 -","- C68 H84 N4 O16 -","4","1","","Zheng, Sai-Li; Chen, Jia-Mei; Zhang, Wei-Xiong; Lu, Tong-Bu","Structures of Polymorphic Agomelatine and Its Cocrystals with Acetic Acid and Ethylene Glycol","Crystal Growth & Design","2011","11","2","466","","10.1021/cg101234p","","","0.71073","MoKα","","0.0592","0.0403","","","0.1293","0.1569","","","","","","1.164","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500185","15.43","0.0012","9.2934","0.0007","20.8558","0.0013","90","","115.241","0.004","90","","2705.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C120 H136 N8 O16 -","8","2","","Zheng, Sai-Li; Chen, Jia-Mei; Zhang, Wei-Xiong; Lu, Tong-Bu","Structures of Polymorphic Agomelatine and Its Cocrystals with Acetic Acid and Ethylene Glycol","Crystal Growth & Design","2011","11","2","466","","10.1021/cg101234p","","","0.71073","MoKα","","0.1061","0.0714","","","0.1988","0.2273","","","","","","1.036","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500186","12.751","0.0019","8.482","0.0017","11.579","0.0012","90","","99.45","0.019","90","","1235.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N2 O4 S -","- C12 H10 N2 O4 S -","- C48 H40 N8 O16 S4 -","4","1","","Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.","Sulfonamide Molecular Crystals: Thermodynamic and Structural Aspects","Crystal Growth & Design","2011","11","4","1067","","10.1021/cg1012389","","","0.71073","MoKα","","0.072","0.0389","","","0.0881","0.1031","","","","","","1.002","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500187","5.7526","0.0011","15.465","0.003","30.087","0.006","90","","90","","90","","2676.7","0.9","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H11 N3 O4 S -","- C12 H11 N3 O4 S -","- C96 H88 N24 O32 S8 -","8","1","","Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.","Sulfonamide Molecular Crystals: Thermodynamic and Structural Aspects","Crystal Growth & Design","2011","11","4","1067","","10.1021/cg1012389","","","0.7107","MoKα","","","0.0543","","","","0.0692","","","","","","1.149","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500188","26.764","0.006","24.756","0.005","8.0027","0.0017","90","","100.543","0.004","90","","5212.8","1.9","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H11 N3 O2 S -","- C13 H11 N3 O2 S -","- C208 H176 N48 O32 S16 -","16","2","","Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.","Sulfonamide Molecular Crystals: Thermodynamic and Structural Aspects","Crystal Growth & Design","2011","11","4","1067","","10.1021/cg1012389","","","0.7107","MoKα","","","0.0626","","","","0.067","","","","","","1.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500189","8.8551","0.0019","8.8551","0.0019","30.282","0.007","90","","90","","90","","2374.5","0.9","293","","293","","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C12 H11 N O2 S -","- C12 H11 N O2 S -","- C96 H88 N8 O16 S8 -","8","1","","Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.","Sulfonamide Molecular Crystals: Thermodynamic and Structural Aspects","Crystal Growth & Design","2011","11","4","1067","","10.1021/cg1012389","","","0.7107","MoKα","","","0.0615","","","","0.0537","","","","","","1.135","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500190","7.3056","0.0012","11.9291","0.0019","13.974","0.002","90","","101.169","0.003","90","","1194.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Co N8 O4 -","- C26 H22 Co N8 O4 -","- C52 H44 Co2 N16 O8 -","2","0.5","","Chen, Shui-Sheng; Lv, Gao-Chao; Fan, Jian; Okamura, Taka-aki; Chen, Min; Sun, Wei-Yin","Entangled Coordination Frameworks with 1,4-Di(1H-imidazol-4-yl)benzene","Crystal Growth & Design","2011","11","4","1082","","10.1021/cg1012439","","","0.71073","MoKα","","0.0482","0.0402","","","0.0932","0.0966","","","","","","1.047","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500191","7.2995","0.0007","11.8735","0.0012","13.8868","0.0014","90","","101.268","0.002","90","","1180.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 N8 Ni O4 -","- C26 H22 N8 Ni O4 -","- C52 H44 N16 Ni2 O8 -","2","0.5","","Chen, Shui-Sheng; Lv, Gao-Chao; Fan, Jian; Okamura, Taka-aki; Chen, Min; Sun, Wei-Yin","Entangled Coordination Frameworks with 1,4-Di(1H-imidazol-4-yl)benzene","Crystal Growth & Design","2011","11","4","1082","","10.1021/cg1012439","","","0.71073","MoKα","","0.0354","0.0327","","","0.0838","0.0855","","","","","","1.006","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500192","14.314","0.003","14.314","0.003","6.2872","0.0012","90","","90","","90","","1288.2","0.5","291","2","291","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C24 H22 Co N8 O2 -","- C24 H22 Co N8 O2 -","- C48 H44 Co2 N16 O4 -","2","0.25","","Chen, Shui-Sheng; Lv, Gao-Chao; Fan, Jian; Okamura, Taka-aki; Chen, Min; Sun, Wei-Yin","Entangled Coordination Frameworks with 1,4-Di(1H-imidazol-4-yl)benzene","Crystal Growth & Design","2011","11","4","1082","","10.1021/cg1012439","","","0.71073","MoKα","","0.0506","0.0449","","","0.1093","0.1119","","","","","","1.017","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500193","9.943","0.002","21.71","0.005","13.266","0.003","90","","97.638","0.004","90","","2838.2","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N8 Ni O6 S -","- C24 H16 N8 Ni O6 S -","- C96 H64 N32 Ni4 O24 S4 -","4","1","","Chen, Shui-Sheng; Lv, Gao-Chao; Fan, Jian; Okamura, Taka-aki; Chen, Min; Sun, Wei-Yin","Entangled Coordination Frameworks with 1,4-Di(1H-imidazol-4-yl)benzene","Crystal Growth & Design","2011","11","4","1082","","10.1021/cg1012439","","","0.71073","MoKα","","0.0677","0.0523","","","0.1383","0.1474","","","","","","0.998","","","","has coordinates,has disorder","179532","2020-10-21","18:00:00",""
"4500194","12.692","0.008","8.213","0.004","11.99","0.006","90","","118.75","0.02","90","","1095.8","1.1","200","","200","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","[Ag2(A)]","","- C12 H8 Ag2 N4 -","- C12 H8 Ag2 N4 -","- C48 H32 Ag8 N16 -","4","0.5","","Chen, Shui-Sheng; Lv, Gao-Chao; Fan, Jian; Okamura, Taka-aki; Chen, Min; Sun, Wei-Yin","Entangled Coordination Frameworks with 1,4-Di(1H-imidazol-4-yl)benzene","Crystal Growth & Design","2011","11","4","1082","","10.1021/cg1012439","","","0.71075","MoKα","","0.0221","0.021","","","0.0525","0.053","","","","","","1.104","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500195","15.616","0.0012","17.365","0.0013","19.962","0.0015","75.813","0.001","89.468","0.0009","76.036","0.0009","5085.8","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H70 Ag7 N20 O63 P2 W18 -","- C50 H70 Ag7 N20 O63 P2 W18 -","- C100 H140 Ag14 N40 O126 P4 W36 -","2","1","","Zhang, Peng-peng; Peng, Jun; Pang, Hai-jun; Sha, Jing-quan; Zhu, Min; Wang, Dan-dan; Liu, Ming-guan; Su, Zhong-min","An Interpenetrating Architecture Based on the Wells‒Dawson Polyoxometalate and AgI···AgIInteractions","Crystal Growth & Design","2011","11","7","2736","","10.1021/cg1012445","","","0.71069","MoKα","","0.0595","0.0442","","","0.1325","0.1512","","","","","","0.993","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500196","29.084","0.005","18.553","0.005","20.463","0.005","90","0.005","107.775","0.005","90","0.005","10515","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H44 N8 O10 Zn2 -","- C58 H44 N8 O10 Zn2 -","- C464 H352 N64 O80 Zn16 -","8","1","","Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan","Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium","Crystal Growth & Design","2011","11","3","735","","10.1021/cg101251a","","","0.71073","MoKα","","0.0794","0.0534","","","0.1476","0.1572","","","","","","1.087","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500197","11.715","0.002","16.47","0.003","12.837","0.003","90","","107.714","0.003","90","","2359.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 N4 O4 Zn -","- C26 H16 N4 O4 Zn -","- C104 H64 N16 O16 Zn4 -","4","1","","Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan","Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium","Crystal Growth & Design","2011","11","3","735","","10.1021/cg101251a","","","0.71073","MoKα","","0.0771","0.0445","","","0.0981","0.1112","","","","","","1.021","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500198","16.722","0.005","6.451","0.005","25.122","0.005","90","0.005","104.131","0.005","90","0.005","2628","2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 Cd N4 O6 -","- C26 H16 Cd N4 O6 -","- C104 H64 Cd4 N16 O24 -","4","1","","Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan","Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium","Crystal Growth & Design","2011","11","3","735","","10.1021/cg101251a","","","0.71073","MoKα","","0.065","0.0559","","","0.1495","0.1554","","","","","","1.05","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500199","24.175","0.006","11.436","0.003","18.386","0.005","90","","101.507","0.004","90","","4981","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H20 N5 O4 Zn -","- C29 H20 N5 O4 Zn -","- C232 H160 N40 O32 Zn8 -","8","1","","Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan","Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium","Crystal Growth & Design","2011","11","3","735","","10.1021/cg101251a","","","0.71073","MoKα","","0.0845","0.0575","","","0.1018","0.1107","","","","","","1.114","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4500200","14.8013","0.0013","6.3249","0.0005","28.897","0.002","90","","93.569","0.001","90","","2700","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cd N2 O5 -","- C14 H10 Cd N2 O5 -","- C112 H80 Cd8 N16 O40 -","8","1","","Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan","Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium","Crystal Growth & Design","2011","11","3","735","","10.1021/cg101251a","","","0.71073","MoKα","","0.0629","0.0561","","","0.1385","0.1439","","","","","","1.098","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500201","33.9988","0.001","5.6638","0.0001","16.5382","0.0005","90","","101.437","0.003","90","","3121.4","0.15","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H21 N4 O14 Zn5 -","- C28 H21 N4 O14 Zn5 -","- C112 H84 N16 O56 Zn20 -","4","0.5","","Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan","Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium","Crystal Growth & Design","2011","11","3","735","","10.1021/cg101251a","","","0.71073","MoKα","","0.0644","0.0443","","","0.1174","0.1219","","","","","","1.115","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500202","13.001","0.003","26.347","0.006","13.131","0.003","90","","117.311","0.004","90","","3996.5","1.6","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H22 F6 N4 O4 Zn -","- C31 H22 F6 N4 O4 Zn -","- C124 H88 F24 N16 O16 Zn4 -","4","1","","Ji, Chang-Chun; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Effect of Different Imidazole Ancillary Ligands on Supramolecular Architectures of a Series of Zn(II) and Cd(II) Complexes with a Bent Dicarboxylate Ligand","Crystal Growth & Design","2011","11","2","480","","10.1021/cg101261f","","","0.71073","MoKα","","0.0793","0.0437","","","0.0894","0.0997","","","","","","1.069","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500203","7.4302","0.0009","25.077","0.003","13.2325","0.0016","90","","102.193","0.002","90","","2410","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H15 Cd F6 N2 O4 -","- C24 H15 Cd F6 N2 O4 -","- C96 H60 Cd4 F24 N8 O16 -","4","1","","Ji, Chang-Chun; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Effect of Different Imidazole Ancillary Ligands on Supramolecular Architectures of a Series of Zn(II) and Cd(II) Complexes with a Bent Dicarboxylate Ligand","Crystal Growth & Design","2011","11","2","480","","10.1021/cg101261f","","","0.71073","MoKα","","0.0722","0.0492","","","0.1473","0.1584","","","","","","1","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500204","14.253","0.002","29.965","0.005","18.34","0.003","90","","112.87","","90","","7217","2","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C77 H59 F12 N9 O9 Zn2 -","- C77 H59 F12 N9 O9 Zn2 -","- C308 H236 F48 N36 O36 Zn8 -","4","1","","Ji, Chang-Chun; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Effect of Different Imidazole Ancillary Ligands on Supramolecular Architectures of a Series of Zn(II) and Cd(II) Complexes with a Bent Dicarboxylate Ligand","Crystal Growth & Design","2011","11","2","480","","10.1021/cg101261f","","","0.71073","MoKα","","0.0967","0.0558","","","0.113","0.1222","","","","","","1.037","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500205","23.685","0.003","14.647","0.002","29.08","0.004","90","","101.867","0.002","90","","9873","2","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C45 H30 F6 N4 O4 Zn -","- C45 H30 F6 N4 O4 Zn -","- C360 H240 F48 N32 O32 Zn8 -","8","1","","Ji, Chang-Chun; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Effect of Different Imidazole Ancillary Ligands on Supramolecular Architectures of a Series of Zn(II) and Cd(II) Complexes with a Bent Dicarboxylate Ligand","Crystal Growth & Design","2011","11","2","480","","10.1021/cg101261f","","","0.71073","MoKα","","0.0662","0.0493","","","0.1315","0.1363","","","","","","1.048","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500206","13.9275","0.0015","16.4116","0.0017","17.7029","0.0019","110.472","0.002","96.531","0.002","109.872","0.002","3438.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C152 H104 Cd4 F24 N12 O19 -","- C152 H104 Cd4 F24 N12 O19 -","- C152 H104 Cd4 F24 N12 O19 -","1","0.5","","Ji, Chang-Chun; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Effect of Different Imidazole Ancillary Ligands on Supramolecular Architectures of a Series of Zn(II) and Cd(II) Complexes with a Bent Dicarboxylate Ligand","Crystal Growth & Design","2011","11","2","480","","10.1021/cg101261f","","","0.71073","MoKα","","0.0695","0.0435","","","0.0712","0.0744","","","","","","1.001","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500207","12.4893","0.0011","10.3565","0.0009","12.0625","0.0011","90","","115.579","0.001","90","","1407.3","0.2","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Fe I N2 -","- C14 H15 Fe I N2 -","- C56 H60 Fe4 I4 N8 -","4","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.0205","0.0172","","","0.041","0.0426","","","","","","1.053","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500208","9.4333","0.0009","7.3718","0.0007","24.192","0.002","90","","96.023","0.001","90","","1673","0.3","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 Fe I N3 -","- C16 H20 Fe I N3 -","- C64 H80 Fe4 I4 N12 -","4","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.0259","0.0223","","","0.0556","0.0574","","","","","","1.172","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500209","36.863","0.002","5.8375","0.0003","13.9186","0.0008","90","","97.828","0.001","90","","2967.2","0.3","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H17 Fe I N2 -","- C15 H17 Fe I N2 -","- C120 H136 Fe8 I8 N16 -","8","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.0358","0.026","","","0.0597","0.0762","","","","","","1.087","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500210","17.167","0.004","7.3457","0.0015","16.854","0.004","90","","116.777","0.002","90","","1897.4","0.7","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Fe I N2 O -","- C20 H19 Fe I N2 O -","- C80 H76 Fe4 I4 N8 O4 -","4","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.0591","0.0512","","","0.1176","0.1207","","","","","","1.197","","","","has coordinates,has disorder","179533","2020-10-21","18:00:00",""
"4500211","15.0403","0.0014","15.055","0.0014","18.998","0.0018","90","","90.773","0.002","90","","4301.4","0.7","193","","193","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H25 Fe I N2 -","- C23 H25 Fe I N2 -","- C184 H200 Fe8 I8 N16 -","8","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.0792","0.0613","","","0.1938","0.2034","","","","","","1.026","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500212","15.4138","0.0015","13.9173","0.0011","9.6697","0.0008","90","","97.185","0.005","90","","2058","0.3","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Fe I N3 -","- C22 H24 Fe I N3 -","- C88 H96 Fe4 I4 N12 -","4","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.1142","0.113","","","0.3168","0.3174","","","","","","2.067","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500213","10.3373","0.0007","7.6643","0.0005","26.9445","0.0019","90","","90","","90","","2134.8","0.3","193","2","193","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H12 Fe N2 -","- C13 H12 Fe N2 -","- C104 H96 Fe8 N16 -","8","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.026","0.0221","","","0.056","0.0588","","","","","","1.062","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500214","15.0084","0.0012","7.7066","0.0006","12.8364","0.001","90","","104.69","0.001","90","","1436.2","0.2","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Fe N2 -","- C19 H16 Fe N2 -","- C76 H64 Fe4 N8 -","4","1","","Mochida, Tomoyuki; Miura, Yuji; Shimizu, Fumiko","Assembled Structures and Cation−Anion Interactions in Crystals of Alkylimidazolium and Alkyltriazolium Iodides with Ferrocenyl Substituents","Crystal Growth & Design","2011","11","1","262","","10.1021/cg101264h","","","0.71073","MoKα","","0.0576","0.0408","","","0.0955","0.1032","","","","","","1.039","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500215","11.8","0.002","4.911","0.001","8.846","0.0018","90","","91.41","0.03","90","","512.47","0.17","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Lithium butyrate","Lithium butanoate","","- C4 H7 Li O2 -","- C4 H7 Li O2 -","- C16 H28 Li4 O8 -","4","1","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","","","0.7514","Synchrotron","","0.0884","0.075","","","0.2006","0.2201","","","","","","1.045","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500216","12.153","0.002","4.928","0.001","8.905","0.0018","90","","91.58","0.03","90","","533.12","0.18","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Lithium butyrate","Lithium butanoate","","- C4 H7 Li O2 -","- C4 H7 Li O2 -","- C16 H28 Li4 O8 -","4","1","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","","","0.7513","Synchrotron","","0.0805","0.065","","","0.1862","0.207","","","","","","1.112","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500217","15.56795","0.00016","7.26249","0.00005","4.80093","0.00004","90","","96.9765","0.0007","90","","538.784","0.008","298","","298","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","Lead(II) butyrate","Lead(II) butanoate","","- C8 H14 O4 Pb -","- C8 H14 O4 Pb -","- C16 H28 O8 Pb2 -","2","0.5","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","powder diffraction","","0.8266","","","","","","","","","","4.7202","1.86","","","","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500218","18.052","0.003","18.052","0.003","19.523","0.004","90","","90","","90","","6362","2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Lithium and Lead(II) Butanoate","Lithium and Lead(II) Tributanoate","","- C12 H21 Li O6 Pb -","- C12 H21 Li O6 Pb -","- C192 H336 Li16 O96 Pb16 -","16","1","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","","","0.7379","Synchrotron","","0.0864","0.0731","","","0.1949","0.2133","","","","","","1.061","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500219","18.417","0.003","18.417","0.003","19.88","0.004","90","","90","","90","","6743","2","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Lithium and Lead(II) Butanoate","Lithium and Lead(II) Tributanoate","","- C12 H21 Li O6 Pb -","- C12 H21 Li O6 Pb -","- C192 H336 Li16 O96 Pb16 -","16","1","","Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez","Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers","Crystal Growth & Design","2011","11","3","759","","10.1021/cg101272n","","","0.7513","Synchrotron","","0.0405","0.0376","","","0.0991","0.1021","","","","","","1.092","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500220","7.0692","0.0004","8.0877","0.0004","20.819","0.001","90.126","0.003","94.01","0.003","98.789","0.003","1173.34","0.11","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H22 N6 O12 -","- C21 H20 N6 O12 -","- C42 H40 N12 O24 -","2","1","","Das, Babulal; Baruah, Jubaraj B.","Water Bridged Assembly and Dimer Formation in Co-Crystals of Caffeine or Theophylline with Polycarboxylic Acids","Crystal Growth & Design","2011","11","1","278","286","10.1021/cg1012846","","","0.71073","MoKα","","0.0564","0.049","","","0.1565","0.1635","","","","","","1.172","","","","has coordinates","211065","2020-10-21","18:00:00",""
"4500221","8.1862","0.0005","9.7027","0.0005","20.4351","0.0011","97.385","0.004","95.162","0.003","107.772","0.003","1518.43","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H14 N6 O7 -","- C12 H14 N6 O7 -","- C48 H56 N24 O28 -","4","2","","Das, Babulal; Baruah, Jubaraj B.","Water Bridged Assembly and Dimer Formation in Co-Crystals of Caffeine or Theophylline with Polycarboxylic Acids","Crystal Growth & Design","2011","11","1","278","286","10.1021/cg1012846","","","0.71073","MoKα","","0.0746","0.0453","","","0.1159","0.1418","","","","","","0.819","","","","has coordinates","211065","2020-10-21","18:00:00",""
"4500222","7.0067","0.0003","8.5496","0.0004","14.864","0.0007","81.218","0.002","76.958","0.002","76.769","0.002","839.62","0.07","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H17 N5 O7 -","- C15 H17 N5 O7 -","- C30 H34 N10 O14 -","2","1","","Das, Babulal; Baruah, Jubaraj B.","Water Bridged Assembly and Dimer Formation in Co-Crystals of Caffeine or Theophylline with Polycarboxylic Acids","Crystal Growth & Design","2011","11","1","278","286","10.1021/cg1012846","","","0.71073","MoKα","","0.0743","0.0421","","","0.1129","0.1279","","","","","","0.947","","","","has coordinates","211065","2020-10-21","18:00:00",""
"4500223","7.5311","0.0007","7.8947","0.0006","14.2199","0.0012","78.166","0.006","75.128","0.006","66.75","0.006","745.63","0.12","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H14 N6 O6 -","- C13 H14 N6 O6 -","- C26 H28 N12 O12 -","2","1","","Das, Babulal; Baruah, Jubaraj B.","Water Bridged Assembly and Dimer Formation in Co-Crystals of Caffeine or Theophylline with Polycarboxylic Acids","Crystal Growth & Design","2011","11","1","278","286","10.1021/cg1012846","","","0.71073","MoKα","","0.062","0.0407","","","0.0937","0.1007","","","","","","0.953","","","","has coordinates","211065","2020-10-21","18:00:00",""
"4500224","9.6071","0.0004","10.373","0.0004","15.3939","0.0007","76.39","0.003","81.941","0.003","66.586","0.003","1366.35","0.11","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H26 N8 O10 -","- C25 H26 N8 O10 -","- C50 H52 N16 O20 -","2","1","","Das, Babulal; Baruah, Jubaraj B.","Water Bridged Assembly and Dimer Formation in Co-Crystals of Caffeine or Theophylline with Polycarboxylic Acids","Crystal Growth & Design","2011","11","1","278","286","10.1021/cg1012846","","","0.71073","MoKα","","0.1018","0.072","","","0.2149","0.2461","","","","","","1.086","","","","has coordinates","211065","2020-10-21","18:00:00",""
"4500225","20.2347","0.0016","8.9073","0.0007","14.6957","0.0011","90","","95.062","0.001","90","","2638.4","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H11 Cl N2 Pd S -","- C13 H11 Cl N2 Pd S -","- C104 H88 Cl8 N16 Pd8 S8 -","8","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0315","0.0302","","","0.073","0.0735","","","","","","1.307","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500226","20.471","0.003","9.0564","0.0011","14.5722","0.0018","90","","94.027","0.002","90","","2694.9","0.6","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H11 Br N2 Pd S -","- C13 H11 Br N2 Pd S -","- C104 H88 Br8 N16 Pd8 S8 -","8","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0274","0.0247","","","0.0793","0.0807","","","","","","1.244","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500227","8.765","0.002","11.551","0.001","14.331","0.014","90","","106.951","0.017","90","","1387.9","1.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 I N2 Pd S -","- C13 H11 I N2 Pd S -","- C52 H44 I4 N8 Pd4 S4 -","4","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0584","0.052","","","0.1243","0.1391","","","","","","1.27","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500228","12.525","0.005","8.55","0.003","26.157","0.01","90","","90","","90","","2801.1","1.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C13 H11 N3 O3 Pd S -","- C13 H11 N3 O3 Pd S -","- C104 H88 N24 O24 Pd8 S8 -","8","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.1017","0.0929","","","0.1566","0.1602","","","","","","1.354","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500229","13.571","0.002","6.8775","0.0011","19.372","0.003","90","","100.397","0.003","90","","1778.4","0.5","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 Cl N3 O4 Pd S -","- C15 H14 Cl N3 O4 Pd S -","- C60 H56 Cl4 N12 O16 Pd4 S4 -","4","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0968","0.0888","","","0.1647","0.1682","","","","","","1.28","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500230","7.369","0.003","8.716","0.004","10.981","0.005","105.397","0.007","92.893","0.007","95.948","0.007","674.1","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H10 Cl2 N2 Pd S -","- C13 H10 Cl2 N2 Pd S -","- C26 H20 Cl4 N4 Pd2 S2 -","2","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0238","0.0235","","","0.0625","0.0627","","","","","","1.255","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500231","7.4604","0.0009","8.9195","0.001","11.2089","0.0013","106.434","0.002","93.494","0.003","96.418","0.002","707.56","0.14","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C13 H10 Br Cl N2 Pd S -","- C13 H10 Br Cl N2 Pd S -","- C26 H20 Br2 Cl2 N4 Pd2 S2 -","2","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0348","0.0344","","","0.0896","0.0899","","","","","","1.212","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500232","7.506","0.002","10.282","0.001","19.63","0.03","90","","90","","90","","1515","2","298","2","298","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C13 H10 Cl I N2 Pd S -","- C13 H10 Cl I N2 Pd S -","- C52 H40 Cl4 I4 N8 Pd4 S4 -","4","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0447","0.0435","","","0.1094","0.1121","","","","","","1.175","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500233","7.398","0.01","8.812","0.012","11.091","0.015","105.26","0.02","93.73","0.02","97.35","0.02","688.1","1.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H13 Cl N2 Pd S -","- C14 H13 Cl N2 Pd S -","- C28 H26 Cl2 N4 Pd2 S2 -","2","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0354","0.035","","","0.1083","0.1102","","","","","","1.149","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500234","7.421","0.002","8.975","0.003","11.242","0.003","106.21","0.004","93.895","0.005","97.039","0.004","709.5","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H13 Br N2 Pd S -","- C14 H13 Br N2 Pd S -","- C28 H26 Br2 N4 Pd2 S2 -","2","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0283","0.0259","","","0.0674","0.0689","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500235","7.5061","0.0009","9.3051","0.0011","11.5247","0.0014","107.556","0.002","95.126","0.002","96.755","0.002","755.47","0.16","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H13 I N2 Pd S -","- C14 H13 I N2 Pd S -","- C28 H26 I2 N4 Pd2 S2 -","2","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.033","0.0311","","","0.0756","0.0765","","","","","","1.325","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500236","18.605","0.003","11.0738","0.0015","15.988","0.002","90","","113.911","0.002","90","","3011.3","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Cl N2 Pd S -","- C15 H15 Cl N2 Pd S -","- C120 H120 Cl8 N16 Pd8 S8 -","8","2","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0625","0.0527","","","0.1355","0.1407","","","","","","1.054","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500237","18.713","0.005","11.191","0.003","16.218","0.004","90","","114","0.004","90","","3102.7","1.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Br N2 Pd S -","- C15 H15 Br N2 Pd S -","- C120 H120 Br8 N16 Pd8 S8 -","8","2","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.0462","0.0387","","","0.0845","0.0874","","","","","","1.114","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500238","21.27","0.02","11.464","0.004","16.749","0.005","90","","127.517","0.017","90","","3239","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H15 I N2 Pd S -","- C15 H15 I N2 Pd S -","- C120 H120 I8 N16 Pd8 S8 -","8","1","","Singh, Amit; Ramanan, Arunachalam; Bandyopadhyay, Debkumar","Link between Isostructurality, Polymorphism, and Weak Interactions in Palladacycle Crystals: Chemical Insight","Crystal Growth & Design","2011","11","7","2743","","10.1021/cg101289s","","","0.71073","MoKα","","0.1002","0.0681","","","0.1296","0.1412","","","","","","1.06","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500239","22.3848","0.0017","22.3848","0.0017","3.7128","0.0003","90","","90","","90","","1860.4","0.3","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H4 Ag Cl4 N8 -","- C16 H4 Ag Cl4 N8 -","- C64 H16 Ag4 Cl16 N32 -","4","0.25","","Naito, Toshio; Kakizaki, Akihiro; Inabe, Tamotsu; Sakai, Riu; Nishibori, Eiji; Sawa, Hiroshi","Growth of Nanocrystals in a Single Crystal of Different Materials: A Way of Giving Function to Molecular Crystals","Crystal Growth & Design","2011","11","2","501","","10.1021/cg101295p","","","0.71073","MoKα","","0.0538","0.044","","0.0884","0.0859","0.0859","","","","","","0.9189","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500240","22.377","0.0011","22.377","0.0011","3.7289","0.0002","90","","90","","90","","1867.17","0.16","300","","300","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H4 Ag Cl4 N8 -","- C16 H4 Ag Cl4 N8 -","- C64 H16 Ag4 Cl16 N32 -","4","0.25","","Naito, Toshio; Kakizaki, Akihiro; Inabe, Tamotsu; Sakai, Riu; Nishibori, Eiji; Sawa, Hiroshi","Growth of Nanocrystals in a Single Crystal of Different Materials: A Way of Giving Function to Molecular Crystals","Crystal Growth & Design","2011","11","2","501","","10.1021/cg101295p","","","0.71073","MoKα","","0.0505","0.0392","","0.0322","0.0319","0.0319","","","","","","1.6109","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500241","22.4002","0.0019","22.4002","0.0019","3.7333","0.0003","90","","90","","90","","1873.3","0.3","100","","100","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H4 Ag Cl4 N8 -","- C16 H4 Ag Cl4 N8 -","- C64 H16 Ag4 Cl16 N32 -","4","0.25","","Naito, Toshio; Kakizaki, Akihiro; Inabe, Tamotsu; Sakai, Riu; Nishibori, Eiji; Sawa, Hiroshi","Growth of Nanocrystals in a Single Crystal of Different Materials: A Way of Giving Function to Molecular Crystals","Crystal Growth & Design","2011","11","2","501","","10.1021/cg101295p","","","0.71073","MoKα","","0.0711","0.0665","","0.072","0.0719","0.0719","","","","","","1.0788","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500242","27.2264","0.0019","13.8822","0.001","18.0322","0.0011","90","","123.734","0.001","90","","5667.9","0.7","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H78 Fe2 N20 Ni2 O5 -","- C42 H78 Fe2 N20 Ni2 O5 -","- C168 H312 Fe8 N80 Ni8 O20 -","4","0.5","","Zheng, Xiao-Dan; Hua, Yan-Long; Xiong, Ren-Gen; Ge, Jia-Zhen; Lu, Tong-Bu","Cyano-Bridged Homochiral Heterometallic Helical Complexes: Synthesis, Structures, Magnetic and Dielectric Properties","Crystal Growth & Design","2011","11","1","302","","10.1021/cg101314j","","","0.71073","MoKα","","0.0801","0.0559","","","0.1369","0.1535","","","","","","1.092","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500243","19.2199","0.0006","19.2199","0.0006","15.8463","0.0007","90","","90","","120","","5069.4","0.3","153","2","153","2","","","","","","","","6","P 61","P 61","169","","","","- C21 H40 Fe N10 Ni O3 -","- C21 H36 Fe N10 Ni O3 -","- C126 H216 Fe6 N60 Ni6 O18 -","6","1","","Zheng, Xiao-Dan; Hua, Yan-Long; Xiong, Ren-Gen; Ge, Jia-Zhen; Lu, Tong-Bu","Cyano-Bridged Homochiral Heterometallic Helical Complexes: Synthesis, Structures, Magnetic and Dielectric Properties","Crystal Growth & Design","2011","11","1","302","","10.1021/cg101314j","","","0.71073","MoKα","","0.0795","0.0461","","","0.0997","0.1286","","","","","","1.084","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500244","19.2182","0.0003","19.2182","0.0003","15.842","0.0004","90","","90","","120","","5067.18","0.17","153","2","153","2","","","","","","","","6","P 65","P 65","170","","","","- C21 H40 Fe N10 Ni O3 -","- C21 H36 Fe N10 Ni O3 -","- C126 H216 Fe6 N60 Ni6 O18 -","6","1","","Zheng, Xiao-Dan; Hua, Yan-Long; Xiong, Ren-Gen; Ge, Jia-Zhen; Lu, Tong-Bu","Cyano-Bridged Homochiral Heterometallic Helical Complexes: Synthesis, Structures, Magnetic and Dielectric Properties","Crystal Growth & Design","2011","11","1","302","","10.1021/cg101314j","","","0.71073","MoKα","","0.0486","0.0359","","","0.0748","0.0831","","","","","","1.062","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500245","10.2422","0.0006","10.2422","0.0006","23.343","0.0016","90","","90","","120","","2120.7","0.2","153","2","153","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C21 H38 Fe N10 Ni O2 -","- C21 H38 Fe N10 Ni O2 -","- C63 H114 Fe3 N30 Ni3 O6 -","3","0.5","","Zheng, Xiao-Dan; Hua, Yan-Long; Xiong, Ren-Gen; Ge, Jia-Zhen; Lu, Tong-Bu","Cyano-Bridged Homochiral Heterometallic Helical Complexes: Synthesis, Structures, Magnetic and Dielectric Properties","Crystal Growth & Design","2011","11","1","302","","10.1021/cg101314j","","","0.71073","MoKα","","0.1114","0.0469","","","0.0905","0.1298","","","","","","1.095","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500246","10.2272","0.0006","10.2272","0.0006","23.3035","0.0014","90","","90","","120","","2110.9","0.2","153","2","153","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C21 H38 Fe N10 Ni O2 -","- C21 H38 Fe N10 Ni O2 -","- C63 H114 Fe3 N30 Ni3 O6 -","3","0.5","","Zheng, Xiao-Dan; Hua, Yan-Long; Xiong, Ren-Gen; Ge, Jia-Zhen; Lu, Tong-Bu","Cyano-Bridged Homochiral Heterometallic Helical Complexes: Synthesis, Structures, Magnetic and Dielectric Properties","Crystal Growth & Design","2011","11","1","302","","10.1021/cg101314j","","","0.71073","MoKα","","0.0309","0.0279","","","0.0646","0.0659","","","","","","1.036","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500247","6.3217","0.0002","8.5303","0.0003","15.5713","0.0006","80.929","0.002","89.67","0.002","69.818","0.002","777.21","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H34 N4 O10 -","- C32 H34 N4 O10 -","- C32 H34 N4 O10 -","1","0.5","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.0532","0.0465","","","0.1318","0.1382","","","","","","1.068","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500248","9.4527","0.0005","9.474","0.0004","9.7186","0.0004","104.394","0.003","101.121","0.003","106.048","0.003","777.52","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H32 N2 O10 S2 -","- C30 H32 N2 O10 S2 -","- C30 H32 N2 O10 S2 -","1","0.5","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.1029","0.0809","","","0.228","0.2534","","","","","","1.025","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500249","14.9497","0.0005","8.8863","0.0003","12.1128","0.0004","90","","98.096","0.002","90","","1593.12","0.09","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 N4 O8 -","- C36 H30 N4 O8 -","- C72 H60 N8 O16 -","2","0.5","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.0603","0.04","","","0.0983","0.1074","","","","","","0.997","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500250","8.79","0.003","12.746","0.004","15.13","0.005","101.03","0.013","91.205","0.014","99.449","0.012","1638.8","0.9","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C80 H62 N8 O8 -","- C80 H62 N8 O8 -","- C80 H62 N8 O8 -","1","0.5","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.1664","0.0585","","","0.1175","0.1475","","","","","","1.016","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500251","23.4842","0.0015","5.0207","0.0004","25.7292","0.0016","90","","115.859","0.004","90","","2729.9","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C128 H104 N8 O32 -","8","2","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.086","0.0452","","","0.1081","0.1324","","","","","","0.925","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500252","26.316","0.011","7.329","0.004","7.737","0.003","90","","90","","90","","1492.2","1.2","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C16 H15 N O5 -","- C16 H15 N O5 -","- C64 H60 N4 O20 -","4","1","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.0529","0.0476","","","0.117","0.1207","","","","","","1.073","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500253","8.665","0.0017","12.644","0.002","12.964","0.002","77.925","0.009","86.183","0.008","87.733","0.009","1385.4","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H27 N3 O4 -","- C34 H27 N3 O4 -","- C68 H54 N6 O8 -","2","1","","Singh, Devendra; Baruah, Jubaraj B.","Structural Study on Solvates of Dopamine-Based Cyclic Imide Derivatives","Crystal Growth & Design","2011","11","3","768","","10.1021/cg101316u","","","0.71073","MoKα","","0.0907","0.0673","","","0.1995","0.2204","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500254","12.824","0.003","16.867","0.003","17.66","0.004","90","","94.5","0.03","90","","3808.1","1.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H50 Cu N4 O13 -","- C34 H50 Cu N4 O13 -","- C136 H200 Cu4 N16 O52 -","4","1","","Luo, Geng-Geng; Xiong, Hong-Bo; Dai, Jing-Cao","Syntheses, Structural Characterization, and Properties of {[Cu(bpp)2(H2O)2](tp)·7H2O} and {[Cu(bpp)2(H2O)](ip)·7H2O} Complexes. New Examples of the Organic Anionic Template Effect on Induced Assembly of Water Clusters (bpp = 1,3-Bis(4-pyridyl)propane, tp = Terephthalate, ip = Isophthalate)†","Crystal Growth & Design","2011","11","2","507","","10.1021/cg1013208","","","0.71073","MoKα","","0.0442","0.0351","","","0.0869","0.0914","","","","","","1.059","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500255","10.439","0.002","16.863","0.003","11.302","0.002","90","","107.84","0.03","90","","1893.9","0.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H48 Cu N4 O12 -","- C34 H48 Cu N4 O12 -","- C68 H96 Cu2 N8 O24 -","2","1","","Luo, Geng-Geng; Xiong, Hong-Bo; Dai, Jing-Cao","Syntheses, Structural Characterization, and Properties of {[Cu(bpp)2(H2O)2](tp)·7H2O} and {[Cu(bpp)2(H2O)](ip)·7H2O} Complexes. New Examples of the Organic Anionic Template Effect on Induced Assembly of Water Clusters (bpp = 1,3-Bis(4-pyridyl)propane, tp = Terephthalate, ip = Isophthalate)†","Crystal Growth & Design","2011","11","2","507","","10.1021/cg1013208","","","0.71073","MoKα","","0.0957","0.0373","","","0.0708","0.1092","","","","","","1.126","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500256","17.5949","0.0003","17.5949","0.0003","22.5436","0.0013","90","","90","","120","","6044","0.4","293","2","293","2","","","","","","","","5","P 64 2 2","P 64 2 (0 0 2)","181","","","","- C18 H36 Cu7 I7 N6 -","- C18 H36 Cu7 I7 N6 -","- C108 H216 Cu42 I42 N36 -","6","0.5","","Zhang, Ying; He, Xinwei; Zhang, Jian; Feng, Pingyun","CuI Cluster-Based Organic Frameworks with Unusual 4- and 5-Connected Topologies","Crystal Growth & Design","2011","11","1","29","","10.1021/cg101321u","","","0.71073","MoKα","","0.0356","0.0303","","","0.073","0.0754","","","","","","1.071","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500257","15.2229","0.0001","15.2229","0.0001","6.8862","0.0001","90","","90","","120","","1381.99","0.02","293","2","293","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- C20 H36 Cu8 I6 N8 -","- C20.06 Cu8 I6 N8 -","- C20.06 Cu8 I6 N8 -","1","0.0833333","","Zhang, Ying; He, Xinwei; Zhang, Jian; Feng, Pingyun","CuI Cluster-Based Organic Frameworks with Unusual 4- and 5-Connected Topologies","Crystal Growth & Design","2011","11","1","29","","10.1021/cg101321u","","","0.71073","MoKα","","0.066","0.0467","","","0.1342","0.1441","","","","","","1.116","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500258","33.758","0.007","23.128","0.005","21.937","0.004","90","","124.48","0.03","90","","14119","7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C128 H124 Mn9 N32 O55 -","- C128 H84 Mn9 N32 O55 -","- C512 H336 Mn36 N128 O220 -","4","0.5","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.093","0.0624","","","0.1422","0.1558","","","","","","1.06","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500259","11.135","0.002","11.234","0.002","21.495","0.004","96.09","0.03","94.38","0.03","92.4","0.03","2662.5","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H47 Mn3.5 N12 O21 -","- C48 H30 Mn3.5 N12 O21 -","- C96 H60 Mn7 N24 O42 -","2","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.1422","0.1087","","","0.2714","0.2864","","","","","","1.059","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500260","23.817","0.005","10.971","0.002","17.866","0.004","90","","127.26","0.03","90","","3715","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H12.75 Cu N4 O5.37 -","- C16 H11.25 Cu N4 O5.375 -","- C128 H90 Cu8 N32 O43 -","8","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.0806","0.062","","","0.1594","0.1702","","","","","","1.063","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500261","15.241","0.003","9.853","0.002","15.122","0.003","90","","96.02","0.03","90","","2258.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19.5 H18.75 N5.25 O5 Zn -","- C19.5 H17.25 N5.25 O5 Zn -","- C78 H69 N21 O20 Zn4 -","4","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.1741","0.0769","","","0.1927","0.2584","","","","","","1.007","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500262","23.987","0.005","16.74","0.003","16.896","0.003","90","","95.55","0.03","90","","6753","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43.5 H32.5 N10.5 O9 Zn2 -","- C43.5 H27.5 N10.5 O9 Zn2 -","- C174 H110 N42 O36 Zn8 -","4","0.5","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.0901","0.0623","","","0.1983","0.2173","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500263","15.656","0.003","19.749","0.004","16.405","0.003","90","","114.35","0.03","90","","4621.1","1.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H47.5 N12 O14.75 Zn2 -","- C42 H40 N12 O14.75 Zn2 -","- C168 H160 N48 O59 Zn8 -","4","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.1057","0.0708","","","0.1723","0.1855","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500264","7.3126","0.0015","31.409","0.006","15.622","0.003","90","","93.06","0.03","90","","3583","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H35 Cd2 N8 O15.5 -","- C32 H35 Cd2 N8 O15.5 -","- C128 H140 Cd8 N32 O62 -","4","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.0875","0.0615","","","0.1536","0.1648","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500265","8.6342","0.0017","22.139","0.004","12.024","0.002","90","","102.26","0.03","90","","2246","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H22.5 Cd N4 O10.25 -","- C16 H22 Cd N4 O10.25 -","- C64 H88 Cd4 N16 O41 -","4","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.0884","0.0627","","","0.182","0.2012","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500266","11.7859","0.0011","24.442","0.002","9.9888","0.0008","90","","110.577","0.005","90","","2693.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H24 Cd N6 O4 -","- C29 H24 Cd N6 O4 -","- C116 H96 Cd4 N24 O16 -","4","1","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.0535","0.035","","","0.0828","0.0919","","","","","","1.054","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500267","24.878","0.005","13.989","0.003","14.758","0.003","90","","118.03","0.03","90","","4534","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 Cd2 N12 O14 -","- C42 H32 Cd2 N12 O14 -","- C168 H128 Cd8 N48 O56 -","4","0.5","","Li, Baiyan; Yang, Fen; Li, Guanghua; Liu, Dan; Zhou, Qi; Shi, Zhan; Feng, Shouhua","Construction of Coordination Polymers Based on Bent 4-Amino-3,5-bis(3-carboxyphenyl)-1,2,4-triazole Ligand: Diverse Structural Topology and Photoluminescent and Magnetic Properties","Crystal Growth & Design","2011","11","5","1475","","10.1021/cg101335a","","","0.71073","MoKα","","0.0342","0.0288","","","0.0782","0.0803","","","","","","1.08","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500268","7.8015","0.0006","8.4145","0.0007","14.759","0.0011","82.508","0.001","79.936","0.001","77.708","0.001","927.71","0.13","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cl4 N8 O4 Zn2 -","- C36 H28 Cl4 N8 O4 Zn2 -","- C36 H28 Cl4 N8 O4 Zn2 -","1","0.5","","Adarsh, N. N.; Dastidar, Parthasarathi","A New Series of ZnIICoordination Polymer Based Metallogels Derived from Bis-pyridyl-bis-amide Ligands: A Crystal Engineering Approach","Crystal Growth & Design","2011","11","1","328","","10.1021/cg101342g","","","0.71073","MoKα","","0.031","0.027","","","0.0768","0.0794","","","","","","1.038","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500269","7.8225","0.0009","8.4218","0.0009","14.8851","0.0016","82.023","0.002","80.663","0.002","78.46","0.002","942.32","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Br4 N8 O4 Zn2 -","- C36 H28 Br4 N8 O4 Zn2 -","- C36 H28 Br4 N8 O4 Zn2 -","1","0.5","","Adarsh, N. N.; Dastidar, Parthasarathi","A New Series of ZnIICoordination Polymer Based Metallogels Derived from Bis-pyridyl-bis-amide Ligands: A Crystal Engineering Approach","Crystal Growth & Design","2011","11","1","328","","10.1021/cg101342g","","","0.71073","MoKα","","0.0448","0.0334","","","0.0761","0.0807","","","","","","1.035","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500270","7.9309","0.0016","8.821","0.002","15.17","0.003","83.763","0.011","81.709","0.011","80.531","0.011","1031.9","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 I4 N8 O4 Zn2 -","- C36 H28 I4 N8 O4 Zn2 -","- C36 H28 I4 N8 O4 Zn2 -","1","0.5","","Adarsh, N. N.; Dastidar, Parthasarathi","A New Series of ZnIICoordination Polymer Based Metallogels Derived from Bis-pyridyl-bis-amide Ligands: A Crystal Engineering Approach","Crystal Growth & Design","2011","11","1","328","","10.1021/cg101342g","","","0.71073","MoKα","","0.0882","0.066","","","0.1812","0.2259","","","","","","1.058","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500271","16.352","0.004","7.805","0.002","17.651","0.005","90","","113.737","0.005","90","","2062.2","0.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Cl2 N4 O4 Zn -","- C18 H14 Cl2 N4 O4 Zn -","- C72 H56 Cl8 N16 O16 Zn4 -","4","1","","Adarsh, N. N.; Dastidar, Parthasarathi","A New Series of ZnIICoordination Polymer Based Metallogels Derived from Bis-pyridyl-bis-amide Ligands: A Crystal Engineering Approach","Crystal Growth & Design","2011","11","1","328","","10.1021/cg101342g","","","0.71073","MoKα","","0.1061","0.0971","","","0.2899","0.2935","","","","","","1.222","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500272","8.671","0.011","9.631","0.013","13.505","0.017","74.014","0.015","74.102","0.016","68.061","0.015","987","2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H17 Cl2 N4 O3 Zn -","- C19 H14 Cl2 N4 O3 Zn -","- C38 H28 Cl4 N8 O6 Zn2 -","2","1","","Adarsh, N. N.; Dastidar, Parthasarathi","A New Series of ZnIICoordination Polymer Based Metallogels Derived from Bis-pyridyl-bis-amide Ligands: A Crystal Engineering Approach","Crystal Growth & Design","2011","11","1","328","","10.1021/cg101342g","","","0.71073","MoKα","","0.0995","0.0813","","","0.2237","0.239","","","","","","1.07","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500273","8.7547","0.0003","9.6918","0.0004","13.655","0.0005","73.332","0.001","74.563","0.001","67.67","0.001","1010.41","0.07","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H17 Br2 N4 O3 Zn -","- C19 H17 Br2 N4 O3 Zn -","- C38 H34 Br4 N8 O6 Zn2 -","2","1","","Adarsh, N. N.; Dastidar, Parthasarathi","A New Series of ZnIICoordination Polymer Based Metallogels Derived from Bis-pyridyl-bis-amide Ligands: A Crystal Engineering Approach","Crystal Growth & Design","2011","11","1","328","","10.1021/cg101342g","","","0.71073","MoKα","","0.043","0.0328","","","0.0785","0.0833","","","","","","1.048","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500274","10.0495","0.0002","11.0245","0.0004","18.1435","0.0004","81.327","0.007","78.6","0.005","79.416","0.006","1923.23","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H23 Eu3 N4 O26 S -","- C28 H23 Eu3 N4 O26 S -","- C56 H46 Eu6 N8 O52 S2 -","2","1","","Xu, Jing; Su, Weiping; Hong, Maochun","A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate","Crystal Growth & Design","2011","11","1","337","","10.1021/cg101343k","","","0.71073","MoKα","","0.0444","0.0364","","","0.092","0.0998","","","","","","1.113","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500275","10.6886","0.0005","16.4787","0.0007","12.4214","0.0006","90","","100.007","0.004","90","","2154.55","0.17","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 Ce2 N2 O16 S -","- C14 H14 Ce2 N2 O16 S -","- C56 H56 Ce8 N8 O64 S4 -","4","1","","Xu, Jing; Su, Weiping; Hong, Maochun","A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate","Crystal Growth & Design","2011","11","1","337","","10.1021/cg101343k","","","0.71073","MoKα","","0.0579","0.0496","","","0.1391","0.1642","","","","","","1.223","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500276","10.6611","0.0009","16.4266","0.0011","12.4018","0.0008","90","","99.793","0.007","90","","2140.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N2 O16 Pr2 S -","- C14 H14 N2 O16 Pr2 S -","- C56 H56 N8 O64 Pr8 S4 -","4","1","","Xu, Jing; Su, Weiping; Hong, Maochun","A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate","Crystal Growth & Design","2011","11","1","337","","10.1021/cg101343k","","","0.71073","MoKα","","0.0743","0.0684","","","0.1671","0.1777","","","","","","1.102","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500277","10.623","0.003","16.369","0.005","12.362","0.004","90","","99.655","0.006","90","","2119.2","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N2 Nd2 O16 S -","- C14 H14 N2 Nd2 O16 S -","- C56 H56 N8 Nd8 O64 S4 -","4","1","","Xu, Jing; Su, Weiping; Hong, Maochun","A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate","Crystal Growth & Design","2011","11","1","337","","10.1021/cg101343k","","","0.71073","MoKα","","0.0389","0.0324","","","0.0812","0.0952","","","","","","1.281","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500278","10.577","0.005","16.299","0.008","12.333","0.006","90","","99.566","0.01","90","","2096.6","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N2 O16 S Sm2 -","- C14 H14 N2 O16 S Sm2 -","- C56 H56 N8 O64 S4 Sm8 -","4","1","","Xu, Jing; Su, Weiping; Hong, Maochun","A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate","Crystal Growth & Design","2011","11","1","337","","10.1021/cg101343k","","","0.71073","MoKα","","0.0517","0.0437","","","0.1146","0.1404","","","","","","1.199","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500279","10.701","0.007","10.737","0.007","27.233","0.017","95.068","0.008","101.078","0.005","103.937","0.009","2950","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H32 Ce5 N7 O35 S2 -","- C44 H32 Ce5 N7 O35 S2 -","- C88 H64 Ce10 N14 O70 S4 -","2","1","","Xu, Jing; Su, Weiping; Hong, Maochun","A Series of Lanthanide Secondary Building Units Based Metal−Organic Frameworks Constructed by Organic Pyridine-2,6-Dicarboxylate and Inorganic Sulfate","Crystal Growth & Design","2011","11","1","337","","10.1021/cg101343k","","","0.71073","MoKα","","0.1047","0.0757","","","0.1974","0.2287","","","","","","1.085","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500280","9.7665","0.0002","19.3844","0.0009","20.3345","0.0009","90","","90","","90","","3849.7","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H23 N O9 U -","- C16 H21 N O9 U -","- C128 H168 N8 O72 U8 -","8","1","","Thuéry, Pierre","Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands","Crystal Growth & Design","2011","11","1","347","","10.1021/cg101344t","","","0.71073","MoKα","","0.0505","0.0416","","","0.0933","0.0961","","","","","","1.135","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500281","7.1987","0.0005","11.4136","0.0004","17.2888","0.0011","90","","101.806","0.003","90","","1390.45","0.14","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 O9 U -","- C10 H10 O9 U -","- C40 H40 O36 U4 -","4","1","","Thuéry, Pierre","Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands","Crystal Growth & Design","2011","11","1","347","","10.1021/cg101344t","","","0.71073","MoKα","","0.0368","0.028","","","0.074","0.0764","","","","","","1.082","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500282","11.106","0.0004","13.2861","0.0005","15.3098","0.0005","77.361","0.002","84.741","0.003","71.863","0.002","2094.11","0.13","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H41 N2 O23.5 U2 -","- C36 H41 N2 O23.5 U2 -","- C72 H82 N4 O47 U4 -","2","1","","Thuéry, Pierre","Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands","Crystal Growth & Design","2011","11","1","347","","10.1021/cg101344t","","","0.71073","MoKα","","0.0321","0.025","","","0.0556","0.0573","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500283","13.2377","0.0011","8.1731","0.0007","18.1071","0.0016","90","","91.195","0.006","90","","1958.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H26 N2 O13 U -","- C14 H26 N2 O13 U -","- C56 H104 N8 O52 U4 -","4","1","","Thuéry, Pierre","Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands","Crystal Growth & Design","2011","11","1","347","","10.1021/cg101344t","","","0.71073","MoKα","","0.0633","0.0539","","","0.1197","0.1239","","","","","","1.137","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500284","18.0451","0.0018","15.0183","0.0008","18.8449","0.0016","90","","90","","90","","5107.1","0.7","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C14 H25 N2 O12.5 U -","- C14 H22 N2 O12.5 U -","- C112 H176 N16 O100 U8 -","8","1","","Thuéry, Pierre","Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands","Crystal Growth & Design","2011","11","1","347","","10.1021/cg101344t","","","0.71073","MoKα","","0.1021","0.0721","","","0.1858","0.1982","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500285","12.002","0.0009","12.6829","0.0005","27.185","0.002","90","","90","","90","","4138.1","0.5","150","2","150","2","","","","","","","","6","I 2 2 2","I 2 2","23","","","","- C14 H21 N2 Na O11 U -","- C14 H19 N2 Na1.00005 O11 U -","- C112 H152 N16 Na8.0004 O88 U8 -","8","1","","Thuéry, Pierre","Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands","Crystal Growth & Design","2011","11","1","347","","10.1021/cg101344t","","","0.71073","MoKα","","0.0414","0.037","","","0.1014","0.1045","","","","","","1.037","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500286","10.719","0.007","17.883","0.005","8.208","0.003","90","","105.072","0.005","90","","1519.2","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 Cd I N4 O3 -","- C13 H11 Cd I N4 O3 -","- C52 H44 Cd4 I4 N16 O12 -","4","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0522","0.0357","","","0.0837","0.0966","","","","","","1.071","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500287","10.395","0.004","16.766","0.005","9.492","0.003","90","","102.088","0.004","90","","1617.6","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 N4 O5 Zn -","- C15 H14 N4 O5 Zn -","- C60 H56 N16 O20 Zn4 -","4","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0508","0.0405","","","0.0981","0.1187","","","","","","1.154","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500288","11.818","0.005","7.566","0.004","16.475","0.004","90","0.006","93.607","0.005","90","0.003","1470.2","1.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 N4 O4 Zn -","- C15 H12 N4 O4 Zn -","- C60 H48 N16 O16 Zn4 -","4","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0677","0.046","","","0.1193","0.1822","","","","","","1.201","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500289","12.392","0.005","13.697","0.006","7.612","0.006","90","","93.127","0.006","90","","1290.1","1.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H9 N5 O5 Zn -","- C13 H9 N5 O5 Zn -","- C52 H36 N20 O20 Zn4 -","4","0.5","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0391","0.0327","","","0.0794","0.0851","","","","","","1.119","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500290","6.673","0.004","14.874","0.003","12.472","0.004","90","","90","","90","","1237.9","0.9","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C13 H11 Cu N4 O3 -","- C13 H11 Cu N4 O3 -","- C52 H44 Cu4 N16 O12 -","4","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0918","0.0636","","","0.1669","0.237","","","","","","1.102","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500291","10.619","0.004","11.171","0.005","13.429","0.004","70.495","0.005","67.445","0.005","88.465","0.003","1377.3","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 N8 Ni O9 -","- C26 H28 N8 Ni O9 -","- C52 H56 N16 Ni2 O18 -","2","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0817","0.0547","","","0.1311","0.1746","","","","","","1.102","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500292","7.171","0.004","9.352","0.003","9.55","0.003","92.794","0.005","92.096","0.005","91.414","0.004","639","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 Co N4 O4 -","- C13 H12 Co N4 O4 -","- C26 H24 Co2 N8 O8 -","2","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.1319","0.1069","","","0.2748","0.3067","","","","","","1.091","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500293","14.423","0.003","13.523","0.003","14.776","0.004","90","","100.451","0.004","90","","2834.1","1.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H19 N9 O8 Pb2 -","- C26 H19 N9 O8 Pb2 -","- C104 H76 N36 O32 Pb8 -","4","1","","Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K.","Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies","Crystal Growth & Design","2011","11","4","1122","","10.1021/cg101351b","","","0.71069","MoKα","","0.0731","0.0441","","","0.1094","0.1546","","","","","","1.111","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500294","24.4141","0.0009","17.7598","0.0004","12.7352","0.0004","90","","116.051","0.004","90","","4960.8","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H50 Cl2 K2 N20 O13.5 -","- C40 H50 Cl2 K2 N20 O13.5 -","- C160 H200 Cl8 K8 N80 O54 -","4","0.5","","Lin, Jingxiang; Lü, Jian; Cao, Minna; Cao, Rong","Effects of Cocrystalline Subunits on the Supramolecular Chemistry of Me10Q[5]: From Simple Inorganic Anions to Cluster Anions","Crystal Growth & Design","2011","11","3","778","","10.1021/cg101355d","","","0.71073","MoKα","","0.0933","0.0661","","","0.202","0.2162","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500295","24.5971","0.0013","17.9071","0.0007","13.102","0.0007","90","","115.756","0.007","90","","5197.6","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C80 H116 Cl4 K4 N40 O43 -","- C80 H116 Cl4 K4 N40 O43 -","- C160 H232 Cl8 K8 N80 O86 -","2","0.25","","Lin, Jingxiang; Lü, Jian; Cao, Minna; Cao, Rong","Effects of Cocrystalline Subunits on the Supramolecular Chemistry of Me10Q[5]: From Simple Inorganic Anions to Cluster Anions","Crystal Growth & Design","2011","11","3","778","","10.1021/cg101355d","","","0.71073","MoKα","","0.1134","0.0581","","","0.138","0.1558","","","","","","0.916","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500296","22.222","0.004","18.009","0.004","12.897","0.003","90","","97.08","0.03","90","","5122","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H50 K2 N22 O13 S2 -","- C42 H50 K2 N22 O11.5 S2 -","- C168 H200 K8 N88 O46 S8 -","4","1","","Lin, Jingxiang; Lü, Jian; Cao, Minna; Cao, Rong","Effects of Cocrystalline Subunits on the Supramolecular Chemistry of Me10Q[5]: From Simple Inorganic Anions to Cluster Anions","Crystal Growth & Design","2011","11","3","778","","10.1021/cg101355d","","","0.71073","MoKα","","0.1747","0.0882","","","0.2217","0.2663","","","","","","1.036","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500297","17.271","0.003","14.611","0.003","28.685","0.006","90","","101.7","0.004","90","","7088","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C40 H62 K2 Mo8 N20 Na2 O42 -","- C40 H50 K2 Mo8 N20 Na2 O42 -","- C160 H200 K8 Mo32 N80 Na8 O168 -","4","0.5","","Lin, Jingxiang; Lü, Jian; Cao, Minna; Cao, Rong","Effects of Cocrystalline Subunits on the Supramolecular Chemistry of Me10Q[5]: From Simple Inorganic Anions to Cluster Anions","Crystal Growth & Design","2011","11","3","778","","10.1021/cg101355d","","","0.71073","MoKα","","0.0835","0.0692","","","0.2","0.2314","","","","","","1.168","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500298","17.323","0.004","14.597","0.003","28.741","0.007","90","","100.931","0.004","90","","7136","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C40 H62 Mo8 N20 Na2 O42 Rb2 -","- C40 H50 Mo8 N20 Na2 O42 Rb2 -","- C160 H200 Mo32 N80 Na8 O168 Rb8 -","4","0.5","","Lin, Jingxiang; Lü, Jian; Cao, Minna; Cao, Rong","Effects of Cocrystalline Subunits on the Supramolecular Chemistry of Me10Q[5]: From Simple Inorganic Anions to Cluster Anions","Crystal Growth & Design","2011","11","3","778","","10.1021/cg101355d","","","0.71073","MoKα","","0.0736","0.0623","","","0.1581","0.1755","","","","","","1.164","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500299","33.015","0.004","12.0251","0.0016","25.366","0.003","90","","93.295","0.002","90","","10054","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H36 Cd3 N8 O13 -","- C54 H34 Cd3 N8 O13 -","- C432 H272 Cd24 N64 O104 -","8","1","","Su, Zhi; Fan, Jian; Chen, Min; Okamura, Taka-aki; Sun, Wei-Yin","Syntheses, Characterization, and Properties of Three-Dimensional Pillared Frameworks with Entanglement","Crystal Growth & Design","2011","11","4","1159","","10.1021/cg101365v","","","0.71073","MoKα","","0.0724","0.0502","","","0.1119","0.1256","","","","","","1.035","","","","has coordinates","179533","2020-10-21","18:00:00",""
"4500300","18.8457","0.0016","13.6944","0.0016","20.315","0.002","90","","90","","90","","5242.9","0.9","200","","200","","","","","","","","","5","P c a 21","P 2c -2ac","29","","[Co3(G1)2(DPA)2(OH2)2]-H2O","","- C54 H40 Co3 N8 O15 -","- C54 H34 Co3 N8 O15 -","- C216 H136 Co12 N32 O60 -","4","1","","Su, Zhi; Fan, Jian; Chen, Min; Okamura, Taka-aki; Sun, Wei-Yin","Syntheses, Characterization, and Properties of Three-Dimensional Pillared Frameworks with Entanglement","Crystal Growth & Design","2011","11","4","1159","","10.1021/cg101365v","","","0.71075","MoKα","","0.0781","0.0736","","","0.1869","0.1928","","","","","","1.062","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500301","6.011","0.0008","17.257","0.002","14.755","0.002","90","","90.591","0.003","90","","1530.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 Cd N4 O4 -","- C17 H14 Cd N4 O4 -","- C68 H56 Cd4 N16 O16 -","4","1","","Su, Zhi; Fan, Jian; Chen, Min; Okamura, Taka-aki; Sun, Wei-Yin","Syntheses, Characterization, and Properties of Three-Dimensional Pillared Frameworks with Entanglement","Crystal Growth & Design","2011","11","4","1159","","10.1021/cg101365v","","","0.71073","MoKα","","0.0427","0.0333","","","0.0699","0.0723","","","","","","1.012","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500302","27.266","0.004","7.5708","0.0011","21.833","0.003","90","","126.51","0.005","90","","3622.4","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H15 Cd N4 O5 -","- C19 H15 Cd N4 O5 -","- C152 H120 Cd8 N32 O40 -","8","1","","Su, Zhi; Fan, Jian; Chen, Min; Okamura, Taka-aki; Sun, Wei-Yin","Syntheses, Characterization, and Properties of Three-Dimensional Pillared Frameworks with Entanglement","Crystal Growth & Design","2011","11","4","1159","","10.1021/cg101365v","","","0.71073","MoKα","","0.0432","0.0394","","","0.0942","0.0964","","","","","","0.936","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500303","10.3889","0.001","16.1517","0.0016","11.3055","0.0011","90","","99.822","0.002","90","","1869.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Cd N4 O5 -","- C18 H11 Cd N4 O5 -","- C72 H44 Cd4 N16 O20 -","4","1","","Su, Zhi; Fan, Jian; Chen, Min; Okamura, Taka-aki; Sun, Wei-Yin","Syntheses, Characterization, and Properties of Three-Dimensional Pillared Frameworks with Entanglement","Crystal Growth & Design","2011","11","4","1159","","10.1021/cg101365v","","","0.71073","MoKα","","0.0388","0.0339","","","0.0842","0.0873","","","","","","1.034","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500304","10.3885","0.0011","16.1515","0.0016","11.3054","0.0011","90","","99.812","0.002","90","","1869.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Cd N4 O5 -","- C18 H9 Cd N4 O5 -","- C72 H36 Cd4 N16 O20 -","4","1","","Su, Zhi; Fan, Jian; Chen, Min; Okamura, Taka-aki; Sun, Wei-Yin","Syntheses, Characterization, and Properties of Three-Dimensional Pillared Frameworks with Entanglement","Crystal Growth & Design","2011","11","4","1159","","10.1021/cg101365v","","","0.71073","MoKα","","0.0634","0.0468","","","0.1114","0.118","","","","","","1.026","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500305","5.3419","0.0005","9.5609","0.0008","23.528","0.003","90","","91.294","0.009","90","","1201.3","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","salicylic acid/benzamide co-crystal","","- C14 H13 N O4 -","- C14 H13 N O4 -","- C56 H52 N4 O16 -","4","1","","Seaton, Colin C.; Parkin, Andrew","Making Benzamide Cocrystals with Benzoic Acids: The Influence of Chemical Structure.","Crystal Growth & Design","2011","11","5","1502","","10.1021/cg101403j","","","0.71073","MoKα","","0.1166","0.0668","","","0.1411","0.1554","","","","","","0.936","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500306","16.2626","0.0011","6.8717","0.0004","11.98","0.0008","90","","107.429","0.007","90","","1277.32","0.15","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-nitrobenzoic acid/benzamide co-crystal","","- C14 H12 N2 O5 -","- C14 H12 N2 O5 -","- C56 H48 N8 O20 -","4","1","","Seaton, Colin C.; Parkin, Andrew","Making Benzamide Cocrystals with Benzoic Acids: The Influence of Chemical Structure.","Crystal Growth & Design","2011","11","5","1502","","10.1021/cg101403j","","","0.71073","MoKα","","0.0684","0.0423","","","0.1015","0.1095","","","","","","0.945","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500307","8.6105","0.0007","5.0229","0.0003","30.253","0.005","90","","98.77","0.01","90","","1293.1","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-hydroxy3-nitrobenzoic acid/benzamide co-crystal","","- C14 H12 N2 O6 -","- C14 H12 N2 O6 -","- C56 H48 N8 O24 -","4","1","","Seaton, Colin C.; Parkin, Andrew","Making Benzamide Cocrystals with Benzoic Acids: The Influence of Chemical Structure.","Crystal Growth & Design","2011","11","5","1502","","10.1021/cg101403j","","","0.71073","MoKα","","0.0601","0.0448","","","0.1033","0.1078","","","","","","1.05","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500308","8.4617","0.0018","10.738","0.002","16.049","0.003","90","","99.334","0.007","90","","1438.9","0.5","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 N3 O7 -","- C14 H11 N3 O7 -","- C56 H44 N12 O28 -","4","1","","Seaton, Colin C.; Parkin, Andrew","Making Benzamide Cocrystals with Benzoic Acids: The Influence of Chemical Structure.","Crystal Growth & Design","2011","11","5","1502","","10.1021/cg101403j","","","0.71073","MoKα","","0.0529","0.0384","","0.098","0.0931","0.098","","","","","","0.9018","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500309","6.5876","0.0005","13.517","0.0008","8.0345","0.0005","90","","90","","90","","715.43","0.08","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Phloroglucinol dihyrate","1, 3, 5-trihydroxybenzene dihydrate","","- C6 H10 O5 -","- C6 H10 O5 -","- C24 H40 O20 -","4","0.5","","Seaton, Colin C.; Parkin, Andrew","Making Benzamide Cocrystals with Benzoic Acids: The Influence of Chemical Structure.","Crystal Growth & Design","2011","11","5","1502","","10.1021/cg101403j","","","0.71073","MoKα","","0.0599","0.0463","","","0.1167","0.1215","","","","","","0.934","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500310","21.561","0.003","14.717","0.002","17.745","0.003","90","","90","","90","","5630.7","1.5","293","2","293","2","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C23 H15 Cu F6 N O4 -","- C23 H15 Cu F6 N O4 -","- C184 H120 Cu8 F48 N8 O32 -","8","","","Pachfule, Pradip; Das, Raja; Poddar, Pankaj; Banerjee, Rahul","Solvothermal Synthesis, Structure, and Properties of Metal Organic Framework Isomers Derived from a Partially Fluorinated Link","Crystal Growth & Design","2011","11","4","1215","","10.1021/cg101414x","","","0.71073","MoKα","","0.0529","0.066","","","0.141","0.1638","","","","","","1.067","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500311","21.626","0.002","14.6622","0.0017","17.777","0.003","90","","90","","90","","5636.8","1.3","298","2","298","2","","","","","","","","6","C m c 21","C 2c -2","36","Zn-F-MOF-4A","","","- C29 H22 F5.92 N2 O4 Zn -","- C29 H22.5 F5.92 N2 O4 Zn -","- C232 H180 F47.36 N16 O32 Zn8 -","8","1","","Pachfule, Pradip; Das, Raja; Poddar, Pankaj; Banerjee, Rahul","Solvothermal Synthesis, Structure, and Properties of Metal Organic Framework Isomers Derived from a Partially Fluorinated Link","Crystal Growth & Design","2011","11","4","1215","","10.1021/cg101414x","","","0.71073","MoKα","","0.0967","0.0596","","","0.1345","0.1542","","","","","","0.949","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500312","26.154","0.005","15.106","0.005","16.753","0.005","90","0.005","118.632","0.005","90","0.005","5809","3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H34 Cd N7 O9 P -","- C21 H34 Cd N7 O9 P -","- C168 H272 Cd8 N56 O72 P8 -","8","1","","Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy","Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]","Crystal Growth & Design","2011","11","5","1512","","10.1021/cg1014169","","","0.71069","MoKα","","0.0434","0.0373","","","0.0956","0.0997","","","","","","1.049","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500313","8.661","0.005","14.334","0.005","15.004","0.005","61.642","0.005","78.645","0.005","78.346","0.005","1594.3","1.2","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H29 Cd Cl3 N9 O10 P -","- C19 H29 Cd Cl3 N9 O10 P -","- C38 H58 Cd2 Cl6 N18 O20 P2 -","2","1","","Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy","Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]","Crystal Growth & Design","2011","11","5","1512","","10.1021/cg1014169","","","0.71069","MoKα","","0.0839","0.0668","","","0.182","0.2014","","","","","","1.019","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500314","9.413","0.005","14.99","0.005","15.112","0.005","116.842","0.005","97.929","0.005","94.084","0.005","1862.8","1.3","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H31 Cd Cl3 N11 O8 P -","- C27 H31 Cd Cl3 N11 O8 P -","- C54 H62 Cd2 Cl6 N22 O16 P2 -","2","1","","Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy","Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]","Crystal Growth & Design","2011","11","5","1512","","10.1021/cg1014169","","","0.71069","MoKα","","0.0937","0.0772","","","0.2091","0.2309","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500315","9.507","0.003","11.992","0.004","12.418","0.004","66.833","0.005","68.149","0.005","88.919","0.006","1194.5","0.7","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H24 Cl2 N7 O3 P Zn -","- C17 H24 Cl2 N7 O3 P Zn -","- C34 H48 Cl4 N14 O6 P2 Zn2 -","2","1","","Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy","Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]","Crystal Growth & Design","2011","11","5","1512","","10.1021/cg1014169","","","0.71073","MoKα","","0.0621","0.0501","","","0.1344","0.1446","","","","","","1.053","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500316","17.251","0.005","20.112","0.005","11.419","0.005","90","0.005","97.786","0.005","90","0.005","3925","2","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H40 Cl2 Mn N14 O4 P2 -","- C32 H40 Cl2 Mn N14 O4 P2 -","- C128 H160 Cl8 Mn4 N56 O16 P8 -","4","1","","Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy","Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]","Crystal Growth & Design","2011","11","5","1512","","10.1021/cg1014169","","","0.71069","MoKα","","0.0853","0.0533","","","0.1194","0.1365","","","","","","0.986","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500317","17.462","0.007","20.228","0.009","11.371","0.005","90","","96.936","0.008","90","","3987","3","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H40 Cl2 Co N14 O4 P2 -","- C32 H40 Cl2 Co N14 O4 P2 -","- C128 H160 Cl8 Co4 N56 O16 P8 -","4","1","","Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy","Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]","Crystal Growth & Design","2011","11","5","1512","","10.1021/cg1014169","","","0.71073","MoKα","","0.1391","0.0549","","","0.1132","0.1449","","","","","","0.907","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500318","8.136","0.002","11.986","0.002","21.178","0.004","90","","98.029","0.002","90","","2045","0.7","150","","150","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H32 O2 -","- C26 H32 O2 -","- C104 H128 O8 -","4","0.5","","Tominaga, Masahide; Masu, Hyuma; Azumaya, Isao","Hydrogen-Bonding Networks of Adamantane-Based Bisphenol Molecules: Toward the Preparation of Molecular Crystals with Channels","Crystal Growth & Design","2011","11","2","542","","10.1021/cg101427k","","","0.71073","MoKα","","0.0504","0.0406","","","0.1049","0.112","","","","","","1.06","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500319","6.909","0.001","10.591","0.002","14.238","0.004","108.02","0.003","97.455","0.003","102.059","0.002","947.5","0.3","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H22 Br2 O2 -","- C22 H22 Br2 O2 -","- C44 H44 Br4 O4 -","2","1","","Tominaga, Masahide; Masu, Hyuma; Azumaya, Isao","Hydrogen-Bonding Networks of Adamantane-Based Bisphenol Molecules: Toward the Preparation of Molecular Crystals with Channels","Crystal Growth & Design","2011","11","2","542","","10.1021/cg101427k","","","0.71073","MoKα","","0.0429","0.0351","","","0.0959","0.0996","","","","","","1.074","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500320","26.384","0.002","6.4107","0.0005","27.2","0.003","90","","117.2","0.001","90","","4091.9","0.6","120","","120","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22.5 H22.5 Cl3.5 O2 -","- C22.5 H22.5 Cl3.5 O2 -","- C180 H180 Cl28 O16 -","8","1","","Tominaga, Masahide; Masu, Hyuma; Azumaya, Isao","Hydrogen-Bonding Networks of Adamantane-Based Bisphenol Molecules: Toward the Preparation of Molecular Crystals with Channels","Crystal Growth & Design","2011","11","2","542","","10.1021/cg101427k","","","0.71073","MoKα","","0.0554","0.0405","","","0.0985","0.1087","","","","","","0.946","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500321","6.354","0.001","12.695","0.002","13.196","0.003","117.671","0.002","90.941","0.002","99.691","0.002","923.8","0.3","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C22.5 H24.5 Cl1.5 O2 -","- C22.5 H24.5 Cl1.5 O2 -","- C45 H49 Cl3 O4 -","2","1","","Tominaga, Masahide; Masu, Hyuma; Azumaya, Isao","Hydrogen-Bonding Networks of Adamantane-Based Bisphenol Molecules: Toward the Preparation of Molecular Crystals with Channels","Crystal Growth & Design","2011","11","2","542","","10.1021/cg101427k","","","0.71073","MoKα","","0.0521","0.0461","","","0.1219","0.1249","","","","","","1.824","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500322","9.5174","0.0003","12.5384","0.0003","16.3714","0.0004","80.008","0.001","81.419","0.001","69.005","0.001","1788.22","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H36 La N2 O12 -","- C36 H36 La N2 O12 -","- C72 H72 La2 N4 O24 -","2","1","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.0227","0.0206","","","0.0534","0.0549","","","","","","1.084","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500323","12.8612","0.0012","10.2716","0.0009","28.254","0.002","90","","112.5","0.004","90","","3448.4","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 Ce N3 O11 -","- C34 H34 Ce N3 O11 -","- C136 H136 Ce4 N12 O44 -","4","1","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.0433","0.0329","","","0.0916","0.0963","","","","","","1.076","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500324","12.9343","0.0007","8.2555","0.0004","24.1694","0.0013","90","","102.518","0.001","90","","2519.4","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H21 N O8 Tb -","- C26 H21 N O8 Tb -","- C104 H84 N4 O32 Tb4 -","4","1","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.0435","0.0366","","","0.0864","0.09","","","","","","0.964","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500325","10.139","","17.804","","20.01","","90","","90","","90","","3612.1","","296","2","296","2","","","","","","","","5","P n a a","-P 2ac 2bc","56","","","","- C38 H33 La N2 O12 -","- C38 H33 La N2 O12 -","- C152 H132 La4 N8 O48 -","4","0.5","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.1502","0.0802","","","0.1766","0.2109","","","","","","1.004","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500326","17.7412","0.0008","19.8116","0.0007","10.0546","0.0003","90","","90","","90","","3534","0.2","296","2","296","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C38 H33 Eu N2 O12 -","- C38 H33 Eu N2 O12 -","- C152 H132 Eu4 N8 O48 -","4","0.5","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.0493","0.0266","","","0.0513","0.0579","","","","","","1.024","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500327","10.04","","17.788","","19.786","","90","","90","","90","","3533.61","","296","2","296","2","","","","","","","","5","P n a a","-P 2ac 2bc","56","","","","- C38 H33 Gd N2 O12 -","- C38 H33 Gd N2 O12 -","- C152 H132 Gd4 N8 O48 -","4","0.5","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.0749","0.0399","","","0.091","0.1093","","","","","","1.051","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500328","17.7423","0.0005","19.7457","0.0005","10.0389","0.0003","90","","90","","90","","3516.97","0.17","296","2","296","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C38 H33 N2 O12 Tb -","- C38 H33 N2 O12 Tb -","- C152 H132 N8 O48 Tb4 -","4","0.5","","Sarma, Rupam; Deka, Himangshu; Boudalis, Athanassios K.; Baruah, Jubaraj B.","Coordination Polymers of Lanthanide(III): Toward Encapsulation of Well-Defined Assembly of Guest Molecules","Crystal Growth & Design","2011","11","2","547","","10.1021/cg101432k","","","0.71073","MoKα","","0.029","0.0194","","","0.0439","0.0458","","","","","","0.945","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500329","21.989","0.008","13.251","0.005","11.174","0.004","90","","97.15","0.005","90","","3231","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 N2 O5 S2 Zn -","- C12 H6 N2 O5 S2 Zn -","- C96 H48 N16 O40 S16 Zn8 -","8","1","","Zhang, Ya-Nan; Liu, Ping; Wang, Yao-Yu; Wu, Ling-Yue; Pang, Ling-Yan; Shi, Qi-Zhen","Syntheses and Crystal Structures of a Series of Zn(II)/Cd(II) Coordination Polymers Constructed from a Flexible 6,6′-Dithiodinicotinic Acid","Crystal Growth & Design","2011","11","5","1531","","10.1021/cg101433t","","","0.71073","MoKα","","0.0832","0.0727","","","0.2088","0.2153","","","","","","1.153","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500330","8.33","0.004","10.652","0.006","12.045","0.006","69.424","0.006","76.87","0.007","79.897","0.007","969.1","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 N3 O4 S2 Zn -","- C18 H12 N3 O4 S2 Zn -","- C36 H24 N6 O8 S4 Zn2 -","2","1","","Zhang, Ya-Nan; Liu, Ping; Wang, Yao-Yu; Wu, Ling-Yue; Pang, Ling-Yan; Shi, Qi-Zhen","Syntheses and Crystal Structures of a Series of Zn(II)/Cd(II) Coordination Polymers Constructed from a Flexible 6,6′-Dithiodinicotinic Acid","Crystal Growth & Design","2011","11","5","1531","","10.1021/cg101433t","","","0.71073","MoKα","","0.1434","0.1293","","","0.4124","0.4234","","","","","","1.742","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500331","7.9715","0.0018","11.701","0.003","15.038","0.003","72.375","0.003","82.931","0.003","75.442","0.003","1292.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H20 N4 O4 S2 Zn -","- C25 H20 N4 O4 S2 Zn -","- C50 H40 N8 O8 S4 Zn2 -","2","1","","Zhang, Ya-Nan; Liu, Ping; Wang, Yao-Yu; Wu, Ling-Yue; Pang, Ling-Yan; Shi, Qi-Zhen","Syntheses and Crystal Structures of a Series of Zn(II)/Cd(II) Coordination Polymers Constructed from a Flexible 6,6′-Dithiodinicotinic Acid","Crystal Growth & Design","2011","11","5","1531","","10.1021/cg101433t","","","0.71073","MoKα","","0.1032","0.0563","","","0.1391","0.1761","","","","","","0.941","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500332","21.328","0.006","13.794","0.006","22.592","0.008","90","","114.387","0.008","90","","6054","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H26 Cd N5 O5 S2 -","- C30 H26 Cd N5 O5 S2 -","- C240 H208 Cd8 N40 O40 S16 -","8","1","","Zhang, Ya-Nan; Liu, Ping; Wang, Yao-Yu; Wu, Ling-Yue; Pang, Ling-Yan; Shi, Qi-Zhen","Syntheses and Crystal Structures of a Series of Zn(II)/Cd(II) Coordination Polymers Constructed from a Flexible 6,6′-Dithiodinicotinic Acid","Crystal Growth & Design","2011","11","5","1531","","10.1021/cg101433t","","","0.71073","MoKα","","0.1127","0.076","","","0.2241","0.2619","","","","","","1.071","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500333","16.2439","0.0011","12.9649","0.0009","22.5736","0.0015","90","","106.404","0.001","90","","4560.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H40 Cd2 N6 O15 S4 -","- C37 H40 Cd2 N6 O15 S4 -","- C148 H160 Cd8 N24 O60 S16 -","4","1","","Zhang, Ya-Nan; Liu, Ping; Wang, Yao-Yu; Wu, Ling-Yue; Pang, Ling-Yan; Shi, Qi-Zhen","Syntheses and Crystal Structures of a Series of Zn(II)/Cd(II) Coordination Polymers Constructed from a Flexible 6,6′-Dithiodinicotinic Acid","Crystal Growth & Design","2011","11","5","1531","","10.1021/cg101433t","","","0.71073","MoKα","","0.0433","0.032","","","0.0749","0.0813","","","","","","1.027","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500334","11.1121","0.0013","10.9483","0.0012","3.8187","0.0005","90","","90","","90","","464.58","0.1","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C3 H4 Ag N3 -","- C3 H4 Ag N3 -","- C12 H16 Ag4 N12 -","4","1","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.0253","0.0235","","","0.0623","0.0636","","","","","","1.079","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500335","7.1495","0.0004","8.1326","0.0004","9.5939","0.0005","90","","90","","90","","557.83","0.05","143","2","143","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C4 H6 Ag N3 -","- C4 H6 Ag N3 -","- C16 H24 Ag4 N12 -","4","1","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.0119","0.0119","","","0.0302","0.0302","","","","","","1.037","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500336","13.1876","0.001","21.3132","0.0015","11.7034","0.0008","90","","122.828","0.001","90","","2764.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H26 Ag4 N12 O -","- C16 H26 Ag4 N12 O -","- C64 H104 Ag16 N48 O4 -","4","0.5","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.0347","0.0284","","","0.0686","0.0726","","","","","","1.042","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500337","13.0358","0.0014","21.135","0.002","11.7194","0.0013","90","","122.184","0.001","90","","2732.7","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H24 Ag4 N12 -","- C16 H24 Ag4 N12 -","- C64 H96 Ag16 N48 -","4","0.5","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.085","0.052","","","0.1144","0.1313","","","","","","1.048","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500338","12.9651","0.0008","21.4537","0.0014","11.7302","0.0007","90","","122.632","0.001","90","","2747.7","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H26 Ag4 Cl2 N12 -","- C17 H26 Ag4 Cl2 N12 -","- C68 H104 Ag16 Cl8 N48 -","4","0.5","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.0315","0.0266","","","0.0663","0.0701","","","","","","1.008","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500339","11.9318","0.0006","21.3866","0.001","11.6563","0.0006","90","","113.844","0.001","90","","2720.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 Ag4 N13 -","- C18 H27 Ag4 N13 -","- C72 H108 Ag16 N52 -","4","1","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.0426","0.0284","","","0.0575","0.065","","","","","","1.024","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500340","13.625","0.0015","21.181","0.0016","11.9294","0.0011","90","","124.107","0.004","90","","2850.5","0.5","103","2","103","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H16 Ag2 N6 -","- C10 H16 Ag2 N6 -","- C80 H128 Ag16 N48 -","8","1","","Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming","Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies","Crystal Growth & Design","2011","11","3","796","","10.1021/cg101435b","","","0.71073","MoKα","","0.0434","0.0369","","","0.0829","0.0872","","","","","","1.046","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500341","19.381","0.003","11.5405","0.0015","21.545","0.003","90","","93.601","0.002","90","","4809.4","1.2","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(2-methoxy-5-phenyl-3-thienyl)perfluorocyclopentene (1a)","","- C27 H18 F6 O2 S2 -","- C27 H18 F6 O2 S2 -","- C216 H144 F48 O16 S16 -","8","2","","Kobatake, Seiya; Hasegawa, Hiroki; Miyamura, Kentaro","High-Convertible Photochromism of a Diarylethene Single Crystal Accompanying the Crystal Shape Deformation","Crystal Growth & Design","2011","11","4","1223","","10.1021/cg101448m","","","0.71073","MoKα","","0.0519","0.0335","","","0.082","0.0887","","","","","","1.007","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500342","16.2352","0.0016","10.4609","0.001","15.2238","0.0015","90","","112.103","0.002","90","","2395.5","0.4","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-dimethoxy-8,8,9,9,10,10-hexafluoro-4,14-diphenyl-3,15-dithiatetracyclo-[10.3.0.0^2,6^.0^7,11^] pentadeca-4,6(7),11(12),13-tetraene (1b)","","- C27 H18 F6 O2 S2 -","- C27 H18 F6 O2 S2 -","- C108 H72 F24 O8 S8 -","4","1","","Kobatake, Seiya; Hasegawa, Hiroki; Miyamura, Kentaro","High-Convertible Photochromism of a Diarylethene Single Crystal Accompanying the Crystal Shape Deformation","Crystal Growth & Design","2011","11","4","1223","","10.1021/cg101448m","","","0.71073","MoKα","","0.0427","0.0325","","","0.0827","0.0886","","","","","","1.028","","","","has coordinates,has disorder","211399","2020-10-21","18:00:00",""
"4500343","9.272","0.002","10.852","0.003","11.186","0.003","87.315","0.006","72.896","0.006","69.683","0.006","1006.9","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H17 N5 O6 Zn -","- C19 H17 N5 O6 Zn -","- C38 H34 N10 O12 Zn2 -","2","1","","Lee, Jhen-Yi; Chen, Chih-Yuan; Lee, Hon Man; Passaglia, Elisa; Vizza, Francesco; Oberhauser, Werner","Zinc Coordination Polymers with 2,6-Bis(imidazole-1-yl)pyridine and Benzenecarboxylate:Pseudo-Supramolecular Isomers with and without Interpenetration and Unprecedented Trinodal Topology","Crystal Growth & Design","2011","11","4","1230","","10.1021/cg101453m","","x-ray","0.71073","MoKα","","0.1264","0.0687","","","0.1669","0.1977","","","","","","1.024","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500344","6.5769","0.0011","10.8765","0.0018","15.686","0.003","98.094","0.005","101.276","0.003","96.389","0.004","1078.3","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 N6 O5 Zn -","- C22 H20 N6 O5 Zn -","- C44 H40 N12 O10 Zn2 -","2","1","","Lee, Jhen-Yi; Chen, Chih-Yuan; Lee, Hon Man; Passaglia, Elisa; Vizza, Francesco; Oberhauser, Werner","Zinc Coordination Polymers with 2,6-Bis(imidazole-1-yl)pyridine and Benzenecarboxylate:Pseudo-Supramolecular Isomers with and without Interpenetration and Unprecedented Trinodal Topology","Crystal Growth & Design","2011","11","4","1230","","10.1021/cg101453m","","x-ray","0.71073","MoKα","","0.0806","0.051","","","0.1187","0.1316","","","","","","1.022","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500345","11.526","0.002","14.485","0.003","13.108","0.003","90","","95.727","0.004","90","","2177.5","0.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H13 N5 O8 Zn2 -","- C20 H13 N5 O8 Zn2 -","- C80 H52 N20 O32 Zn8 -","4","1","","Lee, Jhen-Yi; Chen, Chih-Yuan; Lee, Hon Man; Passaglia, Elisa; Vizza, Francesco; Oberhauser, Werner","Zinc Coordination Polymers with 2,6-Bis(imidazole-1-yl)pyridine and Benzenecarboxylate:Pseudo-Supramolecular Isomers with and without Interpenetration and Unprecedented Trinodal Topology","Crystal Growth & Design","2011","11","4","1230","","10.1021/cg101453m","","x-ray","0.71073","MoKα","","0.1233","0.0678","","","0.1686","0.2047","","","","","","1.024","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500346","11.579","0.002","12.429","0.003","16.887","0.004","98.589","0.004","92.109","0.004","111.937","0.003","2217.7","0.8","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H144 Na4 O32 Ta4 -","- C60 H132 Na4 O32 Ta4 -","- C60 H132 Na4 O32 Ta4 -","1","0.5","","Nunes, Giovana G.; Seisenbaeva, Gulaim A.; Kessler, Vadim G.","Crystal Engineering of Nanomorphology for Complex Oxide Materials via Thermal Decomposition of Metal−Organic Frameworks. Case Study of Sodium Tantalate","Crystal Growth & Design","2011","11","4","1238","","10.1021/cg101456w","","","0.71073","MoKα","","0.055","0.0537","","","0.1626","0.1656","","","","","","1.169","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500347","17.394","0.012","10.049","0.007","8.404","0.006","90","","90.18","0.008","90","","1468.9","1.8","296","2","296","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C30 H60 Na O12 Ta -","- C30 Na O12 Ta -","- C60 Na2 O24 Ta2 -","2","0.25","","Nunes, Giovana G.; Seisenbaeva, Gulaim A.; Kessler, Vadim G.","Crystal Engineering of Nanomorphology for Complex Oxide Materials via Thermal Decomposition of Metal−Organic Frameworks. Case Study of Sodium Tantalate","Crystal Growth & Design","2011","11","4","1238","","10.1021/cg101456w","","","0.71073","MoKα","","0.0312","0.0306","","","0.0767","0.0774","","","","","","1.372","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500348","9.3917","0.0011","14.1197","0.0016","15.313","0.0017","90","","90","","90","","2030.6","0.4","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C20 H22 Co N4 O4 -","- C20 H22 Co N4 O4 -","- C80 H88 Co4 N16 O16 -","4","1","","Liu, Jian-Qiang; Huang, Yun-Sheng; Zhao, Ying-Yong; Jia, Zhen-Bin","Molecular Tectonics of Entangled Metal−Organic Frameworks Based on Different Conformational Carboxylates Mixed with a Flexible N,N′-Type Ligand","Crystal Growth & Design","2011","11","2","569","","10.1021/cg101461w","","","0.71073","MoKα","","0.0442","0.0375","","","0.099","0.106","","","","","","0.86","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500349","17.721","0.003","52.356","0.008","8.5857","0.0012","90","","90","","90","","7966","2","298","2","298","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C34 H54 Co2 N8 O11 -","- C34 H52 Co2 N8 O11 -","- C272 H416 Co16 N64 O88 -","8","0.5","","Liu, Jian-Qiang; Huang, Yun-Sheng; Zhao, Ying-Yong; Jia, Zhen-Bin","Molecular Tectonics of Entangled Metal−Organic Frameworks Based on Different Conformational Carboxylates Mixed with a Flexible N,N′-Type Ligand","Crystal Growth & Design","2011","11","2","569","","10.1021/cg101461w","","","0.71073","MoKα","","0.026","0.024","","","0.0595","0.0607","","","","","","1.054","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500350","8.4306","0.0004","10.866","0.0005","10.9357","0.0005","100.654","0.001","103.878","0.001","111.91","0.001","859.41","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H19 Co N2 O5 -","- C16 H19 Co N2 O5 -","- C32 H38 Co2 N4 O10 -","2","1","","Liu, Jian-Qiang; Huang, Yun-Sheng; Zhao, Ying-Yong; Jia, Zhen-Bin","Molecular Tectonics of Entangled Metal−Organic Frameworks Based on Different Conformational Carboxylates Mixed with a Flexible N,N′-Type Ligand","Crystal Growth & Design","2011","11","2","569","","10.1021/cg101461w","","","0.71073","MoKα","","0.029","0.0264","","","0.0793","0.0803","","","","","","1.091","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500351","14.799","0.0003","15.7385","0.0003","19.0145","0.0005","90","","90","","90","","4428.74","0.17","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H17 Dy2 N3 O16 -","- C18 H17 Dy2 N3 O16 -","- C144 H136 Dy16 N24 O128 -","8","1","","Fang, Shao-Ming; Sañudo, E. Carolina; Hu, Min; Zhang, Qiang; Ma, Song-Tao; Jia, Li-Ran; Wang, Cong; Tang, Jia-You; Du, Miao; Liu, Chun-Sen","Hydrothermal Syntheses, Crystal Structures, and Magnetic Properties of a Series of Unique Three-Dimensional Lanthanide−Organic Coordination Frameworks with aN-Protonated 2,6-Dihydroxypyridine-4-Carboxylate Tecton","Crystal Growth & Design","2011","11","3","811","","10.1021/cg1014626","","","0.71073","MoKα","","0.0572","0.0277","","","0.0418","0.0439","","","","","","0.938","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500352","14.8594","0.0002","15.8477","0.0002","19.0553","0.0003","90","","90","","90","","4487.28","0.11","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H17 Gd2 N3 O16 -","- C18 H17 Gd2 N3 O16 -","- C144 H136 Gd16 N24 O128 -","8","1","","Fang, Shao-Ming; Sañudo, E. Carolina; Hu, Min; Zhang, Qiang; Ma, Song-Tao; Jia, Li-Ran; Wang, Cong; Tang, Jia-You; Du, Miao; Liu, Chun-Sen","Hydrothermal Syntheses, Crystal Structures, and Magnetic Properties of a Series of Unique Three-Dimensional Lanthanide−Organic Coordination Frameworks with aN-Protonated 2,6-Dihydroxypyridine-4-Carboxylate Tecton","Crystal Growth & Design","2011","11","3","811","","10.1021/cg1014626","","","0.71073","MoKα","","0.0292","0.0198","","","0.0444","0.0457","","","","","","0.95","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500353","14.8267","0.0007","15.7817","0.0003","19.0579","0.0007","90","","90","","90","","4459.4","0.3","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H17 N3 O16 Tb2 -","- C18 H17 N3 O16 Tb2 -","- C144 H136 N24 O128 Tb16 -","8","1","","Fang, Shao-Ming; Sañudo, E. Carolina; Hu, Min; Zhang, Qiang; Ma, Song-Tao; Jia, Li-Ran; Wang, Cong; Tang, Jia-You; Du, Miao; Liu, Chun-Sen","Hydrothermal Syntheses, Crystal Structures, and Magnetic Properties of a Series of Unique Three-Dimensional Lanthanide−Organic Coordination Frameworks with aN-Protonated 2,6-Dihydroxypyridine-4-Carboxylate Tecton","Crystal Growth & Design","2011","11","3","811","","10.1021/cg1014626","","","0.71073","MoKα","","0.0328","0.0222","","","0.0477","0.0492","","","","","","0.921","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500354","14.8656","0.0016","15.9425","0.0018","19.175","0.002","90","","90","","90","","4544.4","0.9","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H17 Eu2 N3 O16 -","- C18 H17 Eu2 N3 O16 -","- C144 H136 Eu16 N24 O128 -","8","1","","Fang, Shao-Ming; Sañudo, E. Carolina; Hu, Min; Zhang, Qiang; Ma, Song-Tao; Jia, Li-Ran; Wang, Cong; Tang, Jia-You; Du, Miao; Liu, Chun-Sen","Hydrothermal Syntheses, Crystal Structures, and Magnetic Properties of a Series of Unique Three-Dimensional Lanthanide−Organic Coordination Frameworks with aN-Protonated 2,6-Dihydroxypyridine-4-Carboxylate Tecton","Crystal Growth & Design","2011","11","3","811","","10.1021/cg1014626","","","0.71073","MoKα","","0.0817","0.0404","","","0.0682","0.074","","","","","","0.969","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500355","14.7597","0.0005","15.7023","0.0006","18.9885","0.0009","90","","90","","90","","4400.8","0.3","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H17 Ho2 N3 O16 -","- C18 H17 Ho2 N3 O16 -","- C144 H136 Ho16 N24 O128 -","8","1","","Fang, Shao-Ming; Sañudo, E. Carolina; Hu, Min; Zhang, Qiang; Ma, Song-Tao; Jia, Li-Ran; Wang, Cong; Tang, Jia-You; Du, Miao; Liu, Chun-Sen","Hydrothermal Syntheses, Crystal Structures, and Magnetic Properties of a Series of Unique Three-Dimensional Lanthanide−Organic Coordination Frameworks with aN-Protonated 2,6-Dihydroxypyridine-4-Carboxylate Tecton","Crystal Growth & Design","2011","11","3","811","","10.1021/cg1014626","","","0.71073","MoKα","","0.0301","0.0192","","","0.034","0.0346","","","","","","1.004","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500356","13.358","0.004","22.436","0.007","33.343","0.01","90","","90.006","0.006","90","","9993","5","293","2","120","2","","","","","","","","4","P 1 n 1","P -2yac","7","trimethyltin hydroxide","","","- C24 H72 O8 Sn8 -","- C24 H72 O8 Sn8 -","- C192 H576 O64 Sn64 -","8","4","","Anderson, Kirsty M.; Tallentire, Sarah E.; Probert, Michael R.; Goeta, Andrés E.; Mendis, Budhika G.; Steed, Jonathan W.","Trimethyltin Hydroxide: A Crystallographic and HighZ′ Curiosity","Crystal Growth & Design","2011","11","3","820","","10.1021/cg101464j","","","0.71073","MoKα","","0.3136","0.0681","","","0.2221","0.3569","","","","","","0.91","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500357","10.793","0.002","6.6883","0.0013","8.3828","0.0017","90","","90.13","0.003","90","","605.1","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Me3snoh","","","- C3 H10 O Sn -","- C3 H10 O Sn -","- C12 H40 O4 Sn4 -","4","1","","Anderson, Kirsty M.; Tallentire, Sarah E.; Probert, Michael R.; Goeta, Andrés E.; Mendis, Budhika G.; Steed, Jonathan W.","Trimethyltin Hydroxide: A Crystallographic and HighZ′ Curiosity","Crystal Growth & Design","2011","11","3","820","","10.1021/cg101464j","","","0.71073","MoKα","","0.0791","0.0387","","","0.0718","0.0819","","","","","","1.174","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500358","6.0867","0.0019","10.568","0.003","12.745","0.004","105.127","0.005","101.795","0.005","98.292","0.006","757.6","0.4","115","2","115","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C38 H38 N2 O4 -","2","1","","Nishiguchi, Noriaki; Sato, Tomohiro; Kinuta, Takafumi; Kuroda, Reiko; Matsubara, Yoshio; Imai, Yoshitane","Crystal Structures and Solid-State Optical Properties of Supramolecular Organic Fluorophore Composed of 1D Columnar Network Structure Consisting of Fluorescent 2-Naphthalenecarboxylic Acid","Crystal Growth & Design","2011","11","3","827","","10.1021/cg101480x","","","0.71073","MoKα","","0.0861","0.0708","","","0.1877","0.2039","","","","","","1.034","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500359","5.693","0.0005","9.1762","0.0008","30.95","0.003","90","","94.519","0.002","90","","1611.8","0.3","115","2","115","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 N O2 -","- C20 H21 N O2 -","- C80 H84 N4 O8 -","4","1","","Nishiguchi, Noriaki; Sato, Tomohiro; Kinuta, Takafumi; Kuroda, Reiko; Matsubara, Yoshio; Imai, Yoshitane","Crystal Structures and Solid-State Optical Properties of Supramolecular Organic Fluorophore Composed of 1D Columnar Network Structure Consisting of Fluorescent 2-Naphthalenecarboxylic Acid","Crystal Growth & Design","2011","11","3","827","","10.1021/cg101480x","","","0.71073","MoKα","","0.0685","0.0584","","","0.1313","0.1367","","","","","","1.098","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500360","7.2024","0.0005","6.0955","0.0004","37.705","0.003","90","","90.524","0.001","90","","1655.3","0.2","115","2","115","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N O3 -","- C20 H21 N O3 -","- C80 H84 N4 O12 -","4","1","","Nishiguchi, Noriaki; Sato, Tomohiro; Kinuta, Takafumi; Kuroda, Reiko; Matsubara, Yoshio; Imai, Yoshitane","Crystal Structures and Solid-State Optical Properties of Supramolecular Organic Fluorophore Composed of 1D Columnar Network Structure Consisting of Fluorescent 2-Naphthalenecarboxylic Acid","Crystal Growth & Design","2011","11","3","827","","10.1021/cg101480x","","","0.71073","MoKα","","0.053","0.0457","","","0.1147","0.1192","","","","","","1.013","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500361","10.0243","0.001","16.3867","0.0018","9.0352","0.001","90","","90","","90","","1484.2","0.3","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H2 Br4 N2 S4 Tl -","- C6 H2 Br4 N2 S4 Tl -","- C24 H8 Br16 N8 S16 Tl4 -","4","0.5","","Fujita, Wataru; Takahashi, Kazuyuki; Kobayashi, Hayao","Structural and Magnetic Studies on Two-Dimensional Square Planar Lattice Magnets Composed of Organic Radical Cation Salts (Benzo[1,2-d:4,5-d′]Bis[1,3,2]dithiazolyl-2-zolium)·X (X = TlBr4, TlI4, and InI4)","Crystal Growth & Design","2011","11","2","575","","10.1021/cg101481c","","","0.7107","MoKα","","0.0432","0.0402","","","0.075","0.0759","","","","","","1.269","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500362","12.243","0.002","18.452","0.003","7.4456","0.0017","90","","90","","90","","1682","0.5","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H2 I4 N2 S4 Tl -","- C6 H2 I4 N2 S4 Tl -","- C24 H8 I16 N8 S16 Tl4 -","4","0.5","","Fujita, Wataru; Takahashi, Kazuyuki; Kobayashi, Hayao","Structural and Magnetic Studies on Two-Dimensional Square Planar Lattice Magnets Composed of Organic Radical Cation Salts (Benzo[1,2-d:4,5-d′]Bis[1,3,2]dithiazolyl-2-zolium)·X (X = TlBr4, TlI4, and InI4)","Crystal Growth & Design","2011","11","2","575","","10.1021/cg101481c","","","0.7107","MoKα","","0.0775","0.0664","","","0.1774","0.1847","","","","","","1.141","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500363","12.1161","0.0012","18.8319","0.0018","7.4905","0.0007","90","","90","","90","","1709.1","0.3","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H2 I4 In N2 S4 -","- C6 H2 I4 In N2 S4 -","- C24 H8 I16 In4 N8 S16 -","4","0.5","","Fujita, Wataru; Takahashi, Kazuyuki; Kobayashi, Hayao","Structural and Magnetic Studies on Two-Dimensional Square Planar Lattice Magnets Composed of Organic Radical Cation Salts (Benzo[1,2-d:4,5-d′]Bis[1,3,2]dithiazolyl-2-zolium)·X (X = TlBr4, TlI4, and InI4)","Crystal Growth & Design","2011","11","2","575","","10.1021/cg101481c","","","0.7107","MoKα","","0.0453","0.0389","","","0.0983","0.1006","","","","","","1.228","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500364","24.25","0.007","18.765","0.006","17.72","0.005","90","","107.673","0.004","90","","7683","4","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H52 N12 Nb10 Ni3 O30 -","- C60 H48 N12 Nb10 Ni3 O30 -","- C240 H192 N48 Nb40 Ni12 O120 -","4","0.5","","Niu, Jingyang; Wang, Guan; Zhao, Junwei; Sui, Yunxia; Ma, Pengtao; Wang, Jingping","Zero- or One-Dimensional Organic−Inorganic Hybrid Polyoxoniobates Constructed from Decaniobate Units and Transition-Metal Complexes","Crystal Growth & Design","2011","11","4","1253","","10.1021/cg1014829","","","0.71073","MoKα","","0.0263","0.022","","","0.0595","0.0614","","","","","","1.039","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500365","14.139","0.003","14.16","0.003","24.201","0.005","80.884","0.003","89.686","0.003","89.727","0.003","4783.9","1.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H73 N14 Nb10 Ni3 O36.5 -","- C70 H56 N14 Nb10 Ni3 O36.5 -","- C140 H112 N28 Nb20 Ni6 O73 -","2","1","","Niu, Jingyang; Wang, Guan; Zhao, Junwei; Sui, Yunxia; Ma, Pengtao; Wang, Jingping","Zero- or One-Dimensional Organic−Inorganic Hybrid Polyoxoniobates Constructed from Decaniobate Units and Transition-Metal Complexes","Crystal Growth & Design","2011","11","4","1253","","10.1021/cg1014829","","","0.71073","MoKα","","0.0553","0.0384","","","0.1031","0.1102","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500366","27.578","0.01","17.319","0.006","24.646","0.009","90","","121.555","0.006","90","","10031","6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H72 N14 Nb10 Ni3 O36 -","- C84 H56 N14 Nb10 Ni3 O36 -","- C336 H224 N56 Nb40 Ni12 O144 -","4","0.5","","Niu, Jingyang; Wang, Guan; Zhao, Junwei; Sui, Yunxia; Ma, Pengtao; Wang, Jingping","Zero- or One-Dimensional Organic−Inorganic Hybrid Polyoxoniobates Constructed from Decaniobate Units and Transition-Metal Complexes","Crystal Growth & Design","2011","11","4","1253","","10.1021/cg1014829","","","0.71073","MoKα","","0.1251","0.0577","","","0.1305","0.1653","","","","","","1.002","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500367","27.946","0.004","17.356","0.002","24.704","0.003","90","","121.284","0.002","90","","10240","2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H72 N14 Nb10 O36 Zn3 -","- C84 H56 N14 Nb10 O36 Zn3 -","- C336 H224 N56 Nb40 O144 Zn12 -","4","0.5","","Niu, Jingyang; Wang, Guan; Zhao, Junwei; Sui, Yunxia; Ma, Pengtao; Wang, Jingping","Zero- or One-Dimensional Organic−Inorganic Hybrid Polyoxoniobates Constructed from Decaniobate Units and Transition-Metal Complexes","Crystal Growth & Design","2011","11","4","1253","","10.1021/cg1014829","","","0.71073","MoKα","","0.1235","0.0526","","","0.1158","0.1493","","","","","","1.008","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500368","27.771","0.003","17.263","0.002","24.677","0.005","90","","121.158","0.002","90","","10124","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H72 Co3 N14 Nb10 O36 -","- C84 H56 Co3 N14 Nb10 O36 -","- C336 H224 Co12 N56 Nb40 O144 -","4","0.5","","Niu, Jingyang; Wang, Guan; Zhao, Junwei; Sui, Yunxia; Ma, Pengtao; Wang, Jingping","Zero- or One-Dimensional Organic−Inorganic Hybrid Polyoxoniobates Constructed from Decaniobate Units and Transition-Metal Complexes","Crystal Growth & Design","2011","11","4","1253","","10.1021/cg1014829","","","0.71073","MoKα","","0.0484","0.036","","","0.1042","0.117","","","","","","1.004","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500369","7.2138","0.0012","8.3667","0.0015","8.8361","0.0013","99.826","0.013","113.825","0.01","110.721","0.011","424.55","0.15","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C9 H6 N6 -","- C9 H6 N6 -","- C18 H12 N12 -","2","1","","Schubert, David M.; Natan, Daniel T.; Wilson, Duane C.; Hardcastle, Kenneth I.","Facile Synthesis and Structures of Cyclic Triimidazole and Its Boric Acid Adduct","Crystal Growth & Design","2011","11","3","843","850","10.1021/cg101489t","","","1.54178","CuKα","","0.0753","0.0551","","","0.1697","0.197","","","","","","1.092","","","","has coordinates","211066","2020-10-21","18:00:00",""
"4500370","7.5608","0.0003","7.5669","0.0005","15.8436","0.0008","84.504","0.003","81.269","0.003","87.038","0.003","891.18","0.08","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H7 N6 O0.5 -","- C9 H7 N6 O0.5 -","- C36 H28 N24 O2 -","4","2","","Schubert, David M.; Natan, Daniel T.; Wilson, Duane C.; Hardcastle, Kenneth I.","Facile Synthesis and Structures of Cyclic Triimidazole and Its Boric Acid Adduct","Crystal Growth & Design","2011","11","3","843","850","10.1021/cg101489t","","","1.54178","CuKα","","0.0482","0.0435","","","0.1163","0.1202","","","","","","1.046","","","","has coordinates","211066","2020-10-21","18:00:00",""
"4500371","10.1186","0.0003","10.1186","0.0003","6.3488","0.0004","90","","90","","120","","562.94","0.04","173","2","173","2","","","","","","","","5","P -3","-P 3","147","","","","- C9 H9 B N6 O3 -","- C9 H9 B N6 O3 -","- C18 H18 B2 N12 O6 -","2","0.333333","","Schubert, David M.; Natan, Daniel T.; Wilson, Duane C.; Hardcastle, Kenneth I.","Facile Synthesis and Structures of Cyclic Triimidazole and Its Boric Acid Adduct","Crystal Growth & Design","2011","11","3","843","850","10.1021/cg101489t","","","1.54178","CuKα","","0.0298","0.0284","","","0.0798","0.081","","","","","","1.102","","","","has coordinates","211066","2020-10-21","18:00:00",""
"4500372","13.366","0.003","10.79","0.002","12.769","0.002","90","","93.432","0.004","90","","1838.2","0.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 Ag B F4 N3 O3 -","- C17 H11 Ag B F4 N3 O3 -","- C68 H44 Ag4 B4 F16 N12 O12 -","4","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.0744","0.0537","","","0.156","0.1776","","","","","","1.038","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500373","13.4694","0.0019","10.614","0.0015","12.6433","0.0019","90","","92.801","0.003","90","","1805.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 Ag N4 O6 -","- C17 H11 Ag N4 O6 -","- C68 H44 Ag4 N16 O24 -","4","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.096","0.0469","","","0.1208","0.1528","","","","","","1.005","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500374","6.8745","0.0015","10.444","0.002","25.018","0.005","90","","91.677","0.004","90","","1795.5","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H24 Ag3 N9 O11 -","- C34 H24 Ag3 N9 O11 -","- C68 H48 Ag6 N18 O22 -","2","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.0658","0.0434","","","0.0854","0.0964","","","","","","1.085","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500375","6.8378","0.0018","10.435","0.003","13.23","0.004","96.019","0.005","104.732","0.006","94.695","0.006","902.1","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H22 Ag2 F12 N6 O4 P2 -","- C34 H22 Ag2 F12 N6 O4 P2 -","- C34 H22 Ag2 F12 N6 O4 P2 -","1","0.5","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.091","0.0691","","","0.1761","0.1923","","","","","","1.044","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500376","8.2974","0.0013","8.4741","0.0012","13.966","0.002","100.676","0.003","94.563","0.003","104.608","0.003","925.5","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H11 Ag F3 N3 O4 -","- C19 H11 Ag F3 N3 O4 -","- C38 H22 Ag2 F6 N6 O8 -","2","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.0531","0.045","","","0.1195","0.1283","","","","","","1.036","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500377","30.277","0.005","7.0619","0.0013","20.801","0.004","90","","117.585","0.003","90","","3942","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H22 Ag2 F6 N6 O10 S2 -","- C36 H22 Ag2 F6 N6 O10 S2 -","- C144 H88 Ag8 F24 N24 O40 S8 -","4","0.5","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.0478","0.0386","","","0.1011","0.1108","","","","","","1.031","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500378","9.399","0.004","9.791","0.005","12.087","0.006","93.867","0.009","102.894","0.008","108.332","0.009","1017.8","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H11 Ag F5 N3 O4 -","- C20 H11 Ag F5 N3 O4 -","- C40 H22 Ag2 F10 N6 O8 -","2","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone","Crystal Growth & Design","2011","11","3","832","","10.1021/cg101490a","","","0.71073","MoKα","","0.0529","0.0456","","","0.1219","0.1318","","","","","","1.04","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500379","7.1978","0.001","7.8299","0.0008","14.7824","0.0014","103.094","0.008","101.379","0.01","91.071","0.01","793.74","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H30 Mn N6 O8 S2 -","- C28 H30 Mn N6 O8 S2 -","- C28 H30 Mn N6 O8 S2 -","1","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","1.54178","CuKα","","0.0865","0.075","","","0.2245","0.2667","","","","","","1.065","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500380","9.527","0.0005","11.2958","0.0007","12.2827","0.0008","64.411","0.006","84.523","0.005","74.411","0.005","1147.98","0.14","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H36 Mn N10 O10 S2 -","- C48 H36 Mn N10 O10 S2 -","- C48 H36 Mn N10 O10 S2 -","1","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","0.71073","MoKα","","0.0648","0.0403","","","0.0911","0.0982","","","","","","0.853","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500381","28.6655","0.0009","13.4822","0.0005","15.6206","0.0006","90","","104.564","0.004","90","","5843","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C55 H32 Mn N10 O14 S2 -","- C55 H32 Mn N10 O14 S2 -","- C220 H128 Mn4 N40 O56 S8 -","4","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","1.54178","CuKα","","0.1201","0.0859","","","0.2275","0.2611","","","","","","1.03","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500382","16.677","0.005","17.547","0.005","12.196","0.005","90","","126.616","0.005","90","","2864.6","1.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H14 Cd I2 N4 O6.8 -","- C22 H14 Cd I2 N4 O7.2 -","- C88 H56 Cd4 I8 N16 O28.8 -","4","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","0.71073","MoKα","","0.0758","0.0558","","","0.1643","0.1739","","","","","","0.994","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500383","15.2299","0.0015","10.8222","0.001","15.4087","0.0015","90","","116.394","0.002","90","","2274.9","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 Cd I2 N4 O4 -","- C22 H14 Cd I2 N4 O4 -","- C88 H56 Cd4 I8 N16 O16 -","4","1","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","0.71073","MoKα","","0.0372","0.0266","","","0.0627","0.0676","","","","","","1.081","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500384","5.885","0.005","11.267","0.005","12.9","0.005","68.083","0.005","87.642","0.005","82.567","0.005","786.8","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H16 Cd N6 O6 S2 -","- C28 H16 Cd N6 O6 S2 -","- C28 H16 Cd N6 O6 S2 -","1","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","0.71073","MoKα","","0.0831","0.0743","","","0.2171","0.2233","","","","","","1.054","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500385","18.3308","0.0011","22.5675","0.001","31.7435","0.0013","90","","90","","90","","13131.7","1.1","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C23 H14 Co0.5 N5 O7.5 S -","- C23 H14 Co0.5 N5 O7.5 S -","- C368 H224 Co8 N80 O120 S16 -","16","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","1.54178","CuKα","","0.0907","0.0829","","","0.2143","0.2188","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500386","7.932","0.005","11.356","0.005","14.605","0.005","78.961","0.005","80.467","0.005","79.776","0.005","1258.9","1.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H30 Cl6 Co N10 O8 S2 -","- C48 H30 Cl6 Co N10 O8 S2 -","- C48 H30 Cl6 Co N10 O8 S2 -","1","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","0.71073","MoKα","","0.0614","0.0376","","","0.0542","0.0567","","","","","","1.002","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500387","28.6844","0.0012","13.5805","0.0006","15.5499","0.0006","90","","104.672","0.004","90","","5859.9","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H32 Co N10 O17 S2 -","- C54 H32 Co N10 O17 S2 -","- C216 H128 Co4 N40 O68 S8 -","4","0.5","","Li, Guo-Bi; Liu, Jun-Min; Cai, Yue-Peng; Su, Cheng-Yong","Structural Diversity of a Series of Mn(II), Cd(II), and Co(II) Complexes with Pyridine Donor Diimide Ligands","Crystal Growth & Design","2011","11","7","2763","","10.1021/cg1014913","","","0.71073","MoKα","","0.1504","0.1152","","","0.3494","0.3837","","","","","","1.067","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500388","12.581","0.003","12.583","0.003","17.046","0.003","90","","93.32","0.03","90","","2694","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 Co N6 O8 -","- C27 H24 Co N6 O8 -","- C108 H96 Co4 N24 O32 -","4","1","","Mu, Yajuan; Fu, Junhong; Song, Yajing; Li, Zhen; Hou, Hongwei; Fan, Yaoting","Hydrothermal Syntheses of Metal‒Organic Frameworks Constructed from Aromatic Polycarboxylate and 4,4′-Bis(1,2,4-triazol-1-ylmethyl)biphenyl","Crystal Growth & Design","2011","11","6","2183","","10.1021/cg101494t","","","0.71073","MoKα","","0.051","0.0479","","","0.124","0.1265","","","","","","1.123","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500389","17.519","0.004","10.08","0.002","22.931","0.005","90","","98.72","0.03","90","","4002.6","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H66 Co3 N18 O20 -","- C72 H66 Co3 N18 O20 -","- C144 H132 Co6 N36 O40 -","2","0.5","","Mu, Yajuan; Fu, Junhong; Song, Yajing; Li, Zhen; Hou, Hongwei; Fan, Yaoting","Hydrothermal Syntheses of Metal‒Organic Frameworks Constructed from Aromatic Polycarboxylate and 4,4′-Bis(1,2,4-triazol-1-ylmethyl)biphenyl","Crystal Growth & Design","2011","11","6","2183","","10.1021/cg101494t","","","0.71073","MoKα","","0.0998","0.0836","","","0.1887","0.2011","","","","","","1.146","","","","has coordinates,has disorder","179534","2020-10-21","18:00:00",""
"4500390","9.5435","0.0019","14.915","0.003","25.142","0.005","90","","97.06","0.03","90","","3551.6","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H66 Co3 N18 O18 -","- C72 H66 Co3 N18 O18 -","- C144 H132 Co6 N36 O36 -","2","0.5","","Mu, Yajuan; Fu, Junhong; Song, Yajing; Li, Zhen; Hou, Hongwei; Fan, Yaoting","Hydrothermal Syntheses of Metal‒Organic Frameworks Constructed from Aromatic Polycarboxylate and 4,4′-Bis(1,2,4-triazol-1-ylmethyl)biphenyl","Crystal Growth & Design","2011","11","6","2183","","10.1021/cg101494t","","","0.71073","MoKα","","0.0881","0.07","","","0.1343","0.1465","","","","","","1.188","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500391","9.5275","0.0019","14.861","0.003","25.048","0.005","90","","96.92","0.03","90","","3520.7","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H66 N18 Ni3 O18 -","- C72 H66 N18 Ni3 O18 -","- C144 H132 N36 Ni6 O36 -","2","0.5","","Mu, Yajuan; Fu, Junhong; Song, Yajing; Li, Zhen; Hou, Hongwei; Fan, Yaoting","Hydrothermal Syntheses of Metal‒Organic Frameworks Constructed from Aromatic Polycarboxylate and 4,4′-Bis(1,2,4-triazol-1-ylmethyl)biphenyl","Crystal Growth & Design","2011","11","6","2183","","10.1021/cg101494t","","","0.71073","MoKα","","0.1068","0.0834","","","0.1545","0.1678","","","","","","1.163","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500392","10.169","0.002","16.396","0.003","17.484","0.005","90","","119.24","0.02","90","","2543.7","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H20 Cu N6 O6 -","- C27 H20 Cu N6 O6 -","- C108 H80 Cu4 N24 O24 -","4","1","","Mu, Yajuan; Fu, Junhong; Song, Yajing; Li, Zhen; Hou, Hongwei; Fan, Yaoting","Hydrothermal Syntheses of Metal‒Organic Frameworks Constructed from Aromatic Polycarboxylate and 4,4′-Bis(1,2,4-triazol-1-ylmethyl)biphenyl","Crystal Growth & Design","2011","11","6","2183","","10.1021/cg101494t","","","0.71073","MoKα","","0.0808","0.072","","","0.1499","0.1552","","","","","","1.196","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500393","8.2582","0.0017","11.067","0.002","14.08","0.003","93.68","0.03","105.18","0.03","92.97","0.03","1236.2","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H20 Cu N6 O4 -","- C26 H20 Cu N6 O4 -","- C52 H40 Cu2 N12 O8 -","2","1","","Mu, Yajuan; Fu, Junhong; Song, Yajing; Li, Zhen; Hou, Hongwei; Fan, Yaoting","Hydrothermal Syntheses of Metal‒Organic Frameworks Constructed from Aromatic Polycarboxylate and 4,4′-Bis(1,2,4-triazol-1-ylmethyl)biphenyl","Crystal Growth & Design","2011","11","6","2183","","10.1021/cg101494t","","","0.71073","MoKα","","0.114","0.0863","","","0.1787","0.196","","","","","","1.16","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500394","6.0292","0.0002","3.8688","0.0001","25.3201","0.0008","90","","92.004","0.002","90","","590.25","0.03","153","2","153","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","4,4'-Dichlorobenzil","1,2-Bis(4-chlorophenyl)ethane-1,2-dione","","- C14 H8 Cl2 O2 -","- C14 H8 Cl2 O2 -","- C28 H16 Cl4 O4 -","2","0.5","","Felsmann, Marika; Eissmann, Frank; Schwarzer, Anke; Weber, Edwin","Competitive Interactions in the Crystal Structures of Benzils Effected by Different Halogen Substitution","Crystal Growth & Design","2011","11","4","982","","10.1021/cg101495f","","","0.71073","MoKα","","0.0389","0.0339","","","0.0799","0.082","","","","","","1.163","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500395","6.0063","0.0012","26.006","0.005","4.0378","0.0008","90","","90","","90","","630.7","0.2","93","2","93","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","4,4'-Dibromobenzil","1,2-Bis(4-bromophenyl)ethane-1,2-dione","","- C14 H8 Br2 O2 -","- C14 H8 Br2 O2 -","- C28 H16 Br4 O4 -","2","0.5","","Felsmann, Marika; Eissmann, Frank; Schwarzer, Anke; Weber, Edwin","Competitive Interactions in the Crystal Structures of Benzils Effected by Different Halogen Substitution","Crystal Growth & Design","2011","11","4","982","","10.1021/cg101495f","","","0.71073","MoKα","","0.0297","0.0243","","","0.0485","0.0496","","","","","","1.105","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500396","5.8782","0.0008","27.12","0.004","4.1474","0.0004","90","","90","","90","","661.17","0.15","153","2","153","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","4,4'-Diiodobenzil","1,2-Bis(4-iodophenyl)ethane-1,2-dione","","- C14 H8 I2 O2 -","- C14 H8 I2 O2 -","- C28 H16 I4 O4 -","2","0.5","","Felsmann, Marika; Eissmann, Frank; Schwarzer, Anke; Weber, Edwin","Competitive Interactions in the Crystal Structures of Benzils Effected by Different Halogen Substitution","Crystal Growth & Design","2011","11","4","982","","10.1021/cg101495f","","","0.71073","MoKα","","0.0232","0.023","","","0.0576","0.0577","","","","","","1.368","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500397","10.224","0.002","13.969","0.002","12.724","0.002","90","","98.996","0.002","90","","1794.9","0.5","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","(1RS,3SR,4RS)-1-Phenyl-cis-3,4-butano-1-hydro-2,5-benzoxazocine HCl, (1RS,3SR,4RS)-cis-3,4-butano-N-desmethylnefopam HCl","6-Phenyl-11,12-dihydro-6H-5oxa-12-azonia-dibenzo[a,e]cyclooctene hydrogenchloride","","- C20 H24 Cl N O -","- C20 H24 Cl N O -","- C80 H96 Cl4 N4 O4 -","4","2","","Steinberg, Avital; Ergaz, Itzhak; Toscano, Rubén Alfredo; Glaser, Robert","Crystallization of a Racemate Affords aP21Chiral Crystal Structure: Asymmetric Unit of Two Opposite Handed Molecules Simulates AchiralP21/nPacking via Pseudosymmetry","Crystal Growth & Design","2011","11","4","1262","","10.1021/cg1014994","","","0.71073","MoKα","","0.0279","0.0241","","","0.0596","0.0614","","","","","","1.015","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500398","10.036","0.005","19.177","0.01","7.628","0.004","90","","100.228","0.012","90","","1444.8","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(cyclopropylammonium).(terephthalate)","","- C14 H20 N2 O4 -","- C14 H20 N2 O4 -","- C56 H80 N8 O16 -","4","1","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.1332","0.086","","","0.2156","0.2489","","","","","","1.02","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500399","7.484","0.002","11.332","0.004","11.999","0.004","104.202","0.006","101.783","0.007","106.211","0.007","905.7","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","bis(cyclobutylammonium).(terephthalate).(H2O)","","- C16 H26 N2 O5 -","- C16 H26 N2 O5 -","- C32 H52 N4 O10 -","2","1","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.1211","0.0689","","","0.197","0.2229","","","","","","1.106","","","","has coordinates","179534","2020-10-21","18:00:00",""
"4500400","10.2924","0.0016","6.3171","0.001","14.574","0.002","90","","106.009","0.011","90","","910.8","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(cyclopentylammonium).(terephthalate)","","- C9 H14 N O2 -","- C9 H14 N O2 -","- C36 H56 N4 O8 -","4","1","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.0657","0.0419","","","0.106","0.1137","","","","","","1.038","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500401","6.4126","0.0002","8.368","0.0003","28.9437","0.0008","95.534","0.002","90.51","0.002","96.869","0.002","1534.47","0.08","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","bis(cyclohexylammonium)terepthalate with Disorder Model","","- C20 H32 N2 O4 -","- C20 H32 N2 O4 -","- C60 H96 N6 O12 -","3","1.5","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.1437","0.09","","","0.2697","0.3121","","","","","","1.073","","","","has coordinates,has disorder","179535","2020-10-21","18:00:00",""
"4500402","11.121","0.001","6.2292","0.0005","16.302","0.0014","90","","102.8","0.004","90","","1101.26","0.16","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis(cycloheptylammonium).(terephthalate)","","- C11 H18 N O2 -","- C11 H18 N O2 -","- C44 H72 N4 O8 -","4","1","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.0615","0.0469","","","0.1263","0.1355","","","","","","1.032","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500403","6.5205","0.0009","9.0147","0.0013","11.2738","0.0018","67.047","0.008","74.083","0.008","79.039","0.008","584.22","0.15","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","bis(cyclooctylammonium).(terephthalate)","","- C12 H20 N O2 -","- C12 H20 N O2 -","- C24 H40 N2 O4 -","2","1","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.0687","0.0444","","","0.1234","0.1374","","","","","","0.806","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500404","5.4472","0.0001","8.6949","0.0002","16.5626","0.0005","94.434","0.002","93.198","0.002","97.775","0.001","773.17","0.03","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","bis(cyclododecylammonium).(terephthalate)","","- C16 H28 N O2 -","- C16 H28 N O2 -","- C32 H56 N2 O4 -","2","1","","Lemmerer, Andreas","Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12","Crystal Growth & Design","2011","11","2","583","","10.1021/cg101503x","","","0.71073","MoKα","","0.0462","0.037","","","0.0979","0.103","","","","","","1.055","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500405","8.214","0.001","8.763","0.001","18.791","0.003","80.311","0.001","81.94","0.002","65.782","0.001","1212.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H20 Ag I3 N4 S4 -","- C12 H20 Ag I3 N4 S4 -","- C24 H40 Ag2 I6 N8 S8 -","2","1","","Serpe, Angela; Artizzu, Flavia; Marchiò, Luciano; Mercuri, Maria Laura; Pilia, Luca; Deplano, Paola","Argentophilic Interactions in Mono-, Di-, and Polymeric Ag(I) Complexes withN,N′-Dimethyl-piperazine-2,3-dithione and Iodide","Crystal Growth & Design","2011","11","4","1278","","10.1021/cg1015065","","","0.71073","MoKα","","0.0742","0.0429","","","0.1069","0.1231","","","","","","1.031","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500406","9.328","0.001","15.087","0.001","33.966","0.003","90","","90","","90","","4780.1","0.7","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H20 Ag I3 N4 S4 -","- C12 H20 Ag I3 N4 S4 -","- C96 H160 Ag8 I24 N32 S32 -","8","1","","Serpe, Angela; Artizzu, Flavia; Marchiò, Luciano; Mercuri, Maria Laura; Pilia, Luca; Deplano, Paola","Argentophilic Interactions in Mono-, Di-, and Polymeric Ag(I) Complexes withN,N′-Dimethyl-piperazine-2,3-dithione and Iodide","Crystal Growth & Design","2011","11","4","1278","","10.1021/cg1015065","","","0.71073","MoKα","","0.0405","0.0295","","","0.0668","0.0724","","","","","","1.022","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500407","11.382","0.003","9.242","0.003","11.923","0.004","90","","118.18","0.01","90","","1105.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Ag2 I2 N4 S4 -","- C12 H20 Ag2 I2 N4 S4 -","- C24 H40 Ag4 I4 N8 S8 -","2","0.5","","Serpe, Angela; Artizzu, Flavia; Marchiò, Luciano; Mercuri, Maria Laura; Pilia, Luca; Deplano, Paola","Argentophilic Interactions in Mono-, Di-, and Polymeric Ag(I) Complexes withN,N′-Dimethyl-piperazine-2,3-dithione and Iodide","Crystal Growth & Design","2011","11","4","1278","","10.1021/cg1015065","","","0.71073","MoKα","","0.0324","0.025","","","0.0634","0.066","","","","","","1.002","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500408","7.597","0.001","16.811","0.002","8.875","0.001","90","","96.872","0.005","90","","1125.3","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Ag2 I2 N4 S4 -","- C12 H20 Ag2 I2 N4 S4 -","- C24 H40 Ag4 I4 N8 S8 -","2","0.5","","Serpe, Angela; Artizzu, Flavia; Marchiò, Luciano; Mercuri, Maria Laura; Pilia, Luca; Deplano, Paola","Argentophilic Interactions in Mono-, Di-, and Polymeric Ag(I) Complexes withN,N′-Dimethyl-piperazine-2,3-dithione and Iodide","Crystal Growth & Design","2011","11","4","1278","","10.1021/cg1015065","","","0.71073","MoKα","","0.0331","0.0251","","","0.0637","0.0676","","","","","","1.016","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500409","8.338","0.001","9.352","0.001","9.884","0.001","104.497","0.001","107.909","0.002","102.916","0.002","671.19","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H10 Ag2 I2 N2 S2 -","- C6 H10 Ag2 I2 N2 S2 -","- C12 H20 Ag4 I4 N4 S4 -","2","1","","Serpe, Angela; Artizzu, Flavia; Marchiò, Luciano; Mercuri, Maria Laura; Pilia, Luca; Deplano, Paola","Argentophilic Interactions in Mono-, Di-, and Polymeric Ag(I) Complexes withN,N′-Dimethyl-piperazine-2,3-dithione and Iodide","Crystal Growth & Design","2011","11","4","1278","","10.1021/cg1015065","","","0.71073","MoKα","","0.0364","0.031","","","0.0749","0.0776","","","","","","1.004","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500410","9.423","0.002","14.624","0.003","11.374","0.003","90","","95.013","0.004","90","","1561.4","0.6","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H52 Cl N6 Ni O6.5 -","- C24 H51 Cl N6 Ni O6.5 -","- C48 H102 Cl2 N12 Ni2 O13 -","2","1","","Ou, Guang-Chuan; Feng, Xiao-Long; Lu, Tong-Bu","pH Values Dependent Helicity of 1D Homochiral Helical Chains","Crystal Growth & Design","2011","11","3","851","","10.1021/cg101515g","","","0.71073","MoKα","","0.0551","0.0416","","","0.0934","0.1003","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500411","9.4346","0.0013","14.612","0.002","11.3735","0.0016","90","","95.137","0.002","90","","1561.6","0.4","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H53 Cl N6 Ni O7 -","- C24 H51 Cl N6 Ni O7 -","- C48 H102 Cl2 N12 Ni2 O14 -","2","1","","Ou, Guang-Chuan; Feng, Xiao-Long; Lu, Tong-Bu","pH Values Dependent Helicity of 1D Homochiral Helical Chains","Crystal Growth & Design","2011","11","3","851","","10.1021/cg101515g","","","0.71073","MoKα","","0.0428","0.0369","","","0.0889","0.0927","","","","","","1.039","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500412","12.352","0.002","12.352","0.002","18.238","0.006","90","","90","","90","","2782.6","1.1","173","2","173","2","","","","","","","","6","P 41","P 4w","76","","","","- C22 H48 Cl N5 Ni O6 -","- C22 H48 Cl N5 Ni O6 -","- C88 H192 Cl4 N20 Ni4 O24 -","4","1","","Ou, Guang-Chuan; Feng, Xiao-Long; Lu, Tong-Bu","pH Values Dependent Helicity of 1D Homochiral Helical Chains","Crystal Growth & Design","2011","11","3","851","","10.1021/cg101515g","","","0.71073","MoKα","","0.1027","0.0496","","","0.0891","0.1064","","","","","","0.992","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500413","12.3421","0.001","12.3421","0.001","18.221","0.003","90","","90","","90","","2775.6","0.6","173","2","173","2","","","","","","","","6","P 43","P 4cw","78","","","","- C22 H48 Cl N5 Ni O6 -","- C22 H48 Cl N5 Ni O6 -","- C88 H192 Cl4 N20 Ni4 O24 -","4","1","","Ou, Guang-Chuan; Feng, Xiao-Long; Lu, Tong-Bu","pH Values Dependent Helicity of 1D Homochiral Helical Chains","Crystal Growth & Design","2011","11","3","851","","10.1021/cg101515g","","","0.71073","MoKα","","0.0813","0.0478","","","0.1237","0.1454","","","","","","0.994","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500414","13.0095","0.001","7.0463","0.0006","12.2219","0.0009","90","","115.814","0.001","90","","1008.57","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 N2 O4 -","- C24 H24 N2 O4 -","- C48 H48 N4 O8 -","2","0.5","","Collas, Alain; Bagrowska, Izabela; Aleksandrzak, Krzysztof; Zeller, Matthias; Blockhuys, Frank","Competition between Methoxy-Based and Pyrazine-Based Synthons in Methoxy-Substituted Distyrylpyrazines","Crystal Growth & Design","2011","11","4","1299","","10.1021/cg101523f","","","0.71073","MoKα","","0.0569","0.0421","","","0.1134","0.126","","","","","","1.046","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500415","14.118","0.003","9.424","0.002","7.8733","0.0018","90","","90.938","0.005","90","","1047.4","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 N2 O4 -","- C24 H24 N2 O4 -","- C48 H48 N4 O8 -","2","0.5","","Collas, Alain; Bagrowska, Izabela; Aleksandrzak, Krzysztof; Zeller, Matthias; Blockhuys, Frank","Competition between Methoxy-Based and Pyrazine-Based Synthons in Methoxy-Substituted Distyrylpyrazines","Crystal Growth & Design","2011","11","4","1299","","10.1021/cg101523f","","","0.71073","MoKα","","0.117","0.0612","","","0.1413","0.174","","","","","","1.047","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500416","4.371","0.002","13.193","0.004","20.695","0.005","90","","98.52","0.03","90","","1180.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N2 O6 -","- C26 H28 N2 O6 -","- C52 H56 N4 O12 -","2","0.5","","Collas, Alain; Bagrowska, Izabela; Aleksandrzak, Krzysztof; Zeller, Matthias; Blockhuys, Frank","Competition between Methoxy-Based and Pyrazine-Based Synthons in Methoxy-Substituted Distyrylpyrazines","Crystal Growth & Design","2011","11","4","1299","","10.1021/cg101523f","","","0.71073","MoKα","","0.1571","0.0483","","","0.1213","0.1557","","","","","","0.994","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500417","8.04","0.002","10.806","0.004","15.268","0.005","90","","117.533","0.019","90","","1176.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N2 O6 -","- C26 H28 N2 O6 -","- C52 H56 N4 O12 -","2","0.5","","Collas, Alain; Bagrowska, Izabela; Aleksandrzak, Krzysztof; Zeller, Matthias; Blockhuys, Frank","Competition between Methoxy-Based and Pyrazine-Based Synthons in Methoxy-Substituted Distyrylpyrazines","Crystal Growth & Design","2011","11","4","1299","","10.1021/cg101523f","","","0.71073","MoKα","","0.2265","0.0736","","","0.1847","0.2494","","","","","","0.933","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500418","4.389","0.004","15.488","0.001","17.215","0.004","90","","103.9","0.03","90","","1136","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N2 O6 -","- C26 H28 N2 O6 -","- C52 H56 N4 O12 -","2","0.5","","Collas, Alain; Bagrowska, Izabela; Aleksandrzak, Krzysztof; Zeller, Matthias; Blockhuys, Frank","Competition between Methoxy-Based and Pyrazine-Based Synthons in Methoxy-Substituted Distyrylpyrazines","Crystal Growth & Design","2011","11","4","1299","","10.1021/cg101523f","","","0.71073","MoKα","","0.0748","0.0343","","","0.0841","0.1008","","","","","","1.019","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500419","8.3457","0.0004","13.5238","0.0006","14.446","0.0007","101.971","0.004","90.161","0.004","93.658","0.004","1591.53","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline)","","- C35 H34 N2 O12 -","- C35 H34 N2 O12 -","- C70 H68 N4 O24 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.1085","0.0545","","","0.1407","0.1538","","","","","","0.885","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500420","8.3651","0.0004","13.7509","0.0005","14.4816","0.0004","90.155","0.003","102.153","0.003","95.522","0.003","1620.44","0.11","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","benzene-1,3,5-tricarboxylic acid, 2,6-dimethylaniline, hydrate","","- C17 H19 N O7 -","- C17 H19 N O7 -","- C68 H76 N4 O28 -","4","2","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.0753","0.0473","","","0.1094","0.1221","","","","","","1.009","","","","has coordinates,has disorder","179535","2020-10-21","18:00:00",""
"4500421","5.1537","0.0003","16.5753","0.0013","16.4182","0.0012","102.806","0.007","96.918","0.006","95.858","0.006","1345.6","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline), ethanol","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline), ethanol","","- C28 H34 N2 O7 -","- C28 H34 N2 O7 -","- C56 H68 N4 O14 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.1148","0.0758","","","0.1989","0.2327","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500422","4.8205","0.0006","16.355","0.002","17.304","0.003","107.516","0.013","92.098","0.011","94.317","0.01","1294.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline), methanol","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline), methanol","","- C27 H32 N2 O7 -","- C27 H32 N2 O7 -","- C54 H64 N4 O14 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.1529","0.0781","","","0.1974","0.2503","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500423","8.2723","0.0007","8.5069","0.0005","18.6062","0.001","85.719","0.004","86.79","0.005","75.736","0.006","1264.48","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline), methanol","benzene-1,3,5-tricarboxylic acid, 4,4'-Methylene bis(2,6-dimethylaniline), methanol","","- C27 H32 N2 O7 -","- C27 H32 N2 O7 -","- C54 H64 N4 O14 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.0877","0.0577","","","0.1846","0.1952","","","","","","1.043","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500424","17.6","0.003","8.2122","0.0005","14.321","0.003","90","","132.78","0.03","90","","1519.2","0.8","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","4,4'-Methylene bis(2,6-dimethylaniline)","4,4'-Methylene bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C68 H88 N8 -","4","0.5","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.118","0.0826","","","0.2998","0.3262","","","","","","1.191","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500425","8.255","0.002","9.132","0.002","11.431","0.003","93.69","0.02","110.27","0.02","108.08","0.02","754","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","4,4'-Methylene bis(2,6-dimethylaniline)","4,4'-Methylene bis(2,6-dimethylaniline)","","- C17 H22 N2 -","- C17 H22 N2 -","- C34 H44 N4 -","2","1","","Bhattacharya, Suman; Saha, Binoy K.","Guest-Induced Isomerization of Net and Polymorphism in Trimesic Acid‒Arylamine Complexes","Crystal Growth & Design","2011","11","6","2194","","10.1021/cg101531h","","","0.71073","MoKα","","0.0919","0.062","","","0.2146","0.2293","","","","","","1.122","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500426","16.394","0.006","4.859","0.0015","18.591","0.007","90","","98.34","0.05","90","","1465.3","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Co N4 O2 -","- C14 H12 Co N4 O2 -","- C56 H48 Co4 N16 O8 -","4","0.5","","De la Pinta, Noelia; Fidalgo, M. Luz; Lezama, Luis; Madariaga, Gotzon; Callejo, Lorena; Cortés, Roberto","Ferromagnetic End-to-End Azides and Tetrahedral Cobalt: Unusual Findings in the M-BPA-Pseudohalide2System","Crystal Growth & Design","2011","11","4","1310","","10.1021/cg1015324","","","0.71069","MoKα","","0.1087","0.0357","","","","0.0669","","","","","","0.804","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500427","9.993","0.008","13.395","0.009","10.502","0.006","90","","106.04","0.06","90","","1351","1.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Cu N8 -","- C12 H12 Cu N8 -","- C48 H48 Cu4 N32 -","4","1","","De la Pinta, Noelia; Fidalgo, M. Luz; Lezama, Luis; Madariaga, Gotzon; Callejo, Lorena; Cortés, Roberto","Ferromagnetic End-to-End Azides and Tetrahedral Cobalt: Unusual Findings in the M-BPA-Pseudohalide2System","Crystal Growth & Design","2011","11","4","1310","","10.1021/cg1015324","","","0.71073","MoKα","","0.0943","0.0397","","","","0.1136","","","","","","1.004","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500428","10.2023","0.0004","16.4489","0.0007","7.4756","0.0003","90","","102.316","0.002","90","","1225.66","0.09","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H12 Ca O10 -","- C9 H12 Ca O10 -","- C36 H48 Ca4 O40 -","4","1","","Borah, Ballav Moni; Dey, Sandeep Kumar; Das, Gopal","Crystal to Calcite: Fabrication of Pure Calcium Carbonate Polymorph in the Solid State","Crystal Growth & Design","2011","11","7","2773","","10.1021/cg101534n","","","0.71073","MoKα","","0.081","0.0731","","","0.2037","0.2096","","","","","","1.006","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500429","5.0255","0.0013","6.8219","0.0013","12.196","0.003","89.254","0.007","80.804","0.007","79.282","0.005","405.49","0.16","100","2","100","","","","","","","","see text","4","P -1","-P 1","2","4-(acetylamino)-benzoic acid","","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C18 H18 N2 O6 -","2","1","","Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R.","Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering","Crystal Growth & Design","2011","11","2","616","","10.1021/cg101540y","","x-ray","0.71075","MoKα","","0.0502","0.0407","","","0.112","0.1177","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500430","11.662","0.001","9.4694","0.0008","7.3997","0.0006","90","","106.559","0.007","90","","783.27","0.12","100","2","100","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","1-Acetamido-4-methylbenzene","","","- C9 H11 N O -","- C9 H11 N O -","- C36 H44 N4 O4 -","4","1","","Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R.","Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering","Crystal Growth & Design","2011","11","2","616","","10.1021/cg101540y","","x-ray","0.71075","MoKα","","0.0509","0.0401","","","0.0955","0.1008","","","","","","1.08","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500431","5.0299","0.0002","6.831","0.0003","12.1945","0.0005","89.227","0.002","80.846","0.002","79.318","0.002","406.43","0.03","100","2","100","2","","","","","","","","4","P -1","-P 1","2","p-acetamidobenzoic acid","","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C18 H18 N2 O6 -","2","1","","Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R.","Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering","Crystal Growth & Design","2011","11","2","616","","10.1021/cg101540y","","x-ray","0.71073","MoKα","","0.035","0.018","","","","0.042","0.022","","","","","1.161","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500432","3.876","0.0003","10.9298","0.0009","16.62","0.001","90","","93.383","0.004","90","","702.86","0.09","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","p-methoxy benzoic acid","","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","1","","Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R.","Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering","Crystal Growth & Design","2011","11","2","616","","10.1021/cg101540y","","x-ray","0.71073","MoKα","","0.037","0.018","","","","0.041","0.022","","","","","1.042","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500433","7.2832","0.0003","7.4255","0.0003","7.81","0.0003","96.067","0.002","108.353","0.002","117.701","0.002","338.6","0.03","100","2","100","2","","","","","","","","3","P -1","-P 1","2","p-methyl benzoic acid","","","- C8 H8 O2 -","- C8 H8 O2 -","- C16 H16 O4 -","2","1","","Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R.","Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering","Crystal Growth & Design","2011","11","2","616","","10.1021/cg101540y","","x-ray","0.71073","MoKα","","0.034","0.021","","","","0.06","0.028","","","","","1.917","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500434","9.371","0.0009","7.7868","0.0008","19.53","0.002","90","","90","","90","","1425.1","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","acetanilide","","","- C8 H9 N O -","- C8 H9 N O -","- C64 H72 N8 O8 -","8","1","","Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R.","Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering","Crystal Growth & Design","2011","11","2","616","","10.1021/cg101540y","","x-ray","0.71073","MoKα","","0.067","0.025","","","","0.042","0.028","","","","","1.314","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500435","8.8802","0.0016","10.421","0.0018","35.019","0.006","90","","97.228","0.003","90","","3214.9","1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 Mg O8 -","- C14 H18 Mg O8 -","- C112 H144 Mg8 O64 -","8","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.8463","synchrotron","","0.1163","0.0894","","","0.2131","0.23","","","","","","1.032","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500436","11.8003","0.0004","7.1674","0.0002","15.7364","0.0005","90","","99.998","0.002","90","","1310.73","0.07","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H12 O5 Sr -","- C14 H12 O5 Sr -","- C56 H48 O20 Sr4 -","4","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0856","0.0582","","","0.1248","0.1375","","","","","","1.007","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500437","7.598","0.0003","12.9258","0.0005","30.7127","0.0014","90","","94.956","0.002","90","","3005","0.2","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 Ba O6 -","- C14 H14 Ba O6 -","- C112 H112 Ba8 O48 -","8","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0573","0.035","","","0.0838","0.0988","","","","","","1.202","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500438","7.281","0.0005","6.6002","0.0004","14.6587","0.0009","90","","99.973","0.003","90","","693.79","0.08","120","2","120","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H12 F2 Mg O6 -","- C14 H12 F2 Mg O6 -","- C28 H24 F4 Mg2 O12 -","2","0.5","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.067","0.0547","","","0.1131","0.1191","","","","","","1.096","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500439","6.7231","0.0003","7.4076","0.0003","16.622","0.001","82.951","0.004","89.38","0.004","84.302","0.004","817.49","0.07","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H17.48 F2 O8.74 Sr -","- C14 H14 F2 O8.74 Sr -","- C28 H28 F4 O17.48 Sr2 -","2","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0886","0.0814","","","0.2213","0.2265","","","","","","1.047","","","","has coordinates,has disorder","179535","2020-10-21","18:00:00",""
"4500440","10.3942","0.0005","7.7929","0.0005","16.1632","0.001","90","","103.679","0.004","90","","1272.1","0.13","120","2","120","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H8 Ba F2 O4 -","- C14 H8 Ba F2 O4 -","- C56 H32 Ba4 F8 O16 -","4","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0449","0.0393","","","0.1058","0.1113","","","","","","1.06","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500441","39.806","0.0018","10.387","0.0005","8.848","0.0004","90","","91.039","0.002","90","","3657.7","0.3","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 Cl2 Mg O8 -","- C14 H16 Cl2 Mg O8 -","- C112 H128 Cl16 Mg8 O64 -","8","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.1489","0.0637","","","0.085","0.1075","","","","","","1.089","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500442","6.5797","0.0009","34.867","0.005","7.1797","0.0011","90","","93.184","0.005","90","","1644.6","0.4","120","2","120","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H14 Ca Cl2 O7 -","- C14 H14 Ca Cl2 O7 -","- C56 H56 Ca4 Cl8 O28 -","4","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.1004","0.0706","","","0.175","0.2015","","","","","","1.069","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500443","6.78","0.0002","7.5071","0.0002","17.5087","0.0005","81.9304","0.0014","89.785","0.0015","83.9229","0.0016","877.32","0.04","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Cl2 O8 Sr -","- C14 H16 Cl2 O8 Sr -","- C28 H32 Cl4 O16 Sr2 -","2","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0606","0.0555","","","0.1328","0.1353","","","","","","1.202","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500444","7.0487","0.0005","7.6124","0.0005","17.3085","0.0014","80.425","0.006","89.215","0.006","82.281","0.006","907.46","0.12","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Ba Cl2 O8 -","- C14 H16 Ba Cl2 O8 -","- C28 H32 Ba2 Cl4 O16 -","2","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0662","0.0604","","","0.1536","0.1569","","","","","","1.03","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500445","6.607","0.002","13.075","0.003","18.444","0.004","90","","90","","90","","1593.3","0.7","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 Ca N2 O6 -","- C14 H16 Ca N2 O6 -","- C56 H64 Ca4 N8 O24 -","4","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.1372","0.0932","","","0.2044","0.2358","","","","","","1.086","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500446","33.755","0.002","12.908","0.002","7.542","0.002","90","","96.02","0.02","90","","3268","1","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H16.9 Ba N2 O6.45 -","- C14 H16 Ba N2 O6.45 -","- C112 H128 Ba8 N16 O51.6 -","8","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.7107","MoKα","","0.047","0.0303","","","0.0691","0.0769","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500447","13.8735","0.0006","14.1004","0.0005","14.0354","0.0006","86.534","0.002","62.119","0.002","62.583","0.002","2111.94","0.16","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H24 Mg N2 O16 -","- C14 H24 Mg N2 O16 -","- C56 H96 Mg4 N8 O64 -","4","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0921","0.0454","","","0.111","0.135","","","","","","1.03","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500448","15.093","0.002","9.949","0.0005","15.713","0.002","90","","94.767","0.002","90","","2351.3","0.4","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H26 Ca N2 O17 -","- C14 H26 Ca N2 O17 -","- C56 H104 Ca4 N8 O68 -","4","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0774","0.046","","","0.0825","0.0956","","","","","","1.064","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500449","6.6527","0.0006","11.1343","0.001","31.494","0.003","90","","94.882","0.004","90","","2324.4","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H26 N2 O17 Sr -","- C14 H26 N2 O17 Sr -","- C56 H104 N8 O68 Sr4 -","4","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.1245","0.0541","","","0.0832","0.1063","","","","","","1.045","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500450","6.528","0.0002","10.657","0.0003","28.3021","0.0005","90","","91.156","0.001","90","","1968.55","0.09","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 Ba N2 O13 -","- C14 H18 Ba N2 O13 -","- C56 H72 Ba4 N8 O52 -","4","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0573","0.0316","","","0.0534","0.0595","","","","","","1.003","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500451","9.2329","0.0002","10.039","0.0003","15.686","0.0005","101.056","0.001","98.483","0.002","99.498","0.002","1383.06","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 Ba O7 -","- C14 H12 Ba O7 -","- C56 H48 Ba4 O28 -","4","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0421","0.0253","","","0.0436","0.0477","","","","","","1.035","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500452","5.2497","0.0005","7.6168","0.0008","11.7111","0.0013","81.763","0.004","78.428","0.005","73.836","0.005","438.72","0.08","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Mg N2 O12 -","- C14 H16 Mg N2 O12 -","- C14 H16 Mg N2 O12 -","1","0.5","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0487","0.0369","","","0.0896","0.0956","","","","","","1.065","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500453","7.7232","0.0002","10.1673","0.0003","11.1947","0.0003","81.353","0.001","82.231","0.002","89.441","0.002","861.03","0.04","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 Ca N2 O10 -","- C14 H12 Ca N2 O10 -","- C28 H24 Ca2 N4 O20 -","2","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0408","0.0294","","","0.0633","0.0674","","","","","","1.05","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500454","4.0818","0.0003","31.856","0.002","6.8","0.004","90","","94.378","0.003","90","","881.6","0.5","123","2","123","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C14 H16 N2 O12 Sr -","- C14 H16 N2 O12 Sr -","- C28 H32 N4 O24 Sr2 -","2","0.5","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0976","0.0721","","","0.1605","0.1727","","","","","","1.172","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500455","8.2858","0.0002","8.3482","0.0001","13.8501","0.0003","80.492","0.001","85.986","0.001","71.065","0.001","893.6","0.03","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Ba N2 O11 -","- C14 H14 Ba N2 O11 -","- C28 H28 Ba2 N4 O22 -","2","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0174","0.015","","","0.0329","0.0336","","","","","","1.113","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500456","14.9499","0.0006","8.8062","0.0004","22.3285","0.0009","90","","104.359","0.003","90","","2847.8","0.2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 Ca N2 O6.5 -","- C14 H13 Ca N2 O6.5 -","- C112 H104 Ca8 N16 O52 -","8","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.1066","0.0465","","","0.0807","0.0988","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500457","15.146","0.001","9.022","0.0006","22.492","0.001","90","","105.794","0.001","90","","2957.4","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 N2 O6.5 Sr -","- C14 H13 N2 O6.5 Sr -","- C112 H104 N16 O52 Sr8 -","8","2","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71073","MoKα","","0.0938","0.0476","","","0.0762","0.0885","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500458","13.02","0.0004","4.322","0.0001","15.3326","0.0005","90","","104.74","0.001","90","","834.41","0.04","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H18 Ba N2 O9 -","- C14 H18 Ba N2 O9 -","- C28 H36 Ba2 N4 O18 -","2","1","","Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty","Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates","Crystal Growth & Design","2011","11","4","1318","","10.1021/cg101547r","","","0.71069","MoKα","","0.0313","0.0243","","","0.0416","0.0444","","","","","","1.071","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500459","10.278","0.0004","12.0006","0.0003","21.9936","0.0006","90","","95.19","0.003","90","","2701.62","0.15","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 Br4 N4 O4 S -","- C21 H26 Br4 N4 O4 S -","- C84 H104 Br16 N16 O16 S4 -","4","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Organic Complexes Built by Halogenated Molecules: Unexpectedin SituC‒N Bond Formation in Metal-Free Solvothermal Conditions","Crystal Growth & Design","2011","11","6","2035","","10.1021/cg101550w","","","0.71073","MoKα","","0.0709","0.0491","","","0.1446","0.1748","","","","","","1.012","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500460","15.8417","0.0006","15.8417","0.0006","19.1079","0.0013","90","","90","","90","","4795.3","0.4","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C17.5 H22 Br4 N2 O5.5 S -","- C17.5 H16 Br4 N2 O5.5 S -","- C140 H128 Br32 N16 O44 S8 -","8","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Organic Complexes Built by Halogenated Molecules: Unexpectedin SituC‒N Bond Formation in Metal-Free Solvothermal Conditions","Crystal Growth & Design","2011","11","6","2035","","10.1021/cg101550w","","","0.71073","MoKα","","0.0797","0.0618","","","0.1717","0.1884","","","","","","1.154","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500461","10.3884","0.0004","11.4896","0.0003","21.6902","0.0006","90","","94.662","0.003","90","","2580.35","0.14","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 Cl4 N4 O4 S -","- C21 H26 Cl4 N4 O4 S -","- C84 H104 Cl16 N16 O16 S4 -","4","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Organic Complexes Built by Halogenated Molecules: Unexpectedin SituC‒N Bond Formation in Metal-Free Solvothermal Conditions","Crystal Growth & Design","2011","11","6","2035","","10.1021/cg101550w","","","0.71073","MoKα","","0.0779","0.0501","","","0.14","0.1467","","","","","","1.112","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500462","15.543","0.003","15.543","0.003","19.21","0.005","90","","90","","90","","4640.8","1.8","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C17.5 H22 Cl4 N2 O5.5 S -","- C17.5 H16 Cl4 N2 O5.5 S -","- C140 H128 Cl32 N16 O44 S8 -","8","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Organic Complexes Built by Halogenated Molecules: Unexpectedin SituC‒N Bond Formation in Metal-Free Solvothermal Conditions","Crystal Growth & Design","2011","11","6","2035","","10.1021/cg101550w","","","0.71073","MoKα","","0.0604","0.0541","","","0.1673","0.1819","","","","","","1.089","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500463","13.658","0.003","9.837","0.002","13.586","0.003","90","","92.64","0.03","90","","1823.4","0.7","200","0.2","200","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Ca2 N2 O11 -","- C14 H12 Ca2 N2 O11 -","- C56 H48 Ca8 N8 O44 -","4","0.5","","Kim, Min Kyung; Bae, Kyung-Lyul; Ok, Kang Min","From Pincers to Steps: Synthesis, Structure, Characterization, and Transformation of a New Helical Calcium−Organic Framework, Ca[NC5H3(CO2)2](H2O)1.5","Crystal Growth & Design","2011","11","4","930","","10.1021/cg101558e","","","0.71073","MoKα","","0.1128","0.0497","","","0.0906","0.1394","","","","","","1.152","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500464","5.8693","0.0012","17.848","0.004","9.897","0.002","90","","98.62","0.03","90","","1025.1","0.4","200","0.2","200","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H9 Ca N O7 -","- C7 H9 Ca N O7 -","- C28 H36 Ca4 N4 O28 -","4","1","","Kim, Min Kyung; Bae, Kyung-Lyul; Ok, Kang Min","From Pincers to Steps: Synthesis, Structure, Characterization, and Transformation of a New Helical Calcium−Organic Framework, Ca[NC5H3(CO2)2](H2O)1.5","Crystal Growth & Design","2011","11","4","930","","10.1021/cg101558e","","","0.71073","MoKα","","0.0769","0.0442","","","0.0927","0.1163","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500465","11.967","0.0003","11.967","0.0003","28.6669","0.0007","90","","90","","90","","4105.36","0.18","173","2","173","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C18 H11 Ag4 N O8 -","- C18 H11 Ag4 N O8 -","- C144 H88 Ag32 N8 O64 -","8","0.5","","Sun, Di; Wei, Zhan-Hua; Wang, Dan-Feng; Zhang, Na; Huang, Rong-Bin; Zheng, Lan-Sun","Acetonitrile-Templated Assembly of a Laminar Silver(I) Phthalate Coordination Polymer","Crystal Growth & Design","2011","11","5","1427","","10.1021/cg101562p","","","0.71073","MoKα","","0.0399","0.033","","","0.0834","0.0865","","","","","","1.082","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500466","11.87","0.002","6.5949","0.0013","12.665","0.003","90","","108","0.03","90","","942.9","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 Ag2 O5 -","- C8 H6 Ag2 O5 -","- C32 H24 Ag8 O20 -","4","1","","Sun, Di; Wei, Zhan-Hua; Wang, Dan-Feng; Zhang, Na; Huang, Rong-Bin; Zheng, Lan-Sun","Acetonitrile-Templated Assembly of a Laminar Silver(I) Phthalate Coordination Polymer","Crystal Growth & Design","2011","11","5","1427","","10.1021/cg101562p","","","0.71073","MoKα","","0.031","0.0293","","","0.0714","0.0756","","","","","","1.093","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500467","13.144","0.003","13.454","0.003","31.573","0.006","90","","90","","90","","5583","2","301","2","301","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Temazepam","7-Chloro-1,3-dihydro-3-hydroxy-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one","","- C16 H13 Cl N2 O2 -","- C16 H13 Cl N2 O2 -","- C256 H208 Cl16 N32 O32 -","16","2","","Jetti, Ram K. R.; Bhogala, Balakrishna R.; Gorantla, Asha R.; Karusula, Nageswara R.; Datta, Debashish","Structural and Thermodynamic Features of Three Stable Crystal Forms of Temazepam: A Sedative Drug","Crystal Growth & Design","2011","11","6","2039","","10.1021/cg1015675","","","0.71073","MoKα","","0.056","0.0452","","","0.0993","0.1054","","","","","","1.117","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500468","9.789","0.002","12.235","0.002","13.586","0.003","101.6","0.03","104.53","0.03","98.76","0.03","1507.3","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","Temazepam","7-Chloro-1,3-dihydro-3-hydroxy-1-methyl-5-phenyl-2H-1,4-benzodiazepin- 2-one","","- C16 H13 Cl N2 O2 -","- C16 H13 Cl N2 O2 -","- C64 H52 Cl4 N8 O8 -","4","2","","Jetti, Ram K. R.; Bhogala, Balakrishna R.; Gorantla, Asha R.; Karusula, Nageswara R.; Datta, Debashish","Structural and Thermodynamic Features of Three Stable Crystal Forms of Temazepam: A Sedative Drug","Crystal Growth & Design","2011","11","6","2039","","10.1021/cg1015675","","","0.71073","MoKα","","0.0935","0.0707","","","0.1932","0.2262","","","","","","1.063","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500469","7.227","0.003","23.701","0.011","3.6999","0.0016","90","","90","","90","","633.7","0.5","296","2","296","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C6 H6 N O3.5 -","- C6 H6 N O3.5 -","- C24 H24 N4 O14 -","4","1","","Matias, Elisa P.; Bernardes, Carlos E. S.; Piedade, M. Fátima M.; Minas da Piedade, Manuel E.","A Robust yet Metastable New Hemihydrate of 4-Hydroxynicotinic Acid","Crystal Growth & Design","2011","11","7","2803","","10.1021/cg1015687","","","0.71073","MoKα","","0.0718","0.0465","","","0.1077","0.1188","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500470","25.117","0.011","26.607","0.012","17.479","0.008","90","","90","","90","","11681","9","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C44 H34 N6 O29 Zn7 -","- C44 H24 N6 O29 Zn7 -","- C176 H96 N24 O116 Zn28 -","4","1","","Ling, Yun; Chen, Zhenxia; Zheng, Hua; Zhou, Yaming; Weng, Linhong; Zhao, Dongyuan","Two Novel Zinc(II) Metal‒Organic Frameworks Based on Triazole-Carboxylate Shared Paddle-Wheel Units: Synthesis, Structure, and Gas Adsorption","Crystal Growth & Design","2011","11","7","2811","","10.1021/cg101569a","","","0.71073","MoKα","","0.1606","0.0851","","","0.2212","0.2728","","","","","","1.01","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500471","19.379","0.008","14.639","0.006","19.484","0.007","90","","116.046","0.006","90","","4966","3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C48 H39 N9 O27 Zn6 -","- C48 H30 N9 O27 Zn6 -","- C96 H60 N18 O54 Zn12 -","2","1","","Ling, Yun; Chen, Zhenxia; Zheng, Hua; Zhou, Yaming; Weng, Linhong; Zhao, Dongyuan","Two Novel Zinc(II) Metal‒Organic Frameworks Based on Triazole-Carboxylate Shared Paddle-Wheel Units: Synthesis, Structure, and Gas Adsorption","Crystal Growth & Design","2011","11","7","2811","","10.1021/cg101569a","","","0.71073","MoKα","","0.1056","0.0797","","","0.2406","0.2613","","","","","","1.035","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500472","9.5194","0.0007","13.0361","0.0009","31.562","0.002","80.674","0.006","85.783","0.005","68.813","0.006","3603.2","0.5","120","1","120","1","","","","","","","see text","4","P -1","-P 1","2","","2,2'-((9,9-butyl-9H-fluorene-2,7-diyl)bis(4,1 phenylene))bisbenzo[d]thiazole","","- C188 H140 N8 S8 -","- C188 H140 N8 S8 -","- C188 H140 N8 S8 -","1","0.5","","Dikundwar, Amol G.; Dutta, Gitish K.; Guru Row, Tayur N.; Patil, Satish","Polymorphism in Opto-Electronic Materials with a Benzothiazole-fluorene Core: A Consequence of High Conformational Flexibility of π-Conjugated Backbone and Alkyl Side Chains","Crystal Growth & Design","2011","11","5","1615","","10.1021/cg101579f","","x-ray","0.71073","MoKα","","0.2699","0.1691","","","0.4088","0.4643","","","","","","1.29","","","","has coordinates,has disorder","179535","2020-10-21","18:00:00",""
"4500473","17.9801","0.0007","14.3419","0.0005","14.8689","0.0007","90","","109.381","0.005","90","","3617","0.3","120","1","120","1","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","2,2'-((9,9-butyl-9H-fluorene-2,7-diyl)bis(4,1 phenylene))bisbenzo[d]thiazole","","- C47 H40 N2 S2 -","- C47 H40 N2 S2 -","- C188 H160 N8 S8 -","4","1","","Dikundwar, Amol G.; Dutta, Gitish K.; Guru Row, Tayur N.; Patil, Satish","Polymorphism in Opto-Electronic Materials with a Benzothiazole-fluorene Core: A Consequence of High Conformational Flexibility of π-Conjugated Backbone and Alkyl Side Chains","Crystal Growth & Design","2011","11","5","1615","","10.1021/cg101579f","","x-ray","0.71073","MoKα","","0.093","0.0639","","","0.15","0.167","","","","","","1.061","","","","has coordinates,has disorder","179535","2020-10-21","18:00:00",""
"4500474","16.2922","0.0008","17.2859","0.0008","17.3329","0.0006","88.728","0.003","66.285","0.004","80.992","0.004","4409.6","0.4","120","1","120","1","","","","","","","see text","4","P -1","-P 1","2","","2,2'-((octyl-9H-fluorene-2,7-diyl)bis(4,1 phenylene))bisbenzo[d]thiazole","","- C55 H56 N2 S2 -","- C55 H56 N2 S2 -","- C220 H224 N8 S8 -","4","2","","Dikundwar, Amol G.; Dutta, Gitish K.; Guru Row, Tayur N.; Patil, Satish","Polymorphism in Opto-Electronic Materials with a Benzothiazole-fluorene Core: A Consequence of High Conformational Flexibility of π-Conjugated Backbone and Alkyl Side Chains","Crystal Growth & Design","2011","11","5","1615","","10.1021/cg101579f","","x-ray","0.71073","MoKα","","0.159","0.0733","","","0.1089","0.1383","","","","","","0.933","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500475","8.2872","0.0004","14.9135","0.0009","17.9141","0.001","88.609","0.005","88.098","0.004","86.185","0.005","2207.4","0.2","295","1","295","1","","","","","","","see text","4","P -1","-P 1","2","","2,2'-((octyl-9H-fluorene-2,7-diyl)bis(4,1 phenylene))bisbenzo[d]thiazole","","- C55 H56 N2 S2 -","- C55 H56 N2 S2 -","- C110 H112 N4 S4 -","2","1","","Dikundwar, Amol G.; Dutta, Gitish K.; Guru Row, Tayur N.; Patil, Satish","Polymorphism in Opto-Electronic Materials with a Benzothiazole-fluorene Core: A Consequence of High Conformational Flexibility of π-Conjugated Backbone and Alkyl Side Chains","Crystal Growth & Design","2011","11","5","1615","","10.1021/cg101579f","","x-ray","0.71073","MoKα","","0.1163","0.0597","","","0.1051","0.1306","","","","","","0.983","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500476","7.01","0.005","7.988","0.004","9.281","0.005","86.344","0.005","83.185","0.005","69.55","0.003","483.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 Co N10 O8 -","- C14 H20 Co N10 O8 -","- C14 H20 Co N10 O8 -","1","0.5","","Mishra, Ashutosh Kumar; Kumar, Jitendra; Khanna, Shruti; Verma, Sandeep","Crystallographic Signatures of Cobalt Coordination with Modified Adenine Nucleobase Containing Carboxyl Group Pendants","Crystal Growth & Design","2011","11","5","1623","","10.1021/cg101581g","","","0.71069","MoKα","","0.0911","0.0634","","","0.1495","0.2147","","","","","","1.18","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500477","7.937","0.003","12.11","0.004","12.301","0.004","90","","99.007","0.002","90","","1167.8","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","9-carboxypropyladenine cobalt complex","","","- C16 H28 Co N10 O10 -","- C16 H28 Co N10 O10 -","- C32 H56 Co2 N20 O20 -","2","0.5","","Mishra, Ashutosh Kumar; Kumar, Jitendra; Khanna, Shruti; Verma, Sandeep","Crystallographic Signatures of Cobalt Coordination with Modified Adenine Nucleobase Containing Carboxyl Group Pendants","Crystal Growth & Design","2011","11","5","1623","","10.1021/cg101581g","","","0.71073","MoKα","","0.0966","0.0536","","","0.1126","0.1763","","","","","","1.154","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500478","8.451","0.003","9.032","0.004","13.264","0.005","79.914","0.006","89.183","0.007","81.247","0.007","985.1","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H18 Co N10 O5 -","- C17 H18 Co N10 O5 -","- C34 H36 Co2 N20 O10 -","2","1","","Mishra, Ashutosh Kumar; Kumar, Jitendra; Khanna, Shruti; Verma, Sandeep","Crystallographic Signatures of Cobalt Coordination with Modified Adenine Nucleobase Containing Carboxyl Group Pendants","Crystal Growth & Design","2011","11","5","1623","","10.1021/cg101581g","","","0.71073","MoKα","","0.0858","0.0639","","","0.1664","0.2237","","","","","","1.104","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500479","3.7321","0.0001","7.7308","0.0002","12.0995","0.0004","77.092","0.002","85.07","0.002","76.459","0.002","330.607","0.017","100","2","100","2","","","","","","","","5","P -1","-P 1","2","2-chloro-4-fluoro benzoic acid","","","- C7 H4 Cl F O2 -","- C7 H4 Cl F O2 -","- C14 H8 Cl2 F2 O4 -","2","1","","Hathwar, Venkatesha R.; Guru Row, Tayur N.","Charge Density Analysis of Heterohalogen (Cl···F) and Homohalogen (F···F) Intermolecular Interactions in Molecular Crystals: Importance of the Extent of Polarizability","Crystal Growth & Design","2011","11","4","1338","","10.1021/cg1015862","","x-ray","0.71073","MoKα","","","0.012","","","","0.0306","0.0208","","","","","0.974","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500480","8.8715","0.0003","7.6301","0.0003","9.6077","0.0003","90","","92.576","0.002","90","","649.69","0.04","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-fluoro benzamide","","","- C7 H6 F N O -","- C7 H6 F N O -","- C28 H24 F4 N4 O4 -","4","1","","Hathwar, Venkatesha R.; Guru Row, Tayur N.","Charge Density Analysis of Heterohalogen (Cl···F) and Homohalogen (F···F) Intermolecular Interactions in Molecular Crystals: Importance of the Extent of Polarizability","Crystal Growth & Design","2011","11","4","1338","","10.1021/cg1015862","","x-ray","0.71073","MoKα","","","0.0193","","","","0.0451","0.022","","","","","1.167","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500481","10.3197","0.001","19.6947","0.0019","11.0388","0.0011","90","","112.798","0.002","90","","2068.3","0.4","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 Cu N5 O7 S -","- C17 H20 Cu N5 O7 S -","- C68 H80 Cu4 N20 O28 S4 -","4","1","","Kathalikkattil, Amal Cherian; Bisht, Kamal Kumar; Aliaga-Alcalde, Núria; Suresh, Eringathodi","Synthesis, Magnetic Properties, and Structural Investigation of Mixed-Ligand Cu(II) Helical Coordination Polymers with an Amino Acid Backbone and N-Donor Propping: 1-D Helical, 2-D Hexagonal Net (hcb), and 3-DinsTopologies","Crystal Growth & Design","2011","11","5","1631","","10.1021/cg101587h","","","0.71073","MoKα","","0.0956","0.0831","","","0.1619","0.1668","","","","","","1.281","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500482","23.234","0.006","5.1735","0.0012","11.294","0.003","90","","90","","90","","1357.6","0.6","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C11 H12 Cu N3 O5 -","- C11 H12 Cu N3 O5 -","- C44 H48 Cu4 N12 O20 -","4","1","","Kathalikkattil, Amal Cherian; Bisht, Kamal Kumar; Aliaga-Alcalde, Núria; Suresh, Eringathodi","Synthesis, Magnetic Properties, and Structural Investigation of Mixed-Ligand Cu(II) Helical Coordination Polymers with an Amino Acid Backbone and N-Donor Propping: 1-D Helical, 2-D Hexagonal Net (hcb), and 3-DinsTopologies","Crystal Growth & Design","2011","11","5","1631","","10.1021/cg101587h","","","0.71073","MoKα","","0.0888","0.0842","","","0.1778","0.18","","","","","","1.2","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500483","21.49","0.003","6.8822","0.001","7.8075","0.0011","90","","90","","90","","1154.7","0.3","110","2","110","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C9 H7 Cu N2 O4 -","- C9 H7 Cu N2 O4 -","- C36 H28 Cu4 N8 O16 -","4","1","","Kathalikkattil, Amal Cherian; Bisht, Kamal Kumar; Aliaga-Alcalde, Núria; Suresh, Eringathodi","Synthesis, Magnetic Properties, and Structural Investigation of Mixed-Ligand Cu(II) Helical Coordination Polymers with an Amino Acid Backbone and N-Donor Propping: 1-D Helical, 2-D Hexagonal Net (hcb), and 3-DinsTopologies","Crystal Growth & Design","2011","11","5","1631","","10.1021/cg101587h","","","0.71073","MoKα","","0.0678","0.063","","","0.1439","0.146","","","","","","1.158","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500484","5.6238","0.0002","7.3489","0.0003","12.9709","0.0005","90.821","0.002","96.912","0.002","100.159","0.002","523.48","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","La-Sulfate","","","- C5 H5 La N O9 S2 -","- C5 H5 La N O9 S2 -","- C10 H10 La2 N2 O18 S4 -","2","1","","Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan","Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties","Crystal Growth & Design","2011","11","4","1347","","10.1021/cg101589d","","","0.71073","MoKα","","0.0163","0.0161","","","0.0438","0.0439","","","","","","1.141","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500485","5.0354","0.0001","7.0079","0.0001","16.6321","0.0003","88.5","","87.94","","75.47","","567.679","0.017","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Pr-Sulfate","","","- C5 H5 N O10 Pr S2 -","- C5 H5 N O10 Pr S2 -","- C10 H10 N2 O20 Pr2 S4 -","2","1","","Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan","Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties","Crystal Growth & Design","2011","11","4","1347","","10.1021/cg101589d","","","0.71073","MoKα","","0.0182","0.0175","","","0.0487","0.049","","","","","","1.12","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500486","8.0119","0.0005","9.4075","0.0006","14.9538","0.0009","79.439","0.001","83.749","0.001","73.988","0.001","1062.99","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Nd-Sulfate","","","- C10 H10 N2 Nd2 O18 S4 -","- C10 H10 N2 Nd2 O18 S4 -","- C20 H20 N4 Nd4 O36 S8 -","2","1","","Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan","Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties","Crystal Growth & Design","2011","11","4","1347","","10.1021/cg101589d","","","0.71073","MoKα","","0.0249","0.0215","","","0.0538","0.0551","","","","","","1.079","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500487","7.9585","0.0002","9.3752","0.0003","14.927","0.0004","79.327","0.002","83.927","0.002","73.83","0.002","1049.44","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Sm-Sulfate","","","- C10 H10 N2 O18 S4 Sm2 -","- C10 H10 N2 O18 S4 Sm2 -","- C20 H20 N4 O36 S8 Sm4 -","2","1","","Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan","Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties","Crystal Growth & Design","2011","11","4","1347","","10.1021/cg101589d","","","0.71073","MoKα","","0.0438","0.042","","","0.1141","0.1154","","","","","","1.042","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500488","7.937","0.0006","9.3612","0.0007","14.9214","0.001","79.348","0.001","83.996","0.001","73.777","0.001","1044.52","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Eu-Sulfate","","","- C10 H10 Eu2 N2 O18 S4 -","- C10 H10 Eu2 N2 O18 S4 -","- C20 H20 Eu4 N4 O36 S8 -","2","1","","Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan","Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties","Crystal Growth & Design","2011","11","4","1347","","10.1021/cg101589d","","","0.71073","MoKα","","0.0542","0.0534","","","0.14","0.1412","","","","","","1.085","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500489","16.3706","0.0008","16.3706","0.0008","22.5362","0.0014","90","","90","","120","","5230.5","0.5","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","Cu-Nitroisophthalate","","","- C9 H5 Cu N3 O6 -","- C9 H5 Cu N3 O6 -","- C162 H90 Cu18 N54 O108 -","18","1","","Sarma, Debajit; Ramanujachary, K. V.; Stock, Norbert; Natarajan, Srinivasan","High-Throughput Study of the Cu(CH3COO)2·H2O−5-Nitroisophthalic Acid−Heterocyclic Ligand System: Synthesis, Structure, Magnetic, and Heterogeneous Catalytic Studies of Three Copper Nitroisophthalates","Crystal Growth & Design","2011","11","4","1357","","10.1021/cg1015934","","","0.71073","MoKα","","0.033","0.0278","","","0.0837","0.085","","","","","","1.107","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500490","10.0134","0.0002","6.5861","0.0002","11.4842","0.0003","90","","90.144","0.002","90","","757.37","0.03","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","Cu-Nitroisophthalate","","","- C9 H5 Cu2 N5 O10 -","- C9 H4 Cu2 N5 O10 -","- C18 H8 Cu4 N10 O20 -","2","0.5","","Sarma, Debajit; Ramanujachary, K. V.; Stock, Norbert; Natarajan, Srinivasan","High-Throughput Study of the Cu(CH3COO)2·H2O−5-Nitroisophthalic Acid−Heterocyclic Ligand System: Synthesis, Structure, Magnetic, and Heterogeneous Catalytic Studies of Three Copper Nitroisophthalates","Crystal Growth & Design","2011","11","4","1357","","10.1021/cg1015934","","","0.71073","MoKα","","0.0596","0.0505","","","0.1233","0.1254","","","","","","1.237","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500491","6.4094","0.0015","14.857","0.004","16.066","0.005","90","","90","","90","","1529.9","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Cu-Nitroisophthalate","","","- C9 H5 Cu2 N6 O10 -","- C9 H5 Cu2 N6 O10 -","- C36 H20 Cu8 N24 O40 -","4","1","","Sarma, Debajit; Ramanujachary, K. V.; Stock, Norbert; Natarajan, Srinivasan","High-Throughput Study of the Cu(CH3COO)2·H2O−5-Nitroisophthalic Acid−Heterocyclic Ligand System: Synthesis, Structure, Magnetic, and Heterogeneous Catalytic Studies of Three Copper Nitroisophthalates","Crystal Growth & Design","2011","11","4","1357","","10.1021/cg1015934","","","0.71073","MoKα","","0.0656","0.049","","","0.1113","0.1216","","","","","","1.042","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500492","8.256","0.001","9.084","0.001","10.619","0.001","103.73","0.01","102.17","0.01","102.31","0.01","726.62","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H13 N5 O6 -","- C13 H13 N5 O6 -","- C26 H26 N10 O12 -","2","1","","Marivel, S.; Arunachalam, M.; Ghosh, Pradyut","Binding of Polyatomic Anions with Protonated Ureido-pyridyl Ligands","Crystal Growth & Design","2011","11","5","1642","","10.1021/cg101595n","","","0.71073","MoKα","","0.0352","0.0313","","","0.091","0.0955","","","","","","1.058","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500493","8.586","0.005","10.343","0.006","10.905","0.001","113.51","0.01","108.28","0.01","99.45","0.001","795.3","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H13 Cl N4 O7 -","- C13 H13 Cl N4 O7 -","- C26 H26 Cl2 N8 O14 -","2","1","","Marivel, S.; Arunachalam, M.; Ghosh, Pradyut","Binding of Polyatomic Anions with Protonated Ureido-pyridyl Ligands","Crystal Growth & Design","2011","11","5","1642","","10.1021/cg101595n","","","0.71073","MoKα","","0.0679","0.0511","","","0.1409","0.1764","","","","","","1.14","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500494","6.385","0.001","7.828","0.001","14.914","0.002","104.36","0.01","100.1","0.01","93.24","0.01","707.03","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H26 F6 N8 O6 Si -","- C26 H26 F6 N8 O6 Si -","- C26 H26 F6 N8 O6 Si -","1","0.5","","Marivel, S.; Arunachalam, M.; Ghosh, Pradyut","Binding of Polyatomic Anions with Protonated Ureido-pyridyl Ligands","Crystal Growth & Design","2011","11","5","1642","","10.1021/cg101595n","","","0.71073","MoKα","","0.03","0.0278","","","0.0736","0.0755","","","","","","1.002","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500495","10.198","0.002","10.25","0.002","16.458","0.003","87.78","0.01","77.01","0.01","72.99","0.01","1602.3","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H21 F10 N9 O9 -","- C27 H21 F10 N9 O9 -","- C54 H42 F20 N18 O18 -","2","1","","Marivel, S.; Arunachalam, M.; Ghosh, Pradyut","Binding of Polyatomic Anions with Protonated Ureido-pyridyl Ligands","Crystal Growth & Design","2011","11","5","1642","","10.1021/cg101595n","","","0.71073","MoKα","","0.0748","0.0439","","","0.0977","0.1115","","","","","","1.035","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500496","10.956","0.001","17.701","0.001","7.498","0.001","90","","90","","90","","1454.1","0.2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H10 F5 N3 O3 -","- C14 H10 F5 N3 O3 -","- C56 H40 F20 N12 O12 -","4","1","","Marivel, S.; Arunachalam, M.; Ghosh, Pradyut","Binding of Polyatomic Anions with Protonated Ureido-pyridyl Ligands","Crystal Growth & Design","2011","11","5","1642","","10.1021/cg101595n","","","0.71073","MoKα","","0.0252","0.0239","","","0.0609","0.0618","","","","","","1.036","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500497","7.789","0.001","18.282","0.002","18.558","0.002","90","","90","","90","","2642.6","0.5","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H14 F10 N6 O6 S -","- C24 H14 F10 N6 O6 S -","- C96 H56 F40 N24 O24 S4 -","4","1","","Marivel, S.; Arunachalam, M.; Ghosh, Pradyut","Binding of Polyatomic Anions with Protonated Ureido-pyridyl Ligands","Crystal Growth & Design","2011","11","5","1642","","10.1021/cg101595n","","","0.71073","MoKα","","0.0393","0.0328","","","0.0713","0.0746","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500498","12.2939","0.0001","16.2197","0.0002","13.8075","0.0002","90","","95.703","0.001","90","","2739.63","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H48 Cd2 N8 O19 -","- C52 H48 Cd2 N8 O19 -","- C104 H96 Cd4 N16 O38 -","2","0.5","","Gong, Yun; Li, Jian; Qin, JianBo; Wu, Tao; Cao, Rong; Li, JingHua","Metal(II) Coordination Polymers Derived from Bis-pyridyl-bis-amide Ligands and Carboxylates: Syntheses, Topological Structures, and Photoluminescence Properties","Crystal Growth & Design","2011","11","5","1662","","10.1021/cg1016005","","","0.71073","MoKα","","0.0317","0.025","","","0.0811","0.083","","","","","","1.039","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500499","16.2998","0.0005","9.1813","0.0002","18.2724","0.0006","90","","113.5","0.004","90","","2507.72","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 Cd N4 O6 -","- C26 H24 Cd N4 O6 -","- C104 H96 Cd4 N16 O24 -","4","1","","Gong, Yun; Li, Jian; Qin, JianBo; Wu, Tao; Cao, Rong; Li, JingHua","Metal(II) Coordination Polymers Derived from Bis-pyridyl-bis-amide Ligands and Carboxylates: Syntheses, Topological Structures, and Photoluminescence Properties","Crystal Growth & Design","2011","11","5","1662","","10.1021/cg1016005","","","0.71073","MoKα","","0.0567","0.0332","","","0.0911","0.0963","","","","","","1.042","","","","has coordinates","179535","2020-10-21","18:00:00",""
"4500500","29.482","0.011","9.779","0.003","18.036","0.007","90","","101.689","0.006","90","","5092","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H28 N9 O13 S2 Zn2 -","- C51 H28 N9 O13 S2 Zn2 -","- C204 H112 N36 O52 S8 Zn8 -","4","0.5","","Gong, Yun; Li, Jian; Qin, JianBo; Wu, Tao; Cao, Rong; Li, JingHua","Metal(II) Coordination Polymers Derived from Bis-pyridyl-bis-amide Ligands and Carboxylates: Syntheses, Topological Structures, and Photoluminescence Properties","Crystal Growth & Design","2011","11","5","1662","","10.1021/cg1016005","","","0.71073","MoKα","","0.0763","0.0609","","","0.1451","0.1577","","","","","","1.099","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500501","12.341","0.0011","14.0421","0.0013","11.43","0.001","90","","96.641","0.005","90","","1967.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 N3 O7 S Zn -","- C16 H12 N3 O7 S Zn -","- C64 H48 N12 O28 S4 Zn4 -","4","1","","Gong, Yun; Li, Jian; Qin, JianBo; Wu, Tao; Cao, Rong; Li, JingHua","Metal(II) Coordination Polymers Derived from Bis-pyridyl-bis-amide Ligands and Carboxylates: Syntheses, Topological Structures, and Photoluminescence Properties","Crystal Growth & Design","2011","11","5","1662","","10.1021/cg1016005","","","0.71073","MoKα","","0.0341","0.0309","","","0.0836","0.0858","","","","","","1.116","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500502","20.3856","0.0005","13.8293","0.0003","13.1563","0.0004","90","","103.632","0.003","90","","3604.52","0.17","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H44 Cd2 N12 O14 -","- C62 H44 Cd2 N12 O14 -","- C124 H88 Cd4 N24 O28 -","2","0.25","","Gong, Yun; Li, Jian; Qin, JianBo; Wu, Tao; Cao, Rong; Li, JingHua","Metal(II) Coordination Polymers Derived from Bis-pyridyl-bis-amide Ligands and Carboxylates: Syntheses, Topological Structures, and Photoluminescence Properties","Crystal Growth & Design","2011","11","5","1662","","10.1021/cg1016005","","","0.71073","MoKα","","0.0553","0.0423","","","0.1808","0.185","","","","","","1.315","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500503","9.5894","0.0003","18.8609","0.0004","13.2876","0.0004","90","","106.102","0.003","90","","2308.98","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 N4 O6 Zn -","- C26 H18 N4 O6 Zn -","- C104 H72 N16 O24 Zn4 -","4","1","","Gong, Yun; Li, Jian; Qin, JianBo; Wu, Tao; Cao, Rong; Li, JingHua","Metal(II) Coordination Polymers Derived from Bis-pyridyl-bis-amide Ligands and Carboxylates: Syntheses, Topological Structures, and Photoluminescence Properties","Crystal Growth & Design","2011","11","5","1662","","10.1021/cg1016005","","","0.71073","MoKα","","0.0504","0.0333","","","0.0869","0.0911","","","","","","1","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500504","9.253","0.004","21.321","0.01","23.611","0.012","90","","90","","90","","4658","4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H69 N7 O11 S -","- C37 H69 N7 O11 S -","- C148 H276 N28 O44 S4 -","4","1","","Duley, Anju; Nethaji, Munirathinam; Ramanathan, Gurunath","A Change in the 310- to α-Helical Transition Point in the Heptapeptides Containing Sulfur and Selenium","Crystal Growth & Design","2011","11","6","2238","","10.1021/cg101604g","","","0.71073","MoKα","","0.1641","0.0694","","","0.1322","0.1752","","","","","","0.942","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500505","11.939","0.002","16.031","0.003","24.64","0.003","90","","90","","90","","4716","1.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H73 N7 O13 Se -","- C37 H73 N7 O13 Se -","- C148 H292 N28 O52 Se4 -","4","1","","Duley, Anju; Nethaji, Munirathinam; Ramanathan, Gurunath","A Change in the 310- to α-Helical Transition Point in the Heptapeptides Containing Sulfur and Selenium","Crystal Growth & Design","2011","11","6","2238","","10.1021/cg101604g","","","0.71073","MoKα","","0.0822","0.0579","","","0.1207","0.1351","","","","","","1.008","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500506","22.41","0.002","9.218","0.003","23.588","0.002","90","","90","","90","","4872.7","1.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H71 N7 O11 S -","- C42 H71 N7 O11 S -","- C168 H284 N28 O44 S4 -","4","1","","Duley, Anju; Nethaji, Munirathinam; Ramanathan, Gurunath","A Change in the 310- to α-Helical Transition Point in the Heptapeptides Containing Sulfur and Selenium","Crystal Growth & Design","2011","11","6","2238","","10.1021/cg101604g","","","0.71073","MoKα","","0.0893","0.0598","","","0.1281","0.1601","","","","","","1.04","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500507","5.2586","0.0007","11.7922","0.0014","51.155","0.007","90","","90","","90","","3172.1","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3694-25-06 (209739)","","- C36 H42 N2 O6 -","- C36 H42 N2 O6 -","- C144 H168 N8 O24 -","4","1","","Bethune, Sarah J.; Schultheiss, Nate; Henck, Jan-Olav","Improving the Poor Aqueous Solubility of Nutraceutical Compound Pterostilbene through Cocrystal Formation","Crystal Growth & Design","2011","11","7","2817","","10.1021/cg1016092","","","0.71073","MoKα","","0.1713","0.0545","","","0.0948","0.1255","","","","","","0.967","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500508","7.2644","0.0003","32.8801","0.0016","7.9819","0.0004","90","","96","0.002","90","","1896.07","0.15","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","213357 (3694-54-01)","","- C21 H24 O7 -","- C21 H24 O7 -","- C84 H96 O28 -","4","1","","Bethune, Sarah J.; Schultheiss, Nate; Henck, Jan-Olav","Improving the Poor Aqueous Solubility of Nutraceutical Compound Pterostilbene through Cocrystal Formation","Crystal Growth & Design","2011","11","7","2817","","10.1021/cg1016092","","","0.71073","MoKα","","0.066","0.0472","","","0.1224","0.1396","","","","","","1.086","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500509","9.6721","0.0019","9.6817","0.0019","7.7419","0.0015","99.39","0.03","104.54","0.03","60.72","0.03","611.4","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H9 Na O9 Zn -","- C9 H9.08 Na O9.04 Zn -","- C18 H18.16 Na2 O18.08 Zn2 -","2","1","","Fu, Ying; Su, Jie; Yang, Sihai; Zou, Zhibo; Li, Guobao; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses, Structures, and Structural Transformations of Mixed Na(I) and Zn(II) Metal‒Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands","Crystal Growth & Design","2011","11","6","2243","","10.1021/cg101610k","","","0.71073","MoKα","","0.0734","0.068","","","0.2192","0.23","","","","","","1.007","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500510","7.5112","0.0015","19.151","0.004","21.213","0.004","90","","93.42","0.03","90","","3046","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 Na2 O24 Zn3 -","- C20 H24 Na2 O24 Zn3 -","- C80 H96 Na8 O96 Zn12 -","4","0.5","","Fu, Ying; Su, Jie; Yang, Sihai; Zou, Zhibo; Li, Guobao; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses, Structures, and Structural Transformations of Mixed Na(I) and Zn(II) Metal‒Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands","Crystal Growth & Design","2011","11","6","2243","","10.1021/cg101610k","","","0.71073","MoKα","","0.0842","0.0688","","","0.2245","0.2509","","","","","","1.008","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500511","7.9024","0.0016","9.3784","0.0019","9.7093","0.0019","61.65","0.03","71.6","0.03","80.38","0.03","600.8","0.3","298","2","298","2","","","","","","","","5","P 1","P 1","1","","","","- C19 H17 Na O19 Zn3 -","- C19 H17 Na O19 Zn3 -","- C19 H17 Na O19 Zn3 -","1","1","","Fu, Ying; Su, Jie; Yang, Sihai; Zou, Zhibo; Li, Guobao; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses, Structures, and Structural Transformations of Mixed Na(I) and Zn(II) Metal‒Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands","Crystal Growth & Design","2011","11","6","2243","","10.1021/cg101610k","","","0.71073","MoKα","","0.035","0.0308","","","0.0798","0.0823","","","","","","1.002","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500512","7.3529","0.0015","19.332","0.004","16.542","0.003","90","","99","0.03","90","","2322.4","0.8","383","2","383","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Na2 O18 Zn3 -","- C20 H12 Na2 O18 Zn3 -","- C80 H48 Na8 O72 Zn12 -","4","0.5","","Fu, Ying; Su, Jie; Yang, Sihai; Zou, Zhibo; Li, Guobao; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses, Structures, and Structural Transformations of Mixed Na(I) and Zn(II) Metal‒Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands","Crystal Growth & Design","2011","11","6","2243","","10.1021/cg101610k","","","0.71073","MoKα","","0.1307","0.1041","","","0.2638","0.2817","","","","","","1.033","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500513","7.3847","0.0017","15.339","0.004","23.11","0.005","90","","90","","90","","2617.8","1.1","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H10 Co O5 -","- C14 H10 Co O5 -","- C112 H80 Co8 O40 -","8","1","","Yi, Xiao-Yi; Fang, Hua-Cai; Gu, Zhi-Gang; Zhou, Zheng-Yuan; Cai, Yue-Peng; Tian, Jian; Thallapally, Praveen K.","Metal‒Organic Frameworks with Achiral/Monochiral Nano-Channels","Crystal Growth & Design","2011","11","7","2824","","10.1021/cg101618n","","","0.71073","MoKα","","0.0641","0.0476","","","0.1351","0.1513","","","","","","1.03","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500514","24.058","0.006","6.8774","0.0016","7.7918","0.0018","90","","90","","90","","1289.2","0.5","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C14 H10 Co O5 -","- C14 H10 Co O5 -","- C56 H40 Co4 O20 -","4","1","","Yi, Xiao-Yi; Fang, Hua-Cai; Gu, Zhi-Gang; Zhou, Zheng-Yuan; Cai, Yue-Peng; Tian, Jian; Thallapally, Praveen K.","Metal‒Organic Frameworks with Achiral/Monochiral Nano-Channels","Crystal Growth & Design","2011","11","7","2824","","10.1021/cg101618n","","","0.71073","MoKα","","0.03","0.0249","","","0.0544","0.0569","","","","","","1.067","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500515","6.3985","0.0009","19.848","0.003","21.634","0.003","90","","90","","90","","2747.5","0.7","298","2","298","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C28 H22 Co3 O12 -","- C28 H22 Co3 O12 -","- C112 H88 Co12 O48 -","4","0.5","","Yi, Xiao-Yi; Fang, Hua-Cai; Gu, Zhi-Gang; Zhou, Zheng-Yuan; Cai, Yue-Peng; Tian, Jian; Thallapally, Praveen K.","Metal‒Organic Frameworks with Achiral/Monochiral Nano-Channels","Crystal Growth & Design","2011","11","7","2824","","10.1021/cg101618n","","","0.71073","MoKα","","0.0225","0.0209","","","0.0506","0.0513","","","","","","1.073","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500516","7.7688","0.0002","8.2084","0.0003","16.5067","0.0005","84.082","0.001","76.977","0.001","79.126","0.001","1005.11","0.05","295","2","295","2","","","","","","","","4","P -1","-P 1","2","2,2'-dithiobisbenzoic acid-2-mercaptobenzoic acid","2,2'-disulfanediyldibenzoic acid-2-sulfanylbenzoic acid","","- C21 H15 O6 S3 -","- C21 H15 O6 S3 -","- C42 H30 O12 S6 -","2","1","","Rowland, Clare E.; Cantos, Paula M.; Toby, Brian H.; Frisch, Mark; Deschamps, Jeffrey R.; Cahill, Christopher L.","Controlling Disulfide Bond Formation and Crystal Growth from 2-Mercaptobenzoic Acid","Crystal Growth & Design","2011","11","4","1370","","10.1021/cg101619y","","","0.71073","MoKα","","0.0772","0.0433","","","0.1076","0.1235","","","","","","1.017","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500517","16.53569","0.00017","12.81311","0.00017","20.98335","0.00021","90","","104.888","0.0014","90","","4296.56","0.09","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2,2'-dithiobisbenzoic acid","2,2'-disulfanediyldibenzoic acid","","- C7 H5 O2 S -","- C7 H5 O2 S -","- C168 H120 O48 S24 -","24","3","","Rowland, Clare E.; Cantos, Paula M.; Toby, Brian H.; Frisch, Mark; Deschamps, Jeffrey R.; Cahill, Christopher L.","Controlling Disulfide Bond Formation and Crystal Growth from 2-Mercaptobenzoic Acid","Crystal Growth & Design","2011","11","4","1370","","10.1021/cg101619y","powder diffraction","x-ray","0.413541","","","","","","","","","0.16296","","","","","","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500518","7.579","0.003","6.4","0.002","31.984","0.006","90","","90","","90","","1551.4","0.8","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C4 H4 Cd Cl N3 O2 -","- C4 H4 Cd Cl N3 O2 -","- C32 H32 Cd8 Cl8 N24 O16 -","8","2","","Dirtu, Marinela M.; Neuhausen, Christine; Naik, Anil D.; Léonard, Alexandre; Robert, Francois; Marchand-Brynaert, Jacqueline; Su, Bao-Lian; Garcia, Yann","Superlative Scaffold of 1,2,4-Triazole Derivative of Glycine Steering Linear Chain to a Chiral Helicate","Crystal Growth & Design","2011","11","4","1375","","10.1021/cg101634w","","","0.71073","MoKα","","0.0333","0.0226","","","0.0473","0.0488","","","","","","1.079","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500519","12.164","0.002","7.6685","0.0015","15.945","0.003","90","","101.51","0.03","90","","1457.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 Cd Cl N6 O6 -","- C8 H8 Cd Cl N6 O6 -","- C32 H32 Cd4 Cl4 N24 O24 -","4","1","","Dirtu, Marinela M.; Neuhausen, Christine; Naik, Anil D.; Léonard, Alexandre; Robert, Francois; Marchand-Brynaert, Jacqueline; Su, Bao-Lian; Garcia, Yann","Superlative Scaffold of 1,2,4-Triazole Derivative of Glycine Steering Linear Chain to a Chiral Helicate","Crystal Growth & Design","2011","11","4","1375","","10.1021/cg101634w","","","0.71073","MoKα","","0.0548","0.0436","","","0.1134","0.1187","","","","","","1.037","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500520","7.719","0.0002","16.7675","0.0005","12.0414","0.0003","90","","99.798","0.001","90","","1535.77","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(cafH+).(fsu-)","caffeinium tetrafluorosuccinate","","- C12 H12 F4 N4 O6 -","- C12 H12 F4 N4 O6 -","- C48 H48 F16 N16 O24 -","4","1","","Friščić, Tomislav; Reid, David G.; Day, Graeme M.; Duer, Melinda J.; Jones, William","Effect of Fluorination on Molecular Conformation in the Solid State: Tuning the Conformation of Cocrystal Formers","Crystal Growth & Design","2011","11","4","972","","10.1021/cg1016388","","","0.71073","MoKα","","0.0693","0.0436","","","0.1037","0.115","","","","","","1.028","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500521","9.8232","0.0002","13.2644","0.0003","11.2546","0.0003","90","","112.692","0.001","90","","1352.95","0.06","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(caf)2.(Hfad)","caffeine:octafluoroadipic acid 2/1","","- C22 H22 F8 N8 O8 -","- C22 H22 F8 N8 O8 -","- C44 H44 F16 N16 O16 -","2","0.5","","Friščić, Tomislav; Reid, David G.; Day, Graeme M.; Duer, Melinda J.; Jones, William","Effect of Fluorination on Molecular Conformation in the Solid State: Tuning the Conformation of Cocrystal Formers","Crystal Growth & Design","2011","11","4","972","","10.1021/cg1016388","","","0.71073","MoKα","","0.06","0.0465","","","0.1343","0.1447","","","","","","1.069","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500522","10.6924","0.0002","11.6169","0.0002","22.441","0.0003","90","","90","","90","","2787.45","0.08","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Hfsu.H2O","tetrafluorosuccinic acid monohydrate","","- C4 H4 F4 O5 -","- C4 H4 F4 O5 -","- C64 H64 F64 O80 -","16","2","","Friščić, Tomislav; Reid, David G.; Day, Graeme M.; Duer, Melinda J.; Jones, William","Effect of Fluorination on Molecular Conformation in the Solid State: Tuning the Conformation of Cocrystal Formers","Crystal Growth & Design","2011","11","4","972","","10.1021/cg1016388","","","0.71073","MoKα","","0.0653","0.0381","","","0.1032","0.1243","","","","","","1.13","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500523","7.7939","0.0019","12.52","0.003","29.982","0.007","90","","92.952","0.004","90","","2921.8","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 Eu N4 O13 Zn -","- C26 H21 Eu N4 O13 Zn -","- C104 H84 Eu4 N16 O52 Zn4 -","4","1","","Feng, Rui; Chen, Lian; Chen, Qi-Hui; Shan, Xiao-Chen; Gai, Yan-Li; Jiang, Fei-Long; Hong, Mao-Chun","Novel Luminescent Three-Dimensional Heterometallic Complexes with 2-Fold Interpenetrating (3,6)-Connected Nets","Crystal Growth & Design","2011","11","5","1705","","10.1021/cg101642j","","","0.71073","MoKα","","0.0579","0.0473","","","0.1023","0.108","","","","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500524","7.794","0.003","12.535","0.005","30.012","0.012","90","","92.953","0.005","90","","2928","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 N4 O13 Sm Zn -","- C26 H19 N4 O13 Sm Zn -","- C104 H76 N16 O52 Sm4 Zn4 -","4","1","","Feng, Rui; Chen, Lian; Chen, Qi-Hui; Shan, Xiao-Chen; Gai, Yan-Li; Jiang, Fei-Long; Hong, Mao-Chun","Novel Luminescent Three-Dimensional Heterometallic Complexes with 2-Fold Interpenetrating (3,6)-Connected Nets","Crystal Growth & Design","2011","11","5","1705","","10.1021/cg101642j","","","0.71073","MoKα","","0.0597","0.0504","","","0.1099","0.1158","","","","","","1.109","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500525","7.819","0.002","12.561","0.003","29.962","0.007","90","","92.663","0.005","90","","2939.5","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 N4 Nd O13 Zn -","- C26 H19 N4 Nd O13 Zn -","- C104 H76 N16 Nd4 O52 Zn4 -","4","1","","Feng, Rui; Chen, Lian; Chen, Qi-Hui; Shan, Xiao-Chen; Gai, Yan-Li; Jiang, Fei-Long; Hong, Mao-Chun","Novel Luminescent Three-Dimensional Heterometallic Complexes with 2-Fold Interpenetrating (3,6)-Connected Nets","Crystal Growth & Design","2011","11","5","1705","","10.1021/cg101642j","","","0.71073","MoKα","","0.0476","0.0396","","","0.0826","0.087","","","","","","1.085","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500526","7.766","0.003","12.471","0.005","29.941","0.013","90","","93.191","0.008","90","","2895","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 Dy N4 O13 Zn -","- C26 H19 Dy N4 O13 Zn -","- C104 H76 Dy4 N16 O52 Zn4 -","4","1","","Feng, Rui; Chen, Lian; Chen, Qi-Hui; Shan, Xiao-Chen; Gai, Yan-Li; Jiang, Fei-Long; Hong, Mao-Chun","Novel Luminescent Three-Dimensional Heterometallic Complexes with 2-Fold Interpenetrating (3,6)-Connected Nets","Crystal Growth & Design","2011","11","5","1705","","10.1021/cg101642j","","","0.71073","MoKα","","0.1203","0.0848","","","0.1601","0.1792","","","","","","1.146","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500527","7.747","0.0017","12.44","0.003","29.949","0.007","90","","93.328","0.004","90","","2881.4","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 Er N4 O13 Zn -","- C26 H19 Er N4 O13 Zn -","- C104 H76 Er4 N16 O52 Zn4 -","4","1","","Feng, Rui; Chen, Lian; Chen, Qi-Hui; Shan, Xiao-Chen; Gai, Yan-Li; Jiang, Fei-Long; Hong, Mao-Chun","Novel Luminescent Three-Dimensional Heterometallic Complexes with 2-Fold Interpenetrating (3,6)-Connected Nets","Crystal Growth & Design","2011","11","5","1705","","10.1021/cg101642j","","","0.71073","MoKα","","0.0466","0.0389","","","0.0898","0.0953","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500528","7.777","0.002","12.488","0.003","29.956","0.008","90","","93.123","0.004","90","","2905","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 N4 O13 Tb Zn -","- C26 H19 N4 O13 Tb Zn -","- C104 H76 N16 O52 Tb4 Zn4 -","4","1","","Feng, Rui; Chen, Lian; Chen, Qi-Hui; Shan, Xiao-Chen; Gai, Yan-Li; Jiang, Fei-Long; Hong, Mao-Chun","Novel Luminescent Three-Dimensional Heterometallic Complexes with 2-Fold Interpenetrating (3,6)-Connected Nets","Crystal Growth & Design","2011","11","5","1705","","10.1021/cg101642j","","","0.71073","MoKα","","0.063","0.0459","","","0.0987","0.1086","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500529","12.04226","0.00017","23.22101","0.00029","5.81899","0.00015","90","","90","","90","","1627.18","0.05","293","","293","","","","","","","","","4","P 21 n b","P -2bc 2a","33","","","","- C2 Ca O9 P -","- C2 Ca O9 P -","- C16 Ca8 O72 P8 -","8","2","","Colodrero, Rosario M. P.; Cabeza, Aurelio; Olivera-Pastor, Pascual; Papadaki, Maria; Rius, Jordi; Choquesillo-Lazarte, Duane; García-Ruiz, Juan M.; Demadis, Konstantinos D.; Aranda, Miguel A. G.","Common Structural Features in Calcium Hydroxyphosphonoacetates. A High-Throughput Screening","Crystal Growth & Design","2011","11","5","1713","","10.1021/cg101652e","powder diffraction","x-ray","1.5406","","","","","","","","","0.0924","","3.16","","","","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500530","29.7116","0.0004","8.84842","0.00009","11.31039","0.00009","90","","93.24","0.0008","90","","2968.76","0.06","293","","293","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C8 Ca5 O30 P4 -","- C8 Ca5 O30 P4 -","- C32 Ca20 O120 P16 -","4","0.5","","Colodrero, Rosario M. P.; Cabeza, Aurelio; Olivera-Pastor, Pascual; Papadaki, Maria; Rius, Jordi; Choquesillo-Lazarte, Duane; García-Ruiz, Juan M.; Demadis, Konstantinos D.; Aranda, Miguel A. G.","Common Structural Features in Calcium Hydroxyphosphonoacetates. A High-Throughput Screening","Crystal Growth & Design","2011","11","5","1713","","10.1021/cg101652e","powder diffraction","x-ray","0.2998","","","","","","","","","0.13181","","4.02","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500531","10.11879","0.00025","8.5936","0.00019","6.07574","0.00016","90","","92.4396","0.0016","90","","527.85","0.02","293","","293","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C2 Ca Li O6 P -","- C2 Ca Li O6 P -","- C8 Ca4 Li4 O24 P4 -","4","1","","Colodrero, Rosario M. P.; Cabeza, Aurelio; Olivera-Pastor, Pascual; Papadaki, Maria; Rius, Jordi; Choquesillo-Lazarte, Duane; García-Ruiz, Juan M.; Demadis, Konstantinos D.; Aranda, Miguel A. G.","Common Structural Features in Calcium Hydroxyphosphonoacetates. A High-Throughput Screening","Crystal Growth & Design","2011","11","5","1713","","10.1021/cg101652e","powder diffraction","x-ray","1.5406","","","","","","","","","0.08546","","1.48","","","","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500532","6.64","0.0007","8.7164","0.0009","11.5047","0.0012","76.174","0.001","89.574","0.001","75.524","0.001","625.07","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H10 Ca4 Na2 O27 P4 -","- C8 H10 Ca4 Na2 O27 P4 -","- C8 H10 Ca4 Na2 O27 P4 -","1","0.5","","Colodrero, Rosario M. P.; Cabeza, Aurelio; Olivera-Pastor, Pascual; Papadaki, Maria; Rius, Jordi; Choquesillo-Lazarte, Duane; García-Ruiz, Juan M.; Demadis, Konstantinos D.; Aranda, Miguel A. G.","Common Structural Features in Calcium Hydroxyphosphonoacetates. A High-Throughput Screening","Crystal Growth & Design","2011","11","5","1713","","10.1021/cg101652e","","","0.71073","MoKα","","0.0585","0.056","","","0.1532","0.1545","","","","","","1.194","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500533","14.896","0.003","21.236","0.003","30.962","0.005","90","","90","","90","","9794","3","296","2","296","2","500000","","","","","","","5","P b c a","-P 2ac 2ab","61","dabcoHI hydarte","1,4-diazabicyclo[2.2.2]octanium iodide hydrate","","- C30 H75 I5 N10 O5 -","- C30 H73 I5 N10 O5 -","- C240 H584 I40 N80 O40 -","8","1","","Olejniczak, Anna; Katrusiak, Andrzej","Pressure-Induced Hydration of 1,4-Diazabicyclo[2.2.2]octane Hydroiodide (dabcoHI)","Crystal Growth & Design","2011","11","6","2250","","10.1021/cg101653x","","","0.71073","MoKα","","0.2167","0.1822","","","0.3019","0.3151","","","","","","1.421","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500534","10.731","0.0011","8.2648","0.0014","9.6593","0.0017","90","","90","","90","","856.7","0.2","296","2","296","2","1400000","","","","","","","5","P n m a","-P 2ac 2n","62","dabcoHI hydarte","1,4-diazabicyclo[2.2.2]octanium iodide hydrate","","- C6 H15 I N2 O -","- C6 H15 I N2 O -","- C24 H60 I4 N8 O4 -","4","0.5","","Olejniczak, Anna; Katrusiak, Andrzej","Pressure-Induced Hydration of 1,4-Diazabicyclo[2.2.2]octane Hydroiodide (dabcoHI)","Crystal Growth & Design","2011","11","6","2250","","10.1021/cg101653x","","","0.71073","MoKα","","0.044","0.0402","","","0.0914","0.0931","","","","","","1.226","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500535","14.76","0.003","7.3471","0.0015","14.823","0.003","90","","112.13","0.03","90","","1489","0.6","8184","","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C5 H15 Cl5 N2 O Re -","- C5 H15 Cl5 N2 O Re -","- C20 H60 Cl20 N8 O4 Re4 -","4","0.5","","Martínez-Lillo, José; Armentano, Donatella; Mastropietro, Teresa F.; Julve, Miguel; Faus, Juan; De Munno, Giovanni","Self-Assembled One- and Two-Dimensional Networks Based on NH2Me2[ReX5(DMF)] (X = Cl and Br) Species: Polymorphism and Supramolecular Isomerism in Re(IV) Compounds","Crystal Growth & Design","2011","11","5","1733","","10.1021/cg101658a","","","0.71073","MoKα","","0.0145","0.0136","","","0.0416","0.0423","","","","","","0.928","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500536","6.7652","0.0014","7.4345","0.0015","14.424","0.003","90","","100.63","0.03","90","","713","0.3","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C5 H15 Cl5 N2 O Re -","- C5 H15 Cl5 N2 O Re -","- C10 H30 Cl10 N4 O2 Re2 -","2","0.5","","Martínez-Lillo, José; Armentano, Donatella; Mastropietro, Teresa F.; Julve, Miguel; Faus, Juan; De Munno, Giovanni","Self-Assembled One- and Two-Dimensional Networks Based on NH2Me2[ReX5(DMF)] (X = Cl and Br) Species: Polymorphism and Supramolecular Isomerism in Re(IV) Compounds","Crystal Growth & Design","2011","11","5","1733","","10.1021/cg101658a","","","0.71073","MoKα","","0.0433","0.0421","","","0.1217","0.1226","","","","","","1.081","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500537","28.5337","0.0015","7.679","0.0004","7.228","0.0004","90","","90","","90","","1583.73","0.15","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C5 H15 Br5 N2 O Re -","- C5 H15 Br5 N2 O Re -","- C20 H60 Br20 N8 O4 Re4 -","4","0.5","","Martínez-Lillo, José; Armentano, Donatella; Mastropietro, Teresa F.; Julve, Miguel; Faus, Juan; De Munno, Giovanni","Self-Assembled One- and Two-Dimensional Networks Based on NH2Me2[ReX5(DMF)] (X = Cl and Br) Species: Polymorphism and Supramolecular Isomerism in Re(IV) Compounds","Crystal Growth & Design","2011","11","5","1733","","10.1021/cg101658a","","","0.71073","MoKα","","0.0529","0.0341","","","0.0823","0.0926","","","","","","1.061","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500538","15.034","0.003","17.99","0.004","13.818","0.003","90","","101.78","0.03","90","","3658.5","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Co3 N14 O8 -","- C30 H24 Co3 N14 O8 -","- C120 H96 Co12 N56 O32 -","4","0.5","","Yang, Qian; Zhang, Xiao-Feng; Zhao, Jiong-Peng; Hu, Bo-Wen; Bu, Xian-He","Cobalt(II)‒Azido Coordination Polymers with Dicarboxylate and Di(1H-imidazol-1-yl)methane Ligands Exhibiting Ferromagnetic Behaviors","Crystal Growth & Design","2011","11","7","2839","","10.1021/cg1016615","","","0.71073","MoKα","","0.117","0.0722","","","0.0866","0.0953","","","","","","1.173","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500539","10.134","0.002","10.554","0.002","10.689","0.002","99.81","0.03","103.32","0.03","118.2","0.03","927","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H26 Co3 N14 O9 -","- C30 H26 Co3 N14 O9 -","- C30 H26 Co3 N14 O9 -","1","0.5","","Yang, Qian; Zhang, Xiao-Feng; Zhao, Jiong-Peng; Hu, Bo-Wen; Bu, Xian-He","Cobalt(II)‒Azido Coordination Polymers with Dicarboxylate and Di(1H-imidazol-1-yl)methane Ligands Exhibiting Ferromagnetic Behaviors","Crystal Growth & Design","2011","11","7","2839","","10.1021/cg1016615","","","0.71073","MoKα","","0.053","0.0381","","","0.0869","0.0923","","","","","","1.089","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500540","9.833","0.002","12.23","0.002","12.764","0.003","90","","95.47","0.03","90","","1528","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Co N7 O3 -","- C12 H14 Co N7 O3 -","- C48 H56 Co4 N28 O12 -","4","1","","Yang, Qian; Zhang, Xiao-Feng; Zhao, Jiong-Peng; Hu, Bo-Wen; Bu, Xian-He","Cobalt(II)‒Azido Coordination Polymers with Dicarboxylate and Di(1H-imidazol-1-yl)methane Ligands Exhibiting Ferromagnetic Behaviors","Crystal Growth & Design","2011","11","7","2839","","10.1021/cg1016615","","","0.71073","MoKα","","0.1033","0.065","","","0.096","0.106","","","","","","1.127","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500541","6.9718","0.0005","18.1744","0.0013","8.9804","0.0007","90","","96.357","0.001","90","","1130.89","0.14","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H22 O11 Pb2 -","- C20 H22 O11 Pb2 -","- C40 H44 O22 Pb4 -","2","1","","Yang, Guo-Ping; Hou, Lei; Wang, Yao-Yu; Zhang, Ya-Nan; Shi, Qi-Zhen; Batten, Stuart R.","Two Unprecedented Three-Dimensional PbIIPolymorphs and Structural Diversities Built on a Kinked Flexible Dicarboxylate Building Block","Crystal Growth & Design","2011","11","4","936","","10.1021/cg101663a","","","0.71073","MoKα","","0.0374","0.0349","","","0.0767","0.0776","","","","","","1.006","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500542","9.1296","0.0008","10.226","0.0009","13.0963","0.0011","103.408","0.001","90.242","0.001","99.456","0.001","1172.03","0.18","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H22 O11 Pb2 -","- C20 H22 O11 Pb2 -","- C40 H44 O22 Pb4 -","2","1","","Yang, Guo-Ping; Hou, Lei; Wang, Yao-Yu; Zhang, Ya-Nan; Shi, Qi-Zhen; Batten, Stuart R.","Two Unprecedented Three-Dimensional PbIIPolymorphs and Structural Diversities Built on a Kinked Flexible Dicarboxylate Building Block","Crystal Growth & Design","2011","11","4","936","","10.1021/cg101663a","","","0.71073","MoKα","","0.0452","0.0318","","","0.0753","0.0784","","","","","","1.011","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500543","6.9383","0.0002","8.3245","0.0003","15.892","0.0006","97.13","","96.34","","91.74","","904.32","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H4 Co O20 P2 U2 -","- C4 H4 Co O20 P2 U2 -","- C8 H8 Co2 O40 P4 U4 -","2","1","","Alsobrook, Andrea N.; Hauser, Brad G.; Hupp, Joseph T.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","From Layered Structures to Cubic Frameworks: Expanding the Structural Diversity of Uranyl Carboxyphosphonates via the Incorporation of Cobalt","Crystal Growth & Design","2011","11","4","1385","","10.1021/cg101668f","","","0.71073","MoKα","","0.0208","0.0191","","","0.0474","0.0481","","","","","","1.102","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500544","20.573","0.0013","9.4979","0.0006","13.3841","0.0009","90","","105.219","0.001","90","","2523.5","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 Co O28 P2 U2 -","- C4 H4 Co O28 P2 U2 -","- C16 H16 Co4 O112 P8 U8 -","4","0.5","","Alsobrook, Andrea N.; Hauser, Brad G.; Hupp, Joseph T.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","From Layered Structures to Cubic Frameworks: Expanding the Structural Diversity of Uranyl Carboxyphosphonates via the Incorporation of Cobalt","Crystal Growth & Design","2011","11","4","1385","","10.1021/cg101668f","","","0.71073","MoKα","","0.0297","0.0281","","","0.0795","0.0808","","","","","","1.08","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500545","9.3568","0.0009","9.5026","0.001","12.1282","0.0012","90","","103.912","0.001","90","","1046.73","0.18","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H4 Co O22 P2 U2 -","- C4 H4 Co O22 P2 U2 -","- C8 H8 Co2 O44 P4 U4 -","2","0.5","","Alsobrook, Andrea N.; Hauser, Brad G.; Hupp, Joseph T.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","From Layered Structures to Cubic Frameworks: Expanding the Structural Diversity of Uranyl Carboxyphosphonates via the Incorporation of Cobalt","Crystal Growth & Design","2011","11","4","1385","","10.1021/cg101668f","","","0.71073","MoKα","","0.021","0.0194","","","0.0519","0.0528","","","","","","1.102","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500546","11.1148","0.0005","15.6485","0.0007","18.8376","0.0008","90","","92.647","0.001","90","","3272.9","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H4 Co0.5 O35.67 P2 U6 -","- C4 H4 Co0.5 O35.67 P2 U6 -","- C16 H16 Co2 O142.68 P8 U24 -","4","1","","Alsobrook, Andrea N.; Hauser, Brad G.; Hupp, Joseph T.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","From Layered Structures to Cubic Frameworks: Expanding the Structural Diversity of Uranyl Carboxyphosphonates via the Incorporation of Cobalt","Crystal Growth & Design","2011","11","4","1385","","10.1021/cg101668f","","","0.71073","MoKα","","0.0602","0.0445","","","0.0962","0.1028","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500547","26.3861","0.0003","26.3861","0.0003","26.3861","0.0003","90","","90","","90","","18370.7","0.4","100","2","100","2","","","","","","","","6","I m -3","-I 2 2 3","204","","","","- C6 H42 Co2 O49 P3 U6 -","- C6 H6 Co2 O47.375 P3 U6 -","- C96 H96 Co32 O758 P48 U96 -","16","0.333333","","Alsobrook, Andrea N.; Hauser, Brad G.; Hupp, Joseph T.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","From Layered Structures to Cubic Frameworks: Expanding the Structural Diversity of Uranyl Carboxyphosphonates via the Incorporation of Cobalt","Crystal Growth & Design","2011","11","4","1385","","10.1021/cg101668f","","","0.71073","MoKα","","0.0209","0.0176","","","0.042","0.0429","","","","","","1.076","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500548","20.159","0.003","18.84","0.003","21.336","0.003","90","","92.694","0.003","90","","8094","2","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C80 H60 F24 Mn3 N2 O16 -","- C80 H60 F24 Mn3 N2 O16 -","- C320 H240 F96 Mn12 N8 O64 -","4","0.5","","Wang, Xiqu; Liu, Lumei; Conato, Marlon; Jacobson, Allan J.","Amine-Templated Anionic Metal‒Organic Frameworks with the 4,4′-(Hexafluoroisopropylidene) Bis(benzoic acid) Ligand","Crystal Growth & Design","2011","11","6","2257","","10.1021/cg1016752","","","0.71073","MoKα","","0.1358","0.0579","","","0.0915","0.1199","","","","","","1.001","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500549","19.9107","0.0008","18.7741","0.0008","25.054","0.001","90","","108.434","0.001","90","","8884.8","0.6","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H74 Co3 F24 N2 O16 -","- C84 H70 Co3 F24 N2 O16 -","- C336 H280 Co12 F96 N8 O64 -","4","0.5","","Wang, Xiqu; Liu, Lumei; Conato, Marlon; Jacobson, Allan J.","Amine-Templated Anionic Metal‒Organic Frameworks with the 4,4′-(Hexafluoroisopropylidene) Bis(benzoic acid) Ligand","Crystal Growth & Design","2011","11","6","2257","","10.1021/cg1016752","","","0.71073","MoKα","","0.053","0.0362","","","0.0958","0.1015","","","","","","1.027","","","","has coordinates,has disorder","179536","2020-10-21","18:00:00",""
"4500550","13.4077","0.0008","25.5075","0.0016","13.7566","0.0009","90","","114.712","0.001","90","","4273.9","0.5","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C81 H58 Co3 F24 N2 O16 -","- C81 H58 Co3 F24 N2 O16 -","- C162 H116 Co6 F48 N4 O32 -","2","0.5","","Wang, Xiqu; Liu, Lumei; Conato, Marlon; Jacobson, Allan J.","Amine-Templated Anionic Metal‒Organic Frameworks with the 4,4′-(Hexafluoroisopropylidene) Bis(benzoic acid) Ligand","Crystal Growth & Design","2011","11","6","2257","","10.1021/cg1016752","","","0.71073","MoKα","","0.0647","0.0379","","","0.0839","0.0923","","","","","","0.867","","","","has coordinates,has disorder","179536","2020-10-21","18:00:00",""
"4500551","8.0552","0.0008","11.557","0.0011","10.2634","0.001","90","","107.105","0.002","90","","913.2","0.15","291","2","291","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H16 I2 N4 Se2 -","- C10 H16 I2 N4 Se2 -","- C20 H32 I4 N8 Se4 -","2","1","","Roy, Gouriprasanna; Bhabak, Krishna P.; Mugesh, Govindasamy","Interactions of Antithyroid Drugs and Their Analogues with Halogens and their Biological Implications","Crystal Growth & Design","2011","11","6","2279","","10.1021/cg101688v","","","0.71073","MoKα","","0.0375","0.0305","","","0.0523","0.0548","","","","","","0.957","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500552","11.207","0.002","8.1064","0.0016","30.386","0.006","90","","90","","90","","2760.5","0.9","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C11 H12 Br2 N2 Se -","- C11 H12 Br2 N2 Se -","- C88 H96 Br16 N16 Se8 -","8","1","","Roy, Gouriprasanna; Bhabak, Krishna P.; Mugesh, Govindasamy","Interactions of Antithyroid Drugs and Their Analogues with Halogens and their Biological Implications","Crystal Growth & Design","2011","11","6","2279","","10.1021/cg101688v","","","0.71073","MoKα","","0.0841","0.0417","","","0.1247","0.1856","","","","","","0.558","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500553","14.661","0.007","8.451","0.004","23.808","0.011","90","","94.135","0.009","90","","2942","2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 I2 N2 Se -","- C11 H10 I2 N2 Se -","- C88 H80 I16 N16 Se8 -","8","2","","Roy, Gouriprasanna; Bhabak, Krishna P.; Mugesh, Govindasamy","Interactions of Antithyroid Drugs and Their Analogues with Halogens and their Biological Implications","Crystal Growth & Design","2011","11","6","2279","","10.1021/cg101688v","","","0.71073","MoKα","","0.1175","0.0717","","","0.1946","0.2197","","","","","","1.111","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500554","7.0137","0.0018","11.257","0.003","35.392","0.009","90","","90","","90","","2794.3","1.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H12 Br2 N4 Se2 -","- C8 H12 Br2 N4 Se2 -","- C64 H96 Br16 N32 Se16 -","8","1","","Roy, Gouriprasanna; Bhabak, Krishna P.; Mugesh, Govindasamy","Interactions of Antithyroid Drugs and Their Analogues with Halogens and their Biological Implications","Crystal Growth & Design","2011","11","6","2279","","10.1021/cg101688v","","","0.71073","MoKα","","0.0947","0.0531","","","0.1542","0.1989","","","","","","0.688","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500555","10.514","0.005","10.655","0.005","12.295","0.006","97.351","0.009","112.286","0.008","113.523","0.008","1103.4","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","anderson","","","- C24 H20 Cr Mo6 N4 Na O36 -","- C24 H20 Cr Mo6 N4 Na O36 -","- C24 H20 Cr Mo6 N4 Na O36 -","1","0.5","","Singh, Monika; Ramanan, Arunachalam","Crystal Engineering of Polyoxomolybdates Based Metal‒Organic Solids: The Case of Chromium Molybdate Cluster Based Metal Complexes and Coordination Polymers","Crystal Growth & Design","2011","11","8","3381","","10.1021/cg101695w","","","0.71073","MoKα","","0.0521","0.0476","","","0.0997","0.1021","","","","","","1.136","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500556","10.5998","0.0012","11.8436","0.0014","13.1423","0.0016","102.363","0.002","111.815","0.003","107.759","0.002","1355","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","anderson","","","- C24 H20 Cr Mo6 N4 Ni O48 -","- C24 H20 Cr Mo6 N4 Ni O48 -","- C24 H20 Cr Mo6 N4 Ni O48 -","1","0.5","","Singh, Monika; Ramanan, Arunachalam","Crystal Engineering of Polyoxomolybdates Based Metal‒Organic Solids: The Case of Chromium Molybdate Cluster Based Metal Complexes and Coordination Polymers","Crystal Growth & Design","2011","11","8","3381","","10.1021/cg101695w","","","0.71073","MoKα","","0.0769","0.0647","","","0.1314","0.1383","","","","","","1.108","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500557","10.559","0.004","11.819","0.004","13.105","0.005","102.202","0.006","111.925","0.005","107.706","0.006","1344.1","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","anderson","","","- C24 H20 Cr Cu Mo6 N4 O46 -","- C24 H20 Cr Cu Mo6 N4 O46 -","- C24 H20 Cr Cu Mo6 N4 O46 -","1","0.5","","Singh, Monika; Ramanan, Arunachalam","Crystal Engineering of Polyoxomolybdates Based Metal‒Organic Solids: The Case of Chromium Molybdate Cluster Based Metal Complexes and Coordination Polymers","Crystal Growth & Design","2011","11","8","3381","","10.1021/cg101695w","","","0.71073","MoKα","","0.1006","0.092","","","0.1806","0.1853","","","","","","1.225","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500558","22.084","0.003","9.4366","0.0011","21.011","0.003","90","","98.517","0.002","90","","4330.4","1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","anderson","","","- C24 H20 Cr Mo6 N4 Na O34 -","- C24 H20 Cr Mo6 N4 Na O34 -","- C96 H80 Cr4 Mo24 N16 Na4 O136 -","4","0.5","","Singh, Monika; Ramanan, Arunachalam","Crystal Engineering of Polyoxomolybdates Based Metal‒Organic Solids: The Case of Chromium Molybdate Cluster Based Metal Complexes and Coordination Polymers","Crystal Growth & Design","2011","11","8","3381","","10.1021/cg101695w","","","0.71073","MoKα","","0.0429","0.0413","","","0.0851","0.0854","","","","","","1.074","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500559","10.6636","0.0015","17.262","0.003","14.054","0.0019","90","","108.948","0.003","90","","2446.8","0.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","anderson","","","- C10 H6 Co2 Cr Mo6 N4 O49 -","- C10 H6 Co2 Cr Mo6 N4 O49 -","- C20 H12 Co4 Cr2 Mo12 N8 O98 -","2","0.5","","Singh, Monika; Ramanan, Arunachalam","Crystal Engineering of Polyoxomolybdates Based Metal‒Organic Solids: The Case of Chromium Molybdate Cluster Based Metal Complexes and Coordination Polymers","Crystal Growth & Design","2011","11","8","3381","","10.1021/cg101695w","","","0.71073","MoKα","","0.0595","0.0541","","","0.1171","0.1198","","","","","","1.178","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500560","10.8805","0.0017","17.084","0.003","13.59","0.002","90","","107.703","0.003","90","","2406.5","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","anderson","","","- C10 H6 Cr Cu2 Mo6 N4 O49 -","- C10 H6 Cr Cu2 Mo6 N4 O49 -","- C20 H12 Cr2 Cu4 Mo12 N8 O98 -","2","0.5","","Singh, Monika; Ramanan, Arunachalam","Crystal Engineering of Polyoxomolybdates Based Metal‒Organic Solids: The Case of Chromium Molybdate Cluster Based Metal Complexes and Coordination Polymers","Crystal Growth & Design","2011","11","8","3381","","10.1021/cg101695w","","","0.71073","MoKα","","0.0608","0.0431","","","0.1073","0.1171","","","","","","1.045","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500561","8.6671","0.0006","11.678","0.001","19.4868","0.0017","81.592","0.004","80.848","0.004","68.625","0.004","1804.9","0.3","230","2","230","2","","","","","","","","3","P 1","P 1","1","","","","- C26 H32 N6 -","- C26 H32 N6 -","- C78 H96 N18 -","3","3","","Carrión, M. Carmen; Ortiz, Isabel M.; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana M.; Elguero, José","Ag(I) and Cu(I) [2 ×2] Chiral Grids Containing Pyrimidine Ligands with Camphor Moieties. Arene Encapsulation","Crystal Growth & Design","2011","11","5","1766","","10.1021/cg101709q","","","0.71073","MoKα","","0.1466","0.0713","","","0.167","0.2226","","","","","","0.962","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500562","29.141","0.002","29.141","0.002","17.527","0.003","90","","90","","90","","14884","3","180","2","180","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C130 H156 B4 Cu4 F16 N24 -","- C130 H156 B4 Cu4 F16 N24 -","- C520 H624 B16 Cu16 F64 N96 -","4","0.25","","Carrión, M. Carmen; Ortiz, Isabel M.; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana M.; Elguero, José","Ag(I) and Cu(I) [2 ×2] Chiral Grids Containing Pyrimidine Ligands with Camphor Moieties. Arene Encapsulation","Crystal Growth & Design","2011","11","5","1766","","10.1021/cg101709q","","","0.71073","MoKα","","0.1732","0.0712","","","0.1769","0.1956","","","","","","0.811","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500563","29.1306","0.001","29.1306","0.001","18.2305","0.0013","90","","90","","90","","15470.3","1.3","180","2","180","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C118 H142 Ag4 B4 F16 N24 -","- C118 H142 Ag4 B4 F16 N24 -","- C472 H568 Ag16 B16 F64 N96 -","4","0.25","","Carrión, M. Carmen; Ortiz, Isabel M.; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana M.; Elguero, José","Ag(I) and Cu(I) [2 ×2] Chiral Grids Containing Pyrimidine Ligands with Camphor Moieties. Arene Encapsulation","Crystal Growth & Design","2011","11","5","1766","","10.1021/cg101709q","","","0.71073","MoKα","","0.113","0.0641","","","0.1508","0.1704","","","","","","0.896","","","","has coordinates,has disorder","179536","2020-10-21","18:00:00",""
"4500564","12.9036","0.0005","11.9095","0.0003","22.3016","0.001","90","","91.791","0.004","90","","3425.5","0.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H48 Cu4 N10 O40 Si W12 -","- C35 H48 Cu4 N10 O40 Si W12 -","- C70 H96 Cu8 N20 O80 Si2 W24 -","2","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71073","MoKα","","0.1604","0.0582","","","0.1212","0.1477","","","","","","0.874","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500565","22.254","0.005","11.464","0.005","23.344","0.005","90","0.005","90","0.005","90","0.005","5956","3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H32 Cu4 N8 O40 Si W12 -","- C24 H32 Cu4 N8 O40 Si W12 -","- C96 H128 Cu16 N32 O160 Si4 W48 -","4","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71073","MoKα","","0.1174","0.0694","","","0.1658","0.1838","","","","","","0.997","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500566","24.8","0.005","11.392","0.005","25.025","0.005","90","0.005","116.474","0.005","90","0.005","6329","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 Cu4 N8 O42 Si W12 -","- C24 H32 Cu4 N8 O42 Si W12 -","- C96 H128 Cu16 N32 O168 Si4 W48 -","4","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71069","MoKα","","0.0824","0.0389","","","0.0789","0.0872","","","","","","0.892","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500567","12.6564","0.0005","22.9398","0.001","24.7425","0.0009","90","","99.04","0.003","90","","7094.4","0.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H50 Cu4 N8 O41 Si W12 -","- C32 H48 Cu4 N8 O41 Si W12 -","- C128 H192 Cu16 N32 O164 Si4 W48 -","4","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71073","MoKα","","0.086","0.0382","","","0.0656","0.0703","","","","","","0.735","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500568","23.4725","0.0007","12.0745","0.0003","23.1288","0.0007","90","","112.811","0.004","90","","6042.4","0.3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H35 Cu4 Mo12 N8 O41.5 P -","- C24 H32 Cu4 Mo12 N8 O41.5 P -","- C96 H128 Cu16 Mo48 N32 O166 P4 -","4","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71073","MoKα","","0.092","0.0416","","","0.0867","0.0964","","","","","","0.859","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500569","17.592","0.005","22.091","0.005","15.733","0.005","90","0.005","90","0.005","90","0.005","6114","3","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C28 H40 Cu3 Mo12 N8 O41 P -","- C28 H40 Cu3 Mo12 N8 O41 P -","- C112 H160 Cu12 Mo48 N32 O164 P4 -","4","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71069","MoKα","","0.125","0.0835","","","0.1684","0.1777","","","","","","1.155","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500570","12.8567","0.0004","11.8861","0.0003","22.4652","0.0007","90","","92.158","0.003","90","","3430.61","0.17","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H38 Cu4 Mo12 N10 O40 P -","- C35 H38 Cu4 Mo12 N10 O40 P -","- C70 H76 Cu8 Mo24 N20 O80 P2 -","2","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang; Bai, Hong-Ye","Solvothermal Assembly of a Series of Organic‒Inorganic Hybrid Materials Constructed from Keggin Polyoxometalate Clusters and Copper(I)‒Organic Frameworks","Crystal Growth & Design","2011","11","5","1786","","10.1021/cg1017246","","","0.71073","MoKα","","0.1413","0.0586","","","0.1482","0.1745","","","","","","0.844","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500571","10.049","0.002","15.041","0.003","20.708","0.004","101.561","0.002","93.894","0.003","105.461","0.003","2931","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[Zn(bdc)L1]","","","- C28 H16 N2 O4 Zn -","- C28 H16 N2 O4 Zn -","- C112 H64 N8 O16 Zn4 -","4","2","","Yamada, Teppei; Iwakiri, Shoji; Hara, Takafumi; Kanaizuka, Katsuhiko; Kurmoo, Mohamedally; Kitagawa, Hiroshi","Porous Interpenetrating Metal−Organic Frameworks with Hierarchical Nodes","Crystal Growth & Design","2011","11","5","1798","","10.1021/cg1017278","","","0.71073","MoKα","","0.1065","0.0879","","","0.2144","0.2215","","","","","","1.09","","","","has coordinates,has disorder","179536","2020-10-21","18:00:00",""
"4500572","27.406","0.004","14.461","0.002","25.124","0.004","90","","94.255","0.002","90","","9930","3","100","2","100","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","[Zn3(bpdc)3L1]","","","- C24 H14 N O4 Zn -","- C19.5789 H11.3684 N0.631579 O3.78947 Zn0.947368 -","- C372 H216 N12 O72 Zn18 -","19","4.75","","Yamada, Teppei; Iwakiri, Shoji; Hara, Takafumi; Kanaizuka, Katsuhiko; Kurmoo, Mohamedally; Kitagawa, Hiroshi","Porous Interpenetrating Metal−Organic Frameworks with Hierarchical Nodes","Crystal Growth & Design","2011","11","5","1798","","10.1021/cg1017278","","","0.71073","MoKα","","0.1476","0.0991","","","0.283","0.3097","","","","","","1.048","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500573","17.83","","23.277","","24.071","","95.14","","90.32","","102.22","","9721.45","","293","2","100","2","","","","","","","","6","P -1","-P 1","2","[Zn2(sbpdc)2L1]","","","- C48 H24 N2 O12 S2 Zn2 -","- C288 H138 N12 O72 S12 Zn12 -","- C288 H138 N12 O72 S12 Zn12 -","1","0.5","","Yamada, Teppei; Iwakiri, Shoji; Hara, Takafumi; Kanaizuka, Katsuhiko; Kurmoo, Mohamedally; Kitagawa, Hiroshi","Porous Interpenetrating Metal−Organic Frameworks with Hierarchical Nodes","Crystal Growth & Design","2011","11","5","1798","","10.1021/cg1017278","","","0.71073","MoKα","","0.1031","0.0501","","","0.1218","0.1344","","","","","","0.829","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500574","13.8963","0.0017","23.221","0.003","18.872","0.002","90","","103.102","0.001","90","","5931.2","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Zn2(sbpdc)2(bpy)]","","","- C38 H20 N2 O12 S2 Zn2 -","- C38 H20 N2 O12 S2 Zn2 -","- C152 H80 N8 O48 S8 Zn8 -","4","1","","Yamada, Teppei; Iwakiri, Shoji; Hara, Takafumi; Kanaizuka, Katsuhiko; Kurmoo, Mohamedally; Kitagawa, Hiroshi","Porous Interpenetrating Metal−Organic Frameworks with Hierarchical Nodes","Crystal Growth & Design","2011","11","5","1798","","10.1021/cg1017278","","","0.71073","MoKα","","0.036","0.0295","","","0.075","0.0773","","","","","","1.075","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500575","13.488","0.006","24.834","0.013","8.409","0.004","90","","98.917","0.008","90","","2783","2","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C31 H27 N3 O6 Zn -","- C31 H27 N3 O6 Zn -","- C124 H108 N12 O24 Zn4 -","4","1","","Sharma, Manish K.; Lama, Prem; Bharadwaj, Parimal K.","Reversible Single-Crystal to Single-Crystal Exchange of Guests in a Seven-Fold Interpenetrated Diamondoid Coordination Polymer","Crystal Growth & Design","2011","11","4","1411","","10.1021/cg101731j","","","0.71073","MoKα","","0.0699","0.0577","","","0.1155","0.1257","","","","","","1.015","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500576","13.187","0.008","24.889","0.018","8.666","0.005","90","","102.644","0.011","90","","2775","3","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C31 H26 N2 O5 Zn -","- C31 H26 N2 O5 Zn -","- C124 H104 N8 O20 Zn4 -","4","1","","Sharma, Manish K.; Lama, Prem; Bharadwaj, Parimal K.","Reversible Single-Crystal to Single-Crystal Exchange of Guests in a Seven-Fold Interpenetrated Diamondoid Coordination Polymer","Crystal Growth & Design","2011","11","4","1411","","10.1021/cg101731j","","","0.71073","MoKα","","0.1055","0.0684","","","0.1595","0.2231","","","","","","1.065","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500577","12.934","0.005","24.97","0.003","8.715","0.004","90","","103.834","0.005","90","","2733","1.7","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C30 H23 N3 O4 Zn -","- C30 H23 N3 O4 Zn -","- C120 H92 N12 O16 Zn4 -","4","1","","Sharma, Manish K.; Lama, Prem; Bharadwaj, Parimal K.","Reversible Single-Crystal to Single-Crystal Exchange of Guests in a Seven-Fold Interpenetrated Diamondoid Coordination Polymer","Crystal Growth & Design","2011","11","4","1411","","10.1021/cg101731j","","","0.71073","MoKα","","0.1697","0.0797","","","0.154","0.1942","","","","","","0.972","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500578","13.507","0.004","24.837","0.01","8.406","0.003","90","","98.841","0.005","90","","2786.5","1.7","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C31 H27 N3 O5 Zn -","- C31 H27 N3 O5 Zn -","- C124 H108 N12 O20 Zn4 -","4","1","","Sharma, Manish K.; Lama, Prem; Bharadwaj, Parimal K.","Reversible Single-Crystal to Single-Crystal Exchange of Guests in a Seven-Fold Interpenetrated Diamondoid Coordination Polymer","Crystal Growth & Design","2011","11","4","1411","","10.1021/cg101731j","","","0.71073","MoKα","","0.0828","0.0584","","","0.1438","0.2191","","","","","","1.198","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500579","8.619","0.002","17.959","0.003","8.135","0.002","90","","110.828","0.014","90","","1176.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 O9 Pr S -","- C7 H8 O9 Pr S -","- C28 H32 O36 Pr4 S4 -","4","1","","Xu, Jing; Cheng, Jianwen; Su, Weiping; Hong, Maochun","Effect of Lanthanide Contraction on Crystal Structures of Three-Dimensional Lanthanide Based Metal‒Organic Frameworks with Thiophene-2,5-Dicarboxylate and Oxalate","Crystal Growth & Design","2011","11","6","2294","","10.1021/cg101736e","","","0.71073","MoKα","","0.0498","0.0459","","","0.1206","0.1333","","","","","","1.217","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500580","8.591","0.002","17.914","0.003","8.1002","0.0018","90","","110.854","0.014","90","","1164.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 Nd O9 S -","- C7 H8 Nd O9 S -","- C28 H32 Nd4 O36 S4 -","4","1","","Xu, Jing; Cheng, Jianwen; Su, Weiping; Hong, Maochun","Effect of Lanthanide Contraction on Crystal Structures of Three-Dimensional Lanthanide Based Metal‒Organic Frameworks with Thiophene-2,5-Dicarboxylate and Oxalate","Crystal Growth & Design","2011","11","6","2294","","10.1021/cg101736e","","","0.71073","MoKα","","0.0374","0.0358","","","0.1013","0.1032","","","","","","1.152","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500581","8.554","0.002","17.844","0.005","8.026","0.002","90","","110.587","0.003","90","","1146.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 O9 S Sm -","- C7 H8 O9 S Sm -","- C28 H32 O36 S4 Sm4 -","4","1","","Xu, Jing; Cheng, Jianwen; Su, Weiping; Hong, Maochun","Effect of Lanthanide Contraction on Crystal Structures of Three-Dimensional Lanthanide Based Metal‒Organic Frameworks with Thiophene-2,5-Dicarboxylate and Oxalate","Crystal Growth & Design","2011","11","6","2294","","10.1021/cg101736e","","","0.71073","MoKα","","0.0445","0.0412","","","0.106","0.1191","","","","","","1.095","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500582","8.531","0.002","17.79","0.004","7.979","0.002","90","","110.334","0.004","90","","1135.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 Gd O9 S -","- C7 H8 Gd O9 S -","- C28 H32 Gd4 O36 S4 -","4","1","","Xu, Jing; Cheng, Jianwen; Su, Weiping; Hong, Maochun","Effect of Lanthanide Contraction on Crystal Structures of Three-Dimensional Lanthanide Based Metal‒Organic Frameworks with Thiophene-2,5-Dicarboxylate and Oxalate","Crystal Growth & Design","2011","11","6","2294","","10.1021/cg101736e","","","0.71073","MoKα","","0.0395","0.0383","","","0.1074","0.1088","","","","","","1.151","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500583","19.2794","0.0014","9.8604","0.0005","12.4549","0.001","90","","106.871","0.004","90","","2265.8","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H8 Dy O9 S -","- C7 H8 Dy O9 S -","- C56 H64 Dy8 O72 S8 -","8","1","","Xu, Jing; Cheng, Jianwen; Su, Weiping; Hong, Maochun","Effect of Lanthanide Contraction on Crystal Structures of Three-Dimensional Lanthanide Based Metal‒Organic Frameworks with Thiophene-2,5-Dicarboxylate and Oxalate","Crystal Growth & Design","2011","11","6","2294","","10.1021/cg101736e","","","0.71073","MoKα","","0.042","0.0368","","","0.0923","0.0967","","","","","","1.117","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500584","19.25","0.02","9.796","0.009","12.388","0.013","90","","106.392","0.017","90","","2241","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H8 Er O9 S -","- C7 H8 Er O9 S -","- C56 H64 Er8 O72 S8 -","8","1","","Xu, Jing; Cheng, Jianwen; Su, Weiping; Hong, Maochun","Effect of Lanthanide Contraction on Crystal Structures of Three-Dimensional Lanthanide Based Metal‒Organic Frameworks with Thiophene-2,5-Dicarboxylate and Oxalate","Crystal Growth & Design","2011","11","6","2294","","10.1021/cg101736e","","","0.71073","MoKα","","0.0681","0.0419","","","0.1251","0.1989","","","","","","1.049","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500585","11.338","0.006","13.308","0.007","20.793","0.008","93.411","0.008","92.971","0.008","98.712","0.008","3090","3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C125 H156 N20 O17 P4 -","- C125 H156 N20 O17 P4 -","- C125 H156 N20 O17 P4 -","1","0.5","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.1168","0.0762","","","0.1749","0.1936","","","","","","1.032","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500586","11.211","0.003","8.249","0.002","12.563","0.003","90","","102.41","0.03","90","","1134.7","0.5","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N5 -","- C11 H13 N5 -","- C44 H52 N20 -","4","1","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.1125","0.0864","","","0.2748","0.2981","","","","","","1.143","","","","has coordinates,has disorder","179536","2020-10-21","18:00:00",""
"4500587","8.271","0.001","11.522","0.001","12.058","0.001","101.27","0.01","96.38","0.01","100.33","0.01","1095.9","0.2","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C11 H13 N5 -","- C11 H13 N5 -","- C44 H52 N20 -","4","2","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.123","0.0862","","","0.2802","0.2915","","","","","","1.122","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500588","22.836","0.003","8.177","0.001","11.577","0.001","90","","94.29","0.002","90","","2155.7","0.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H37 N5 -","- C21 H37 N5 -","- C84 H148 N20 -","4","1","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.1173","0.059","","","0.1427","0.1673","","","","","","0.998","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500589","17.181","0.003","8.113","0.001","11.691","0.002","90","","107.45","0.02","90","","1554.6","0.5","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H23 N5 -","- C15 H23 N5 -","- C60 H92 N20 -","4","1","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.0764","0.053","","","0.1539","0.1647","","","","","","1.111","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500590","5.444","0.002","18.033","0.008","9.563","0.004","90","","99.228","0.008","90","","926.7","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","1","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.0747","0.0596","","","0.1196","0.1264","","","","","","1.128","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500591","8.32","0.001","11.292","0.001","24.911","0.002","102.669","0.006","91.003","0.005","91.806","0.006","2281.5","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H24 N5 O3 P -","- C23 H24 N5 O3 P -","- C92 H96 N20 O12 P4 -","4","2","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.1619","0.0745","","","0.1349","0.1745","","","","","","0.993","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500592","8.209","0.001","17.912","0.002","25.091","0.003","90","","103.615","0.004","90","","3585.7","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 N5 O3 P -","- C15 H24 N5 O3 P -","- C120 H192 N40 O24 P8 -","8","2","","Kumara Swamy, K. C.; Allu, Srinivasarao; Srinivas, Venu; Balaraman, E.; Kumar, K. V. P. Pavan","Alkynyl and Phosphonyl Substituted Nucleobases: A Case of Thermally Induced Conformational Polymorphism","Crystal Growth & Design","2011","11","6","2302","","10.1021/cg101737x","","","0.71073","MoKα","","0.1187","0.0746","","","0.1532","0.175","","","","","","1.031","","","","has coordinates","179536","2020-10-21","18:00:00",""
"4500593","11.899","0.0006","12.712","0.0007","14.019","0.0007","67","0.005","72.669","0.004","79.114","0.004","1856.98","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C82 H64 Cd2 N14 O9 -","- C82 H64 Cd2 N14 O9 -","- C82 H64 Cd2 N14 O9 -","1","0.5","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","0.71073","MoKα","","0.1014","0.0463","","","0.0713","0.0802","","","","","","0.812","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500594","10.1973","0.001","18.464","0.002","18.495","0.002","90","","104.565","0.01","90","","3370.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H27 Cd N8 O5 -","- C35 H25 Cd N8 O5 -","- C140 H100 Cd4 N32 O20 -","4","1","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","0.71073","MoKα","","0.1727","0.0701","","","0.1659","0.1847","","","","","","0.971","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500595","12.055","0.0003","9.957","0.0002","29.093","0.0006","90","","98.02","0.002","90","","3457.93","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H32 Cd N8 O6 -","- C36 H29 Cd N8 O6 -","- C144 H116 Cd4 N32 O24 -","4","1","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","0.71069","MoKα","","0.0538","0.0329","","","0.0702","0.0749","","","","","","0.994","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500596","14.9127","0.0002","9.2663","0.0003","27.2481","0.0004","90","","98.253","0.001","90","","3726.3","0.14","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C42 H33 Cd N8 O5 -","- C42 H33 Cd N8 O5 -","- C168 H132 Cd4 N32 O20 -","4","1","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","1.54184","CuKα","","0.1039","0.0654","","","0.1606","0.1874","","","","","","0.995","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500597","10.112","0.0003","18.386","0.0007","18.473","0.0006","90","","104.583","0.004","90","","3323.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H28 Mn N8 O5 -","- C35 H24 Mn N8 O5 -","- C140 H96 Mn4 N32 O20 -","4","1","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","0.71073","MoKα","","0.1237","0.0564","","","0.1297","0.1448","","","","","","0.855","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500598","22.466","0.0001","22.466","0.0001","13.387","0.0001","90","","90","","90","","6756.7","0.07","293","2","293","2","","","","","","","","6","P 4/n :2","-P 4a","85","","","","- C124 H108 Cl4 N28 Ni4 O16 -","- C124 H108 Cl4 N28 Ni4 O16 -","- C248 H216 Cl8 N56 Ni8 O32 -","2","0.25","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","1.54184","CuKα","","0.074","0.0591","","","0.1822","0.1963","","","","","","1.054","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500599","11.048","0.0003","11.563","0.0004","16.169","0.0007","76.974","0.004","89.733","0.003","63.126","0.004","1783.8","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H55 N14 Ni2 O21 -","- C74 H50 N14 Ni2 O20.5 -","- C74 H50 N14 Ni2 O20.5 -","1","0.5","","Wu, Hua; Liu, Hai-Yan; Yang, Jin; Liu, Bo; Ma, Jian-Fang; Liu, Ying-Ying; Liu, Yun-Yu","Series of Coordination Polymers Based on Different Carboxylates and a Tri(4-imidazolylphenyl)amine Ligand: Entangled Structures and Photoluminescence","Crystal Growth & Design","2011","11","6","2317","","10.1021/cg200005q","","","0.71069","MoKα","","0.0664","0.052","","","0.1487","0.1565","","","","","","1.011","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500600","27.324","0.017","6.433","0.003","14.561","0.008","90","","101.14","0.018","90","","2511","2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H20 N O4 -","- C13 H20 N O4 -","- C104 H160 N8 O32 -","8","1","","André, Vânia; Fernandes, Auguste; Santos, Pedro Paulo; Duarte, M. Teresa","On the Track of New Multicomponent Gabapentin Crystal Forms: Synthon Competition and pH Stability","Crystal Growth & Design","2011","11","6","2325","","10.1021/cg200008z","","","0.71069","MoKα","","0.0922","0.0455","","","0.092","0.1035","","","","","","0.922","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500601","16.526","0.0007","16.929","0.001","6.561","0.001","90","","92.23","0.007","90","","1834.2","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","GBP_TrimesicAcid_hydrate","","","- C18 H25 N O9 -","- C18 H25 N O9 -","- C72 H100 N4 O36 -","4","1","","André, Vânia; Fernandes, Auguste; Santos, Pedro Paulo; Duarte, M. Teresa","On the Track of New Multicomponent Gabapentin Crystal Forms: Synthon Competition and pH Stability","Crystal Growth & Design","2011","11","6","2325","","10.1021/cg200008z","","","0.71069","MoKα","","0.1579","0.069","","","0.1692","0.1986","","","","","","0.945","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500602","14.341","0.003","9.6028","0.0019","7.2024","0.0014","90","","97.63","0.03","90","","983.1","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 I O5 -","- C8 H7 I O5 -","- C32 H28 I4 O20 -","4","1","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0568","0.052","","","0.167","0.1721","","","","","","1.026","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500603","27.451","0.005","9.517","0.0019","16.842","0.003","90","","122.08","0.03","90","","3728.1","1.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H24 I2 N4 O9 Zn2 -","- C40 H24 I2 N4 O9 Zn2 -","- C160 H96 I8 N16 O36 Zn8 -","4","0.5","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0587","0.0549","","","0.1473","0.1504","","","","","","1.088","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500604","9.926","0.002","10.815","0.002","13.742","0.003","106.53","0.03","94.87","0.03","111.8","0.03","1282.7","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H18 I N3 O4 Zn -","- C26 H18 I N3 O4 Zn -","- C52 H36 I2 N6 O8 Zn2 -","2","1","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.073","0.0515","","","0.0849","0.0937","","","","","","1.038","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500605","10.433","0.005","14.803","0.007","26.493","0.012","90","","109.45","0.017","90","","3858","3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H22 Cd2 I2 N4 O8 -","- C40 H22 Cd2 I2 N4 O8 -","- C160 H88 Cd8 I8 N16 O32 -","4","1","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0613","0.0495","","","0.1212","0.1259","","","","","","1.037","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500606","10.247","0.002","14.609","0.003","26.348","0.007","90","","109.29","0.03","90","","3722.8","1.6","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H22 I2 Mn2 N4 O8 -","- C40 H22 I2 Mn2 N4 O8 -","- C160 H88 I8 Mn8 N16 O32 -","4","1","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0337","0.0311","","","0.0626","0.0643","","","","","","1.099","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500607","10.2135","0.0005","13.8853","0.0006","18.1964","0.0008","90","","103.173","0.001","90","","2512.7","0.2","296","2","296","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C80 H52 I4 Mn4 N8 O21 -","- C80 H52 I4 Mn4 N8 O21 -","- C80 H52 I4 Mn4 N8 O21 -","1","0.25","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0696","0.0561","","","0.1982","0.2077","","","","","","1.095","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500608","10.22","0.01","14.56","0.01","15.01","0.01","90","","104.85","0.02","90","","2159","3","298","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H17 Co I N4 O4 -","- C22 H17 Co I N4 O4 -","- C88 H68 Co4 I4 N16 O16 -","4","1","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.1085","0.0545","","","0.0638","0.0705","","","","","","1.02","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500609","24.231","0.0004","10.1656","0.0007","19.5257","0.0003","90","","114.942","0.001","90","","4361.1","0.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H17 Co I N4 O4 -","- C22 H17 Co I N4 O4 -","- C176 H136 Co8 I8 N32 O32 -","8","1","","Zang, Shuang-Quan; Fan, Ya-Juan; Li, Jia-Bin; Hou, Hong-Wei; Mak, Thomas C. W.","Halogen Bonding in the Assembly of Coordination Polymers Based on 5-Iodo-Isophthalic Acid","Crystal Growth & Design","2011","11","8","3395","","10.1021/cg200022j","","","0.71073","MoKα","","0.0543","0.0329","","","0.0699","0.0787","","","","","","1.03","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500610","6.1475","0.0005","13.1349","0.001","10.5981","0.0009","90","","99.16","0.008","90","","844.85","0.12","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H22 Cl N O3 -","- C18 H22 Cl N O3 -","- C36 H44 Cl2 N2 O6 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0511","0.0459","","","0.1092","0.1115","","","","","","1.131","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500611","10.4182","0.0006","8.0374","0.0004","20.2501","0.0014","90","","90","","90","","1695.65","0.17","123","2","123","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C18 H22 Cl N O3 -","- C18 H22 Cl N O3 -","- C72 H88 Cl4 N4 O12 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.058","0.0396","","","0.0635","0.0669","","","","","","0.895","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500612","5.8119","0.0002","13.1776","0.0003","12.041","0.0004","90","","103.222","0.003","90","","897.74","0.05","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H24 N2 O6 -","- C18 H24 N2 O6 -","- C36 H48 N4 O12 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0296","0.0259","","","0.0575","0.0584","","","","","","0.978","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500613","15.6457","0.0003","11.2144","0.0002","21.0605","0.0004","90","","90","","90","","3695.22","0.12","123","2","123","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H24 N2 O6 -","- C18 H24 N2 O6 -","- C144 H192 N16 O48 -","8","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0535","0.0334","","","0.074","0.0774","","","","","","0.917","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500614","5.8318","0.0005","13.0114","0.0007","10.8982","0.0008","90","","97.971","0.004","90","","818.96","0.1","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H22 F N O3 -","- C18 H22 F N O3 -","- C36 H44 F2 N2 O6 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.1174","0.058","","","0.1126","0.1347","","","","","","1.022","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500615","24.2192","0.0013","5.7476","0.0003","23.7497","0.0014","90","","96.799","0.006","90","","3282.8","0.3","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 F N O3 -","- C18 H22 F N O3 -","- C144 H176 F8 N8 O24 -","8","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0694","0.0412","","","0.0907","0.0962","","","","","","0.88","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500616","5.8311","0.0002","12.9695","0.0004","23.552","0.0009","90","","94.839","0.003","90","","1774.81","0.11","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H22 N2 O5 -","- C18 H22 N2 O5 -","- C72 H88 N8 O20 -","4","2","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0564","0.0373","","","0.0591","0.0625","","","","","","0.908","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500617","5.8279","0.0007","12.8112","0.0011","23.307","0.003","90","","91.683","0.013","90","","1739.4","0.3","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N2 O5 -","- C18 H22 N2 O5 -","- C72 H88 N8 O20 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0849","0.0551","","","0.1361","0.1541","","","","","","0.967","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500618","5.9395","0.0008","15.0195","0.0013","9.6906","0.0013","90","","97.506","0.012","90","","857.07","0.18","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C38 H50 N2 O6 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0625","0.0319","","","0.0474","0.0505","","","","","","0.779","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500619","8.0447","0.0002","10.4716","0.0002","20.2936","0.0004","90","","90","","90","","1709.55","0.06","120","2","120","2","","","","","","","","4","P b c 21","P 2c -2b","29","","","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C76 H100 N4 O12 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0367","0.0329","","","0.0742","0.076","","","","","","1.058","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500620","7.423","0.0002","11.2355","0.0003","10.5683","0.0002","90","","93.59","0.002","90","","879.68","0.04","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H23 N O4 S -","- C17 H23 N O4 S -","- C34 H46 N2 O8 S2 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0523","0.0382","","","0.0634","0.0659","","","","","","0.924","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500621","10.4282","0.0002","10.8429","0.0001","14.9671","0.0002","90","","94.601","0.001","90","","1686.91","0.04","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 N O4 S -","- C17 H23 N O4 S -","- C68 H92 N4 O16 S4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0384","0.0307","","","0.0896","0.0917","","","","","","1.109","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500622","5.9219","0.0012","32.974","0.005","7.1591","0.0012","90","","99.465","0.002","90","","1378.9","0.4","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H40 N2 O8 S2 -","- C24 H40 N2 O8 S2 -","- C48 H80 N4 O16 S4 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0366","0.0353","","","0.08","0.0804","","","","","","1.199","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500623","5.9393","0.0005","33.056","0.002","7.3071","0.0006","90","","102.924","0.008","90","","1398.26","0.19","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 N O4 S -","- C12 H20 N O4 S -","- C48 H80 N4 O16 S4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","1.5418","CuKα","","0.0807","0.0663","","","0.1701","0.1771","","","","","","1.065","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500624","5.8796","0.0006","21.637","0.003","33.84","0.004","90","","90","","90","","4305","0.9","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H21 N O4 S -","- C12 H21 N O4 S -","- C144 H252 N12 O48 S12 -","12","3","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.1615","0.0963","","","0.1804","0.2209","","","","","","1.073","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500625","5.7618","0.0003","17.4809","0.0011","13.7006","0.0008","90","","95.417","0.005","90","","1373.78","0.14","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H21 N O4 S -","- C12 H21 N O4 S -","- C48 H84 N4 O16 S4 -","4","2","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0679","0.0387","","","0.0687","0.0727","","","","","","0.804","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500626","6.0452","0.0004","13.2486","0.0007","18.0074","0.0009","90","","90","","90","","1442.22","0.14","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H21 N O6 S -","- C11 H20.5 N O6 S -","- C44 H82 N4 O24 S4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0703","0.0495","","","0.0817","0.0864","","","","","","1.04","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500627","5.8927","0.0002","17.3398","0.0005","13.7513","0.0004","90","","95.424","0.002","90","","1398.79","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H21 N O6 S -","- C11 H21 N O6 S -","- C44 H84 N4 O24 S4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0713","0.0541","","","0.1033","0.1131","","","","","","1.088","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500628","19.9658","0.0005","13.5075","0.0004","5.7764","0.0002","90","","90","","90","","1557.83","0.08","123","2","123","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C15 H21 N O5 -","- C15 H21 N O5 -","- C60 H84 N4 O20 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0581","0.0421","","","0.0864","0.0886","","","","","","0.912","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500629","10.6674","0.0007","24.5551","0.0018","5.9212","0.0003","90","","100.111","0.006","90","","1526.91","0.17","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 N O5 -","- C15 H21 N O5 -","- C60 H84 N4 O20 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","1.5418","CuKα","","0.0715","0.0421","","","0.0984","0.1062","","","","","","0.897","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500630","7.8391","0.0005","9.6967","0.0005","11.2005","0.0007","103.35","0.005","100.24","0.005","111.083","0.005","740.34","0.09","123","2","123","2","","","","","","","","4","P 1","P 1","1","","","","- C14 H21 N O5 -","- C14 H21 N O5 -","- C28 H42 N2 O10 -","2","2","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0693","0.0512","","","0.1126","0.1176","","","","","","0.955","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500631","10.1926","0.0012","5.7077","0.0012","13.2031","0.0015","71.63","0.01","80.82","0.009","81.111","0.009","715.2","0.2","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H21 N O5 -","- C14 H21 N O5 -","- C28 H42 N2 O10 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","1.5418","CuKα","","0.0597","0.0506","","","0.1421","0.1494","","","","","","1.076","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500632","7.2851","0.0001","9.6672","0.0002","17.2535","0.0003","90","","90","","90","","1215.1","0.04","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H18 Br N O -","- C11 H18 Br N O -","- C44 H72 Br4 N4 O4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0186","0.0161","","","0.0345","0.0347","","","","","","1.023","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500633","5.73759","0.00016","30.5983","0.0011","6.9823","0.0002","90","","106.92","0.003","90","","1172.75","0.07","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H18 Br N O -","- C11 H18 Br N O -","- C44 H72 Br4 N4 O4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0563","0.0484","","","0.0864","0.0876","","","","","","1.396","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500634","7.1557","0.0002","9.5708","0.0002","16.8627","0.0004","90","","90","","90","","1154.86","0.05","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H18 Cl N O -","- C11 H18 Cl N O -","- C44 H72 Cl4 N4 O4 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0314","0.0267","","","0.0589","0.0598","","","","","","0.984","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500635","33.6032","0.0013","6.9855","0.0002","9.9089","0.0003","90","","95.085","0.002","90","","2316.81","0.13","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H18 Cl N O -","- C11 H18 Cl N O -","- C88 H144 Cl8 N8 O8 -","8","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0558","0.04","","","0.0874","0.0933","","","","","","1.064","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500636","6.6465","0.0002","11.9973","0.0005","23.0394","0.001","90","","90","","90","","1837.16","0.12","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 Cl N O4 -","- C18 H24 Cl N O4 -","- C72 H96 Cl4 N4 O16 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0553","0.0346","","","0.0562","0.0592","","","","","","0.865","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500637","24.7872","0.0012","5.8486","0.0002","23.7079","0.0011","90","","97.92","0.004","90","","3404.2","0.3","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 Cl N O3 -","- C18 H22 Cl N O3 -","- C144 H176 Cl8 N8 O24 -","8","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0768","0.0403","","","0.0862","0.0949","","","","","","0.936","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500638","8.628","0.0002","10.9921","0.0002","18.7914","0.0004","90","","90","","90","","1782.17","0.06","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 N O4 -","- C18 H25 N O4 -","- C72 H100 N4 O16 -","4","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0396","0.0309","","","0.0582","0.0595","","","","","","0.916","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500639","13.9277","0.0003","11.22","0.0003","20.7001","0.0007","90","","90","","90","","3234.78","0.16","123","2","123","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C144 H184 N8 O24 -","8","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0546","0.0325","","","0.0692","0.0734","","","","","","0.924","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500640","7.6416","0.0002","25.5067","0.0005","7.8781","0.0002","90","","104.173","0.003","90","","1488.8","0.06","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C11 H18 I2 N O -","- C11 H18 I2 N O -","- C44 H72 I8 N4 O4 -","4","2","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0573","0.0462","","","0.0648","0.0668","","","","","","1.136","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4500641","7.6216","0.0004","7.6754","0.0004","11.0946","0.0005","83.537","0.004","84.005","0.005","70.642","0.005","606.88","0.06","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H18 I N O -","- C11 H18 I N O -","- C22 H36 I2 N2 O2 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0228","0.0189","","","0.0397","0.0403","","","","","","0.97","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500642","6.1399","0.0001","13.3725","0.0004","10.3002","0.0003","90","","98.217","0.002","90","","837.02","0.04","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H23 N O5 S -","- C17 H23 N O5 S -","- C34 H46 N2 O10 S2 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.034","0.0316","","","0.0766","0.0783","","","","","","1.092","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500643","10.2179","0.0003","13.6409","0.0004","15.0037","0.0004","64.086","0.003","87.575","0.002","72.856","0.002","1788.26","0.1","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H24 N O5.5 S -","- C17 H24 N O5.5 S -","- C68 H96 N4 O22 S4 -","4","2","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0656","0.0367","","","0.0785","0.0842","","","","","","0.94","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500644","12.8247","0.0005","7.7239","0.0003","18.065","0.0008","90","","104.569","0.004","90","","1731.92","0.13","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H23 N O4 -","- C18 H23 N O4 -","- C72 H92 N4 O16 -","4","2","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.075","0.0439","","","0.0725","0.0775","","","","","","0.878","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500645","5.9915","0.0001","14.2038","0.0003","9.9003","0.0002","90","","96.679","0.001","90","","836.82","0.03","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H22 Cl N O3 -","- C18 H22 Cl N O3 -","- C36 H44 Cl2 N2 O6 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.0441","0.0408","","","0.1012","0.1033","","","","","","1.188","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500646","6.0437","0.0002","14.1258","0.0003","9.9363","0.0003","90","","98.017","0.003","90","","839.99","0.04","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C38 H50 N2 O6 -","2","1","","Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William","Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine","Crystal Growth & Design","2011","11","5","1821","","10.1021/cg200030s","","","0.71073","MoKα","","0.043","0.034","","","0.0663","0.0682","","","","","","0.949","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500647","6.0187","0.0003","5.3451","0.0003","9.9651","0.0004","90","","92.604","0.002","90","","320.25","0.03","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,5-dichloro 1,4-benzoquinone","","","- C6 H2 Cl2 O2 -","- C6 H2 Cl2 O2 -","- C12 H4 Cl4 O4 -","2","0.5","","Hathwar, Venkatesha R.; Gonnade, Rajesh G.; Munshi, Parthapratim; Bhadbhade, Mohan M.; Guru Row, Tayur N.","Halogen Bonding in 2,5-Dichloro-1,4-benzoquinone: Insights from Experimental and Theoretical Charge Density Analysis","Crystal Growth & Design","2011","11","5","1855","","10.1021/cg2000415","","x-ray","0.71073","MoKα","","0.0157","0.0116","","","","0.016","","","","","","1.003","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500648","27.422","0.003","27.422","0.003","38.087","0.008","90","","90","","120","","24803","6","113.15","","113.15","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C30 H14 Co3 N4 O17 -","- C30 H14 Co3 N4 O17 -","- C540 H252 Co54 N72 O306 -","18","0.5","","Chang, Ze; Zhang, Da-Shuai; Hu, Tong-Liang; Bu, Xian-He","Microporous Metal‒Organic Framework Based on Supermolecular Building Blocks (SBBs): Structure Analysis and Selective Gas Adsorption Properties","Crystal Growth & Design","2011","11","6","2050","","10.1021/cg200043a","","","0.71073","MoKα","","0.0848","0.0677","","","0.1793","0.1938","","","","","","1.081","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500649","7.4045","0.0001","7.4045","0.0001","12.2053","0.0002","90","","90","","120","","579.523","0.015","293","2","293","2","","","","","","","","4","P 63","P 6c","173","","","","- Cs2 Mo3 O12 Te -","- Cs2 Mo3 O12 Te -","- Cs4 Mo6 O24 Te2 -","2","0.333333","","Zhang, Junjie; Tao, Xutang; Sun, Youxuan; Zhang, Zhonghan; Zhang, Chengqian; Gao, Zeliang; Xia, Haibing; Xia, Shengqing","Top-Seeded Solution Growth, Morphology, and Properties of a Polar Crystal Cs2TeMo3O12","Crystal Growth & Design","2011","11","5","1863","","10.1021/cg200050g","","","0.71073","MoKα","","0.0139","0.0138","","","0.0318","0.0318","","","","","","1.2","","","","has coordinates","202022","2020-10-21","18:00:00",""
"4500650","5.7335","0.0011","10.5","0.002","19.088","0.004","98.09","0.03","93.79","0.03","91.46","0.03","1134.5","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Eu(OTf)3 3CH3CN","Europium(III)triflate acetonitrile solvate","","- C9 H9 Eu F9 N3 O9 S3 -","- C9 H9 Eu F9 N3 O9 S3 -","- C18 H18 Eu2 F18 N6 O18 S6 -","2","1","","Tang, Sifu; Mudring, Anja-Verena","Ionic Liquids as Crystallization Media: Weakly-Coordinating Anions Do Coordinate in1∞[Eu(OTf)3(CH3CN)3]","Crystal Growth & Design","2011","11","5","1437","","10.1021/cg200064n","","","0.71073","MoKα","","0.0411","0.0332","","","0.0756","0.0783","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500651","6.709","0.002","11.932","0.005","12.869","0.004","107.062","0.013","95.121","0.012","100.054","0.014","958.9","0.6","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H26 Cu3 N12 O18 -","- C40 H26 Cu3 N12 O18 -","- C40 H26 Cu3 N12 O18 -","1","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71075","MoKα","","0.0325","0.0297","","","0.0747","0.0759","","","","","","1.113","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500652","26.458","0.008","6.5936","0.0015","16.939","0.005","90","","118.205","0.012","90","","2604.2","1.3","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 Co N6 O15 -","- C20 H18 Co N6 O15 -","- C80 H72 Co4 N24 O60 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71075","MoKα","","0.0401","0.0368","","","0.0988","0.101","","","","","","1.12","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500653","26.495","0.004","6.6189","0.0011","16.996","0.003","90","","118.296","0.008","90","","2624.4","0.8","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 N6 Ni O15 -","- C20 H26 N6 Ni O15 -","- C80 H104 N24 Ni4 O60 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71075","MoKα","","0.0965","0.0625","","","0.1325","0.1476","","","","","","1.056","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500654","17.949","0.003","12.708","0.003","9.6065","0.0016","90","","112.333","0.004","90","","2026.8","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Mn N6 O8 -","- C20 H12 Mn N6 O8 -","- C80 H48 Mn4 N24 O32 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71073","MoKα","","0.0379","0.0333","","","0.0823","0.0844","","","","","","1.032","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500655","20.064","0.005","7.7666","0.0019","17.11","0.004","90","","122.82","0.004","90","","2240.6","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 Cu2 N6 O13 -","- C20 H20 Cu2 N6 O13 -","- C80 H80 Cu8 N24 O52 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71073","MoKα","","0.0478","0.0373","","","0.0795","0.0825","","","","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500656","20.555","0.003","7.4526","0.001","17.229","0.003","90","","123.504","0.005","90","","2200.8","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 Co2 N6 O13 -","- C20 H20 Co2 N6 O13 -","- C80 H80 Co8 N24 O52 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71073","MoKα","","0.038","0.0354","","","0.0996","0.1016","","","","","","1.067","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500657","20.625","0.004","7.3923","0.0015","17.25","0.003","90","","123.574","0.003","90","","2191.3","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 N6 Ni2 O13 -","- C20 H20 N6 Ni2 O13 -","- C80 H80 N24 Ni8 O52 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71073","MoKα","","0.0367","0.0339","","","0.106","0.1088","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500658","10.531","0.003","14.549","0.006","7.681","0.003","90","","90","","90","","1176.8","0.7","200","","200","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C10 H11 Mn N3 O7 -","- C10 H11 Mn N3 O7 -","- C40 H44 Mn4 N12 O28 -","4","0.5","","Chen, Min; Chen, Shui-Sheng; Okamura, Taka-aki; Su, Zhi; Chen, Man-Sheng; Zhao, Yue; Sun, Wei-Yin; Ueyama, Norikazu","pH Dependent Structural Diversity of Metal Complexes with 5-(4H-1,2,4-Triazol-4-yl)benzene-1,3-dicarboxylic Acid","Crystal Growth & Design","2011","11","5","1901","","10.1021/cg200068v","","","0.71075","MoKα","","0.0276","0.0258","","","0.07","0.071","","","","","","1.136","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500659","23.376","0.007","13.341","0.003","23.042","0.005","90","","105.768","0.009","90","","6915","3","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","tris(2,6-dimethyl-4-hydroxyphenyl)benzene","1,3,5-tris(2,6-dimethyl-4-hydroxyphenyl)benzene","","- C81 H84 O6 -","- C81 H84 O6 -","- C324 H336 O24 -","4","0.5","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.1624","0.0852","","","0.1936","0.2261","","","","","","1.05","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500660","23.562","0.005","13.96","0.005","28.168","0.007","90","","113.151","0.008","90","","8519","4","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","tris(2,6-dimethyl-4-hydroxyphenyl)benzene","1,3,5-tris(2,6-dimethyl-4-hydroxyphenyl)benzene","","- C88 H124 O23 -","- C88 H118 O23 -","- C352 H472 O92 -","4","0.5","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.1695","0.1033","","","0.2736","0.3162","","","","","","1.086","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500661","13.932","0.003","11.104","0.002","28.633","0.006","90","","100.752","0.004","90","","4351.8","1.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","tris(2,6-dimethyl-4-hydroxyphenyl)benzene","tris(2,6-dimethyl-4-hydroxyphenyl)benzene","","- C44 H63 N O12 -","- C44 H63 N O12 -","- C176 H252 N4 O48 -","4","1","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.1278","0.0656","","","0.1221","0.1398","","","","","","1.034","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500662","23.0586","0.0018","23.0586","0.0018","7.4775","0.0008","90","","90","","90","","3975.8","0.6","100","2","100","2","","","","","","","","3","I 4 c m","I 4 -2c","108","1,3,5-tris(4-hydroxyphenyl)mesitylene","1,3,5-tris(4-hydroxyphenyl)mesitylene","","- C27 H24 O3 -","- C28 H24 O3 -","- C224 H192 O24 -","8","0.5","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.0447","0.0401","","","0.0996","0.1027","","","","","","1.046","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500663","10.446","0.005","13.758","0.007","16.201","0.008","108.821","0.007","93.859","0.01","108.646","0.009","2050.1","1.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1,3,5-tris(4-hydroxyphenyl)mesitylene","1,3,5-tris(4-hydroxyphenyl)mesitylene","","- C39 H52 O11 -","- C39 H48 O11 -","- C78 H96 O22 -","2","1","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.2135","0.1315","","","0.3219","0.3736","","","","","","1.092","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500664","21.037","0.003","21.037","0.003","53.66","0.011","90","","90","","120","","20566","6","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","tris(2,12-dimethyl-8-hydroxybiphenyl)benzene","1,3,5-tris(2,12-dimethyl-8-hydroxybiphenyl)benzene","","- C276 H375 N3 O72 -","- C276 H327 N3 O71.94 -","- C828 H981 N9 O215.82 -","3","0.166667","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.1981","0.118","","","0.3001","0.3498","","","","","","1.134","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500665","34.693","0.005","34.693","0.005","7.198","0.003","90","","90","","90","","8664","4","100","2","100","2","","","","","","","","3","I -4","I -4","82","1,3,5-tris(4-hydroxybiphenyl)mesitylene","1,3,5-tris(4-hydroxybiphenyl)mesitylene","","- C52 H44 O3 -","- C52 H44 O3 -","- C416 H352 O24 -","8","1","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.1527","0.0934","","","0.2188","0.2513","","","","","","1.062","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500666","9.393","0.001","22.498","0.001","37.809","0.009","90","","90","","90","","7990","2","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,3,5-tris(4-hydroxybiphenyl)mesitylene","1,3,5-tris(4-hydroxybiphenyl)mesitylene","","- C85 H97 O12 -","- C85 H91 O12 -","- C340 H364 O48 -","4","1","","Moorthy, Jarugu Narasimha; Natarajan, Palani; Bajpai, Alankriti; Venugopalan, Paloth","Trigonal Rigid Triphenols: Self-Assembly and Multicomponent Lattice Inclusion","Crystal Growth & Design","2011","11","8","3406","","10.1021/cg200074z","","","0.71073","MoKα","","0.1927","0.1046","","","0.2318","0.2699","","","","","","1.061","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500667","13.371","0.003","33.458","0.008","36.582","0.009","90","","95.539","0.004","90","","16289","7","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- Co6 Cs3 Ge3 H90 K3 O159 W33 -","- Co6 Cs3 Ge3 K3 O159 W33 -","- Co24 Cs12 Ge12 K12 O636 W132 -","4","1","","Chen, Lijuan; Shi, Dongying; Zhao, Junwei; Wang, Yulong; Ma, Pengtao; Wang, Jingping; Niu, Jingyang","Three Transition-Metal Substituted Polyoxotungstates Containing Keggin Fragments: From Trimer to One-Dimensional Chain to Two-Dimensional Sheet","Crystal Growth & Design","2011","11","5","1913","","10.1021/cg200077r","","","0.71073","MoKα","","0.1012","0.075","","","0.1914","0.2043","","","","","","1.024","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500668","12.722","0.011","17.742","0.016","20.62","0.019","91.844","0.015","107.857","0.015","108.924","0.015","4146","6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- H72 K18 Mn9 O156 Si4 W34 -","- K6 Mn9 O156 Si4 W34 -","- K6 Mn9 O156 Si4 W34 -","1","0.5","","Chen, Lijuan; Shi, Dongying; Zhao, Junwei; Wang, Yulong; Ma, Pengtao; Wang, Jingping; Niu, Jingyang","Three Transition-Metal Substituted Polyoxotungstates Containing Keggin Fragments: From Trimer to One-Dimensional Chain to Two-Dimensional Sheet","Crystal Growth & Design","2011","11","5","1913","","10.1021/cg200077r","","","0.71073","MoKα","","0.2012","0.1062","","","0.2548","0.3116","","","","","","1.018","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500669","23.838","0.008","12.084","0.004","30.45","0.01","90","","96.985","0.005","90","","8706","5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Cd6 H56 K8 O96 Si2 W18 -","- Cd6 K8 O96 Si2 W18 -","- Cd24 K32 O384 Si8 W72 -","4","0.5","","Chen, Lijuan; Shi, Dongying; Zhao, Junwei; Wang, Yulong; Ma, Pengtao; Wang, Jingping; Niu, Jingyang","Three Transition-Metal Substituted Polyoxotungstates Containing Keggin Fragments: From Trimer to One-Dimensional Chain to Two-Dimensional Sheet","Crystal Growth & Design","2011","11","5","1913","","10.1021/cg200077r","","","0.71073","MoKα","","0.0364","0.0325","","","0.0762","0.078","","","","","","1.029","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500670","8.181","0.003","8.421","0.003","10.25","0.004","98.774","0.006","95.521","0.006","114.52","0.006","624.9","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H20 Br2 N4 O6 S2 -","- C22 H20 Br2 N4 O6 S2 -","- C22 H20 Br2 N4 O6 S2 -","1","0.5","","Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini","Sulfonamide−Pyridine-N-oxide Cocrystals","Crystal Growth & Design","2011","11","5","1930","","10.1021/cg200094x","","","0.71073","MoKα","","0.0329","0.0299","","","0.0747","0.0764","","","","","","1.11","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500671","7.8871","0.0005","7.8871","0.0005","51.1","0.007","90","","90","","90","","3178.7","0.5","100","2","100","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C16 H14 Cl N3 O4 S -","- C16 H14 Cl N3 O4 S -","- C128 H112 Cl8 N24 O32 S8 -","8","1","","Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini","Sulfonamide−Pyridine-N-oxide Cocrystals","Crystal Growth & Design","2011","11","5","1930","","10.1021/cg200094x","","","0.71073","MoKα","","0.0325","0.0325","","","0.078","0.0781","","","","","","1.151","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500672","8.7426","0.0008","5.2061","0.0005","27.7269","0.0019","90","","102.935","0.002","90","","1229.96","0.18","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N4 O8 S2 -","- C24 H26 N4 O8 S2 -","- C48 H52 N8 O16 S4 -","2","0.5","","Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini","Sulfonamide−Pyridine-N-oxide Cocrystals","Crystal Growth & Design","2011","11","5","1930","","10.1021/cg200094x","","","0.71073","MoKα","","0.0422","0.0397","","","0.1017","0.1036","","","","","","1.082","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500673","5.2214","0.0004","9.586","0.0008","20.154","0.0017","85.222","0.001","88.759","0.001","74.826","0.001","970.2","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H17 Cl N4 O7 S -","- C18 H17 Cl N4 O7 S -","- C36 H34 Cl2 N8 O14 S2 -","2","1","","Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini","Sulfonamide−Pyridine-N-oxide Cocrystals","Crystal Growth & Design","2011","11","5","1930","","10.1021/cg200094x","","","0.71073","MoKα","","0.0336","0.0317","","","0.0834","0.0849","","","","","","1.038","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500674","10.317","0.0009","12.3913","0.001","20.0553","0.0017","90","","103.728","0.001","90","","2490.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N4 O6 S2 -","- C24 H26 N4 O6 S2 -","- C96 H104 N16 O24 S8 -","4","1","","Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini","Sulfonamide−Pyridine-N-oxide Cocrystals","Crystal Growth & Design","2011","11","5","1930","","10.1021/cg200094x","","","0.71073","MoKα","","0.0362","0.0335","","","0.0878","0.09","","","","","","1.017","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500675","8.023","0.0006","8.3201","0.0006","17.5479","0.0012","77.734","0.001","77.52","0.001","81.286","0.001","1110.71","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H19 Cl N4 O7.5 S -","- C22 H19 Cl N4 O7.25 S -","- C44 H38 Cl2 N8 O14.5 S2 -","2","1","","Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini","Sulfonamide−Pyridine-N-oxide Cocrystals","Crystal Growth & Design","2011","11","5","1930","","10.1021/cg200094x","","","0.71073","MoKα","","0.0406","0.0376","","","0.0953","0.0973","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500676","8.9954","0.0008","9.7521","0.0005","14.1574","0.001","74.025","0.006","75.373","0.007","80.65","0.006","1149.5","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H24 N6 -","- C28 H24 N6 -","- C56 H48 N12 -","2","1","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Liu, Bo; Liu, Yun-Yu; Ma, Jian-Fang","pH-Dependent Assembly of 1D to 3D Octamolybdate Hybrid Materials Based on a New Flexible Bis-[(pyridyl)-benzimidazole] Ligand","Crystal Growth & Design","2011","11","7","2920","","10.1021/cg200095c","","","0.71073","MoKα","","0.1395","0.0525","","","0.1139","0.1593","","","","","","0.809","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500677","9.6482","0.0004","9.8674","0.0004","14.1812","0.0007","96.766","0.004","102.504","0.004","116.635","0.004","1141.92","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H32 Mo8 N6 O28 -","- C28 H32 Mo8 N6 O28 -","- C28 H32 Mo8 N6 O28 -","1","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Liu, Bo; Liu, Yun-Yu; Ma, Jian-Fang","pH-Dependent Assembly of 1D to 3D Octamolybdate Hybrid Materials Based on a New Flexible Bis-[(pyridyl)-benzimidazole] Ligand","Crystal Growth & Design","2011","11","7","2920","","10.1021/cg200095c","","","0.71073","MoKα","","0.0513","0.0279","","","0.0581","0.0788","","","","","","0.921","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500678","10.398","0.005","35.826","0.005","13.418","0.005","90","0.005","108.416","0.005","90","0.005","4742","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 Cu Mo8 N6 O31 -","- C28 H36 Cu Mo8 N6 O31 -","- C112 H144 Cu4 Mo32 N24 O124 -","4","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Liu, Bo; Liu, Yun-Yu; Ma, Jian-Fang","pH-Dependent Assembly of 1D to 3D Octamolybdate Hybrid Materials Based on a New Flexible Bis-[(pyridyl)-benzimidazole] Ligand","Crystal Growth & Design","2011","11","7","2920","","10.1021/cg200095c","","","0.71073","MoKα","","0.0479","0.0273","","","0.0614","0.0657","","","","","","0.953","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500679","7.914","0.005","10.423","0.005","13.808","0.005","91.308","0.005","96.509","0.005","100.792","0.005","1110.5","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H32 Cu Mo8 N6 O29 -","- C28 H30 Cu Mo8 N6 O29 -","- C28 H30 Cu Mo8 N6 O29 -","1","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Liu, Bo; Liu, Yun-Yu; Ma, Jian-Fang","pH-Dependent Assembly of 1D to 3D Octamolybdate Hybrid Materials Based on a New Flexible Bis-[(pyridyl)-benzimidazole] Ligand","Crystal Growth & Design","2011","11","7","2920","","10.1021/cg200095c","","","0.71073","MoKα","","0.037","0.028","","","0.0677","0.0699","","","","","","0.965","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500680","10.9471","0.0003","11.5905","0.0004","14.5109","0.0005","104.956","0.003","95.054","0.002","110.967","0.003","1627.46","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H50 Cu Mo8 N12 O26 -","- C56 H50 Cu Mo8 N12 O26 -","- C56 H50 Cu Mo8 N12 O26 -","1","0.5","","Liu, Hai-Yan; Wu, Hua; Yang, Jin; Liu, Ying-Ying; Liu, Bo; Liu, Yun-Yu; Ma, Jian-Fang","pH-Dependent Assembly of 1D to 3D Octamolybdate Hybrid Materials Based on a New Flexible Bis-[(pyridyl)-benzimidazole] Ligand","Crystal Growth & Design","2011","11","7","2920","","10.1021/cg200095c","","","0.71073","MoKα","","0.0942","0.0429","","","0.0929","0.1082","","","","","","0.903","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500681","12.6602","0.0009","12.6602","0.0009","28.733","0.004","90","","90","","120","","3988.3","0.7","291","2","291","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C52 H70 N O9 -","- C52 H70 N O9 -","- C156 H210 N3 O27 -","3","0.5","","Guan, Yang-Fan; Li, Zheng-Yi; Ni, Meng-Fei; Lin, Chen; Jiang, Juli; Li, Yi-Zhi; Wang, Leyong","Chiral Moieties-Oriented Single-Stranded Helical Assembly of Calix[4]azacrown Derivatives","Crystal Growth & Design","2011","11","7","2684","","10.1021/cg2000975","","","0.71073","MoKα","","0.077","0.0606","","","0.1363","0.1403","","","","","","1.09","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500682","12.6547","0.0012","12.6547","0.0012","28.776","0.005","90","","90","","120","","3990.8","0.9","291","2","291","2","","","","","","","","4","P 32 2 1","P 32 2""","154","","","","- C52 H70 N O9 -","- C52 H70 N O9 -","- C156 H210 N3 O27 -","3","0.5","","Guan, Yang-Fan; Li, Zheng-Yi; Ni, Meng-Fei; Lin, Chen; Jiang, Juli; Li, Yi-Zhi; Wang, Leyong","Chiral Moieties-Oriented Single-Stranded Helical Assembly of Calix[4]azacrown Derivatives","Crystal Growth & Design","2011","11","7","2684","","10.1021/cg2000975","","","0.71073","MoKα","","0.0694","0.0512","","","0.0962","0.0999","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500683","11.9708","0.0013","34.928","0.003","12.444","0.002","90","","110.505","0.001","90","","4873.4","1","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C108 H146 N2 O16 -","- C108 H146 N2 O16 -","- C216 H292 N4 O32 -","2","1","","Guan, Yang-Fan; Li, Zheng-Yi; Ni, Meng-Fei; Lin, Chen; Jiang, Juli; Li, Yi-Zhi; Wang, Leyong","Chiral Moieties-Oriented Single-Stranded Helical Assembly of Calix[4]azacrown Derivatives","Crystal Growth & Design","2011","11","7","2684","","10.1021/cg2000975","","","","","","0.079","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500684","7.1113","0.0003","13.3625","0.0005","13.6784","0.0005","102.423","0.002","104.864","0.002","101.286","0.002","1182.74","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","potassium uranyl phthalate","","","- C16 H8 K O17 U3 -","- C16 H8 K O17 U3 -","- C32 H16 K2 O34 U6 -","2","1","","Mihalcea, Ionut; Henry, Natacha; Loiseau, Thierry","Revisiting the Uranyl-phthalate System: Isolation and Crystal Structures of Two Types of Uranyl−Organic Frameworks (UOF)","Crystal Growth & Design","2011","11","5","1940","","10.1021/cg200106j","","","0.71073","MoKα","","0.061","0.0443","","","0.1227","0.1352","","","","","","1.146","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500685","7.2962","0.0003","13.3376","0.0004","13.685","0.0004","102.294","0.002","105.175","0.002","101.557","0.002","1208.64","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H8 N O17 U3 -","- C16 H8 N O17 U3 -","- C32 H16 N2 O34 U6 -","2","1","","Mihalcea, Ionut; Henry, Natacha; Loiseau, Thierry","Revisiting the Uranyl-phthalate System: Isolation and Crystal Structures of Two Types of Uranyl−Organic Frameworks (UOF)","Crystal Growth & Design","2011","11","5","1940","","10.1021/cg200106j","","","0.71073","MoKα","","0.0395","0.0256","","","0.0588","0.0731","","","","","","1.135","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500686","30.5385","0.0007","30.5385","0.0007","5.8489","0.0002","90","","90","","120","","4723.9","0.2","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C12 H9 O11 U1.5 -","- C12 H9 O11 U1.5 -","- C144 H108 O132 U18 -","12","0.666667","","Mihalcea, Ionut; Henry, Natacha; Loiseau, Thierry","Revisiting the Uranyl-phthalate System: Isolation and Crystal Structures of Two Types of Uranyl−Organic Frameworks (UOF)","Crystal Growth & Design","2011","11","5","1940","","10.1021/cg200106j","","","0.71073","MoKα","","0.0355","0.0221","","","0.0629","0.0674","","","","","","1.31","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500687","30.181","0.006","9.0918","0.0018","17.92","0.004","90","","125.66","0.03","90","","3995","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H28 Ag N2 O8 -","- C15 H28 Ag N2 O8 -","- C120 H224 Ag8 N16 O64 -","8","1","","Luo, Geng-Geng; Xiong, Hong-Bo; Sun, Di; Wu, Dong-Liang; Huang, Rong-Bin; Dai, Jing-Cao","A Discrete Spirocyclic (H2O)9Cluster and 1D Novel Water Chain with Tetrameric and Octameric Clusters in Cationic Hosts","Crystal Growth & Design","2011","11","5","1948","","10.1021/cg200111j","","","0.71073","MoKα","","0.0446","0.0362","","","0.1236","0.1411","","","","","","1.087","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500688","13.6","0.003","15.107","0.003","33","0.007","90","","90","","90","","6780","2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C28 H46 Ag2 N4 O13 -","- C28 H46 Ag2 N4 O13 -","- C224 H368 Ag16 N32 O104 -","8","0.25","","Luo, Geng-Geng; Xiong, Hong-Bo; Sun, Di; Wu, Dong-Liang; Huang, Rong-Bin; Dai, Jing-Cao","A Discrete Spirocyclic (H2O)9Cluster and 1D Novel Water Chain with Tetrameric and Octameric Clusters in Cationic Hosts","Crystal Growth & Design","2011","11","5","1948","","10.1021/cg200111j","","","0.71073","MoKα","","0.0221","0.0207","","","0.0532","0.054","","","","","","1.066","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500689","21.693","0.004","18.321","0.003","22.792","0.004","90","","117.959","0.002","90","","8001","2","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C72 H50 Co3 N12 O28 -","- C72 H46 Co3 N12 O28 -","- C288 H184 Co12 N48 O112 -","4","0.5","","Zhang, Jian-Yong; Jing, Xue-Hui; Ma, Yu; Cheng, Ai-Ling; Gao, En-Qing","Interpenetration, Self-Catenation, and New Topology in Metal‒Organic Frameworks of Cobalt with Mixed Organic Linkers","Crystal Growth & Design","2011","11","9","3681","","10.1021/cg200120p","","","0.71073","MoKα","","0.092","0.0585","","","0.1534","0.1794","","","","","","0.99","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500690","13.725","0.004","15.197","0.005","20.131","0.009","96.855","0.006","100.123","0.006","113.155","0.004","3717","2","298","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H55 Co3 N11 O27.5 -","- C72 H52 Co3 N11 O27.5 -","- C144 H104 Co6 N22 O55 -","2","1","","Zhang, Jian-Yong; Jing, Xue-Hui; Ma, Yu; Cheng, Ai-Ling; Gao, En-Qing","Interpenetration, Self-Catenation, and New Topology in Metal‒Organic Frameworks of Cobalt with Mixed Organic Linkers","Crystal Growth & Design","2011","11","9","3681","","10.1021/cg200120p","","","0.71073","MoKα","","0.154","0.0941","","","0.1965","0.2286","","","","","","1.058","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500691","12.923","0.008","19.427","0.013","21.115","0.014","95.816","0.011","93.135","0.011","96.147","0.012","5232","6","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H80 Ce Cu3.5 N18 O80 P2 W22 -","- C26 H76 Ce Cu3.5 N18 O80 P2 W22 -","- C52 H152 Ce2 Cu7 N36 O160 P4 W44 -","2","1","","Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping","1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals","Crystal Growth & Design","2011","11","9","3769","","10.1021/cg2001249","","","0.71073","MoKα","","0.1637","0.073","","","0.1371","0.1545","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500692","13.0173","0.0006","19.3803","0.0009","21.5028","0.0009","96.007","0.001","95.311","0.001","95.713","0.001","5339","0.4","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H93 Cu3.5 N18 O86.5 P2 Pr W22 -","- C26 H72 Cu3.5 N18 O86.5 P2 Pr W22 -","- C52 H144 Cu7 N36 O173 P4 Pr2 W44 -","2","1","","Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping","1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals","Crystal Growth & Design","2011","11","9","3769","","10.1021/cg2001249","","","0.71073","MoKα","","0.0669","0.044","","","0.0866","0.0932","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500693","13.7083","0.0016","19.323","0.002","25.369","0.003","105.421","0.002","104.048","0.002","99.871","0.002","6080.9","1.2","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H101 Cu5 Gd N20 O88 P2 W22 -","- C36 H80 Cu5 Gd N20 O88 P2 W22 -","- C72 H160 Cu10 Gd2 N40 O176 P4 W44 -","2","1","","Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping","1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals","Crystal Growth & Design","2011","11","9","3769","","10.1021/cg2001249","","","0.71073","MoKα","","0.0769","0.0641","","","0.1592","0.1669","","","","","","1.015","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500694","13.702","0.0008","19.324","0.001","25.3506","0.0014","105.382","0.001","104.017","0.001","99.958","0.001","6074","0.6","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H102 Cu5 N20 O88.5 P2 Tb W22 -","- C36 H80 Cu5 N20 O88.5 P2 Tb W22 -","- C72 H160 Cu10 N40 O177 P4 Tb2 W44 -","2","1","","Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping","1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals","Crystal Growth & Design","2011","11","9","3769","","10.1021/cg2001249","","","0.71073","MoKα","","0.0692","0.0443","","","0.0831","0.0913","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500695","13.7089","0.0013","19.2704","0.0018","25.333","0.002","105.13","0.002","104.191","0.001","99.847","0.002","6062.6","0.9","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H102 Cu5 Er N20 O88.5 P2 W22 -","- C36 H80 Cu5 Er N20 O88.5 P2 W22 -","- C72 H160 Cu10 Er2 N40 O177 P4 W44 -","2","1","","Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping","1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals","Crystal Growth & Design","2011","11","9","3769","","10.1021/cg2001249","","","0.71073","MoKα","","0.0526","0.0381","","","0.0847","0.0894","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500696","15.563","0.012","19.967","0.016","20.922","0.016","116.419","0.015","91.769","0.015","94.845","0.016","5785","8","296","2","296","2","","","","","","","","9","P -1","-P 1","2","","","","- C20 H59 Cu3 N12 Na2 Nd O81 P2 W22 -","- C20 H48 Cu3 N12 Na2 Nd O81 P2 W22 -","- C40 H96 Cu6 N24 Na4 Nd2 O162 P4 W44 -","2","1","","Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping","1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals","Crystal Growth & Design","2011","11","9","3769","","10.1021/cg2001249","","","0.71073","MoKα","","0.1528","0.0842","","","0.1479","0.157","","","","","","1.003","","","","has coordinates,has disorder","179537","2020-10-21","18:00:00",""
"4500697","26.4013","0.0004","26.4013","0.0004","26.4013","0.0004","90","","90","","90","","18402.5","0.5","100","2","293","2","","","","","","","","6","I m -3","-I 2 2 3","204","","","","- C6 H6 Mn2 O47.3 P3 U6 -","- C6 H6 Mn2 O47.3 P3 U6 -","- C96 H96 Mn32 O756.8 P48 U96 -","16","0.333333","","Alsobrook, Andrea N.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","Incorporation of Mn(II) and Fe(II) into Uranyl Carboxyphosphonates","Crystal Growth & Design","2011","11","6","2358","","10.1021/cg200127a","","","0.71073","MoKα","","0.0218","0.0185","","","0.04","0.0411","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500698","12.7708","0.0013","14.5298","0.0014","18.8587","0.0019","82.784","0.001","72.179","0.001","79.385","0.001","3265.5","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H12 Mn4 O57.75 P6 U5 -","- C12 H12 Mn4 O57.92 P6 U5 -","- C24 H24 Mn8 O115.84 P12 U10 -","2","1","","Alsobrook, Andrea N.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","Incorporation of Mn(II) and Fe(II) into Uranyl Carboxyphosphonates","Crystal Growth & Design","2011","11","6","2358","","10.1021/cg200127a","","","0.71073","MoKα","","0.0474","0.0389","","","0.1013","0.1065","","","","","","0.892","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500699","6.7914","0.0003","17.5941","0.0009","10.1757","0.0005","90","","98.607","0.001","90","","1202.19","0.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H4 Mn2 O26 P2 U3 -","- C4 H4 Mn2 O26 P2 U3 -","- C8 H8 Mn4 O52 P4 U6 -","2","0.5","","Alsobrook, Andrea N.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","Incorporation of Mn(II) and Fe(II) into Uranyl Carboxyphosphonates","Crystal Growth & Design","2011","11","6","2358","","10.1021/cg200127a","","","0.71073","MoKα","","0.0213","0.0194","","","0.051","0.0517","","","","","","1.133","","","","has coordinates","179537","2020-10-21","18:00:00",""
"4500700","20.62","0.004","9.4956","0.0016","13.384","0.002","90","","104.987","0.002","90","","2531.4","0.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 Fe O28 P2 U2 -","- C4 H4 Fe O28 P2 U2 -","- C16 H16 Fe4 O112 P8 U8 -","4","0.5","","Alsobrook, Andrea N.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","Incorporation of Mn(II) and Fe(II) into Uranyl Carboxyphosphonates","Crystal Growth & Design","2011","11","6","2358","","10.1021/cg200127a","","","0.71073","MoKα","","0.0259","0.0243","","","0.0684","0.0696","","","","","","1.104","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500701","7.0208","0.0003","8.2937","0.0003","11.0388","0.0005","80.96","0.001","74.05","0.001","89.85","0.001","609.79","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H4 Fe O26 P2 U2 -","- C4 H4 Fe O26 P2 U2 -","- C4 H4 Fe O26 P2 U2 -","1","0.5","","Alsobrook, Andrea N.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","Incorporation of Mn(II) and Fe(II) into Uranyl Carboxyphosphonates","Crystal Growth & Design","2011","11","6","2358","","10.1021/cg200127a","","","0.71073","MoKα","","0.0198","0.0195","","","0.0495","0.0497","","","","","","1.057","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500702","11.237","0.0005","20.8524","0.0009","14.6189","0.0007","90","","104.997","0.001","90","","3308.8","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H40 F2 N2 O39 P8 U6 -","- C32 H40 F2 N2 O39 P8 U6 -","- C64 H80 F4 N4 O78 P16 U12 -","2","0.5","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Hydrothermal Synthesis and Structural Characterization of Organically Templated Uranyl Diphosphonate Compounds","Crystal Growth & Design","2011","11","5","1966","","10.1021/cg200129g","","","0.71073","MoKα","","0.0359","0.026","","","0.0512","0.0548","","","","","","1.022","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500703","16.651","0.004","20.376","0.004","8.7419","0.0019","90","","90","","90","","2966","1.1","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C40 H56 N2 O30 P8 U2 -","- C40 H58 N2 O30 P8 U2 -","- C80 H116 N4 O60 P16 U4 -","2","0.25","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Hydrothermal Synthesis and Structural Characterization of Organically Templated Uranyl Diphosphonate Compounds","Crystal Growth & Design","2011","11","5","1966","","10.1021/cg200129g","","","0.71073","MoKα","","0.0579","0.0391","","","0.0907","0.1004","","","","","","1.057","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500704","8.5409","0.0006","19.1605","0.0013","11.3037","0.0008","90","","110.327","0.001","90","","1734.6","0.2","100","2","100","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C18 H26 F N O19 P4 U3 -","- C17.67 H25.85 F N O19 P4 U3 -","- C35.34 H51.7 F2 N2 O38 P8 U6 -","2","0.5","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Hydrothermal Synthesis and Structural Characterization of Organically Templated Uranyl Diphosphonate Compounds","Crystal Growth & Design","2011","11","5","1966","","10.1021/cg200129g","","","0.71073","MoKα","","0.023","0.0185","","","0.0404","0.0417","","","","","","1.054","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500705","12.8912","0.0006","13.1722","0.0005","17.114","0.0007","90","","96.0184","0.0014","90","","2890","0.2","173.1","","173.1","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 Cu F12 N4 O P2 -","- C23 H23 Cu F12 N4 O P2 -","- C92 H92 Cu4 F48 N16 O4 P8 -","4","1","","Noro, Shin-ichiro; Fukuhara, Katsuo; Kubo, Kazuya; Nakamura, Takayoshi","Rational Construction of Wide Coordination Space and Control of Adsorption Properties in One-Dimensional Cu(II) Coordination Polymer","Crystal Growth & Design","2011","11","6","2379","","10.1021/cg2001392","","","0.71075","MoKα","","","0.0442","","","","0.0587","","","","","","1.209","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500706","13.135","0.003","13.453","0.004","13.51","0.004","110.197","0.004","92.133","0.003","93.261","0.004","2232.7","1.1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H46 N8 O9 Zn2 -","- C48 H46 N8 O9 Zn2 -","- C96 H92 N16 O18 Zn4 -","2","1","","Jia, Weiwei; Luo, Junhua; Zhu, Miaoli","A Molecular Basketwork: Self-Assembly of Coordination Polymers from Zn(II) and Biphenyl-3,4′-dicarboxylate Regulated by Different Flexible Bridging and Chelating N-Donor Ancillary Ligands","Crystal Growth & Design","2011","11","6","2386","","10.1021/cg200142f","","","0.71073","MoKα","","0.0454","0.0385","","","0.1125","0.1266","","","","","","1.207","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500707","16.08","0.006","15.054","0.006","19.34","0.007","90","","90","","90","","4682","3","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H20 N2 O6 Zn -","- C26 H20 N2 O6 Zn -","- C208 H160 N16 O48 Zn8 -","8","1","","Jia, Weiwei; Luo, Junhua; Zhu, Miaoli","A Molecular Basketwork: Self-Assembly of Coordination Polymers from Zn(II) and Biphenyl-3,4′-dicarboxylate Regulated by Different Flexible Bridging and Chelating N-Donor Ancillary Ligands","Crystal Growth & Design","2011","11","6","2386","","10.1021/cg200142f","","","0.71073","MoKα","","0.0972","0.0931","","","0.182","0.184","","","","","","1.388","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500708","16.176","0.012","14.453","0.011","19.137","0.015","90","","90","","90","","4474","6","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H20 N2 O6 Zn -","- C24 H20 N2 O6 Zn -","- C192 H160 N16 O48 Zn8 -","8","1","","Jia, Weiwei; Luo, Junhua; Zhu, Miaoli","A Molecular Basketwork: Self-Assembly of Coordination Polymers from Zn(II) and Biphenyl-3,4′-dicarboxylate Regulated by Different Flexible Bridging and Chelating N-Donor Ancillary Ligands","Crystal Growth & Design","2011","11","6","2386","","10.1021/cg200142f","","","0.71073","MoKα","","0.0859","0.0727","","","0.222","0.2363","","","","","","1.137","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500709","13.682","0.004","14.692","0.005","6.0405","0.0018","90","","97.086","0.005","90","","1205","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 O5 Zn -","- C14 H10 O5 Zn -","- C56 H40 O20 Zn4 -","4","1","","Jia, Weiwei; Luo, Junhua; Zhu, Miaoli","A Molecular Basketwork: Self-Assembly of Coordination Polymers from Zn(II) and Biphenyl-3,4′-dicarboxylate Regulated by Different Flexible Bridging and Chelating N-Donor Ancillary Ligands","Crystal Growth & Design","2011","11","6","2386","","10.1021/cg200142f","","","0.71073","MoKα","","0.0344","0.0289","","","0.0721","0.0756","","","","","","1.09","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500710","8.5027","0.0008","8.6975","0.0008","40.9499","0.0011","93.251","0.005","94.148","0.005","99.009","0.008","2976","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H53 I N2 -","- C27 H53 I N2 -","- C108 H212 I4 N8 -","4","2","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","MoKα","","0.0319","0.0276","","","0.0671","0.0691","","","","","","1.093","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500711","45.831","0.003","9.6888","0.0006","7.355","0.0005","90","","99.224","0.005","90","","3223.7","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H53 I3 N2 -","- C27 H53 I3 N2 -","- C108 H212 I12 N8 -","4","0.5","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","MoKα","","0.0136","0.0122","","","0.031","0.0315","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500712","5.2631","0.0004","41.705","0.005","33.069","0.004","90","","92.528","0.009","90","","7251.5","1.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H53 I5 N2 -","- C27 H53 I5 N2 -","- C216 H424 I40 N16 -","8","2","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","MoKα","","0.0868","0.04","","","0.091","0.1071","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500713","7.2671","0.0004","10.106","0.0007","20.7305","0.0007","101.009","0.003","98.259","0.006","91.545","0.006","1476.64","0.14","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H53 N5 -","- C29 H53 N5 -","- C58 H106 N10 -","2","1","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","MoKα","","0.0636","0.0424","","","0.1026","0.1122","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500714","7.4686","0.0005","10.051","0.0007","21.4603","0.0014","77.423","0.001","87.537","0.002","88.558","0.001","1570.64","0.18","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C31 H53 N5 -","- C31 H53 N5 -","- C62 H106 N10 -","2","1","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","MoKα","","0.0503","0.0405","","","0.1138","0.1212","","","","","","1.063","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500715","13.909","0.002","6.3867","0.0009","35.945","0.005","90","","100.628","0.003","90","","3138.3","0.8","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C27 H53 F6 N2 Sb -","- C27 H53 F6 N2 Sb -","- C108 H212 F24 N8 Sb4 -","4","1","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","","","0.0466","0.0352","","","0.079","0.0836","","","","","","1.07","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500716","8.8995","0.0005","11.0981","0.0007","18.0698","0.0011","95.577","0.001","92.752","0.001","108","0.001","1683.57","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H53 B N6 -","- C31 H53 B N6 -","- C62 H106 B2 N12 -","2","1","","Wang, Xinjiao; Vogel, Carola S.; Heinemann, Frank W.; Wasserscheid, Peter; Meyer, Karsten","Solid-State Structures of Double-Long-Chain Imidazolium Ionic Liquids: Influence of Anion Shape on Cation Geometry and Crystal Packing","Crystal Growth & Design","2011","11","5","1974","","10.1021/cg200169u","","","0.71073","MoKα","","0.0691","0.0429","","","0.1041","0.1184","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500717","5.8389","0.0003","8.3195","0.0005","16.9691","0.001","90","","90","","90","","824.3","0.08","100","2","100","2","","","","","","","Sigma Aldrich","3","P 21 21 21","P 2ac 2ab","19","L-3-phenyllactic acid","(S)-2-hydroxy-3-phenylpropionic acid","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","","Navare, Pranoti S.; MacDonald, John C.","Investigation of Stability and Structure in Three Homochiral and Heterochiral Crystalline Forms of 3-Phenyllactic Acid","Crystal Growth & Design","2011","11","6","2422","","10.1021/cg200171r","","x-ray","0.71073","MoKα","","0.0304","0.0288","","","0.0718","0.0729","","","","","","1.064","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500718","8.493","0.0006","8.5972","0.0007","11.529","0.0009","90","","109.203","0.002","90","","794.96","0.11","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","D/L-3-phenyllactic acid","(rac)-2-hydroxy-3-phenylpropionic acid","","- C9 H10 O3 -","- C9 H10 O3 -","- C36 H40 O12 -","4","1","","Navare, Pranoti S.; MacDonald, John C.","Investigation of Stability and Structure in Three Homochiral and Heterochiral Crystalline Forms of 3-Phenyllactic Acid","Crystal Growth & Design","2011","11","6","2422","","10.1021/cg200171r","","","0.71073","MoKα","","0.0386","0.0345","","","0.0882","0.0915","","","","","","1.047","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500719","23.941","0.005","18.794","0.004","19.897","0.004","90","","124.96","0.03","90","","7337","4","100","2","100","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H7 Cu N O7 -","- C16 H7 Cu N O7 -","- C192 H84 Cu12 N12 O84 -","12","1.5","","Zhang, Zhenjie; Wojtas, Lukasz; Zaworotko, Michael J.","Consequences of Partial Flexibility in 1,3-Benzenedicarboxylate Linkers: Kagomé Lattice and NbO Supramolecular Isomers from Complexation of a Bulky 1,3-Benzenedicarboxylate to Cu(II) Paddlewheel Moieties","Crystal Growth & Design","2011","11","5","1441","","10.1021/cg200183x","","","0.40663","synchrotron","","0.1326","0.0767","","","0.1691","0.1849","","","","","","1.018","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500720","22.4425","0.0003","22.4425","0.0003","20.1201","0.0007","90","","90","","120","","8776.1","0.3","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C20 H16 Cu N2 O7 -","- C20 H16 Cu N2 O7 -","- C360 H288 Cu18 N36 O126 -","18","1","","Zhang, Zhenjie; Wojtas, Lukasz; Zaworotko, Michael J.","Consequences of Partial Flexibility in 1,3-Benzenedicarboxylate Linkers: Kagomé Lattice and NbO Supramolecular Isomers from Complexation of a Bulky 1,3-Benzenedicarboxylate to Cu(II) Paddlewheel Moieties","Crystal Growth & Design","2011","11","5","1441","","10.1021/cg200183x","","","1.54178","CuKα","","0.0777","0.0516","","","0.1329","0.146","","","","","","1.05","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500721","6.5119","0.0014","5.8624","0.0008","20.426","0.005","90","","93.904","0.008","90","","778","0.3","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z,Z)-muconic isoprorylammonium","","- C12 H24 N2 O4 -","- C12 H24 N2 O4 -","- C24 H48 N4 O8 -","2","0.5","","Nishizawa, Natsuko; Nakamura, Junya; Matsumoto, Akikazu","Single-Crystal-to-Single-Crystal Transformation of Di(isopropylammonium) (Z,Z)-Muconate into the (E,E)-Muconate during One-Way Photoisomerization in the Solid State","Crystal Growth & Design","2011","11","8","3442","","10.1021/cg200184c","","","0.71075","MoKα","","0.0713","0.0531","","","0.1517","0.1641","","","","","","1.096","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500722","6.4631","0.0017","5.9109","0.0019","20.402","0.008","90","","97.1","0.03","90","","773.4","0.4","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","EE-iPrAm","","- C12 H24 N2 O4 -","- C12 H24 N2 O4 -","- C24 H48 N4 O8 -","2","0.5","","Nishizawa, Natsuko; Nakamura, Junya; Matsumoto, Akikazu","Single-Crystal-to-Single-Crystal Transformation of Di(isopropylammonium) (Z,Z)-Muconate into the (E,E)-Muconate during One-Way Photoisomerization in the Solid State","Crystal Growth & Design","2011","11","8","3442","","10.1021/cg200184c","","","0.71075","MoKα","","0.0633","0.0381","","","0.0897","0.0953","","","","","","0.926","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500723","6.5022","0.0014","5.8929","0.0016","20.534","0.006","90","","94.839","0.01","90","","784","0.4","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 N2 O4 -","- C12 H24.648 N2 O4 -","- C24 H49.296 N4 O8 -","2","0.5","","Nishizawa, Natsuko; Nakamura, Junya; Matsumoto, Akikazu","Single-Crystal-to-Single-Crystal Transformation of Di(isopropylammonium) (Z,Z)-Muconate into the (E,E)-Muconate during One-Way Photoisomerization in the Solid State","Crystal Growth & Design","2011","11","8","3442","","10.1021/cg200184c","","","0.71075","MoKα","","0.0942","0.0504","","","0.1187","0.1286","","","","","","0.915","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500724","9.906","0.003","16.193","0.004","17.823","0.006","90","","95.252","0.01","90","","2846.9","1.5","100","0.5","100","0.5","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H33 N7 O9 S3 -","- C21 H33 N7 O9 S3 -","- C84 H132 N28 O36 S12 -","4","1","","Işiklan, Muhammet; Saeed, Musabbir A.; Pramanik, Avijit; Wong, Bryan M.; Fronczek, Frank R.; Hossain, Alamgir","A C Symmetric Nitrate Complex with a Thiophene-Based Tripodal Receptor.","Crystal growth & design","2011","11","4","959","963","10.1021/cg2001859","","","0.71073","MoKα","","0.0997","0.0618","","","0.1449","0.1665","","","","","","1.019","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500725","10.5433","0.0005","11.4203","0.0006","24.5107","0.0015","90","","90","","90","","2951.3","0.3","90","0.5","90","0.5","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H33 I3 N4 S3 -","- C21 H33 I3 N4 S3 -","- C84 H132 I12 N16 S12 -","4","1","","Işiklan, Muhammet; Saeed, Musabbir A.; Pramanik, Avijit; Wong, Bryan M.; Fronczek, Frank R.; Hossain, Alamgir","A C Symmetric Nitrate Complex with a Thiophene-Based Tripodal Receptor.","Crystal growth & design","2011","11","4","959","963","10.1021/cg2001859","","","0.71073","MoKα","","0.048","0.038","","","0.081","0.093","","","","","","1.036","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500726","4.8186","0.0013","14.63","0.004","10.239","0.003","90","","99.81","0.005","90","","711.3","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","1","","Nath, Naba K.; Aggarwal, Himanshu; Nangia, Ashwini","Crystal Structure of Methyl Paraben Polymorph II","Crystal Growth & Design","2011","11","4","967","","10.1021/cg2001909","","","0.71073","MoKα","","0.0884","0.0801","","","0.1564","0.1602","","","","","","1.339","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500727","15.7406","0.0006","15.7406","0.0006","36.836","0.003","90","","90","","120","","7904","0.8","293","2","100","2","","","","","","","","6","P -6 2 c","P -6c -2c","190","","","","- C145 H139 Cl3 F6 O33 Sn6 -","- C145 H126 Cl3 F6 O33 Sn6 -","- C290 H252 Cl6 F12 O66 Sn12 -","2","0.166667","","Chandrasekhar, V.; Thilagar, P.; Steiner, A.","Guest-Assisted Self-assembly of Organostannoxane Nanotubules on a Mica Surface","Crystal Growth & Design","2011","11","5","1446","","10.1021/cg2001927","","","0.71073","MoKα","","0.0761","0.0691","","","0.1732","0.1787","","","","","","0.981","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500728","15.901","0.003","15.901","0.003","35.553","0.014","90","","90","","120","","7785","4","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C145 H137 Br6 Cl3 O35 Sn6 -","- C145 H138 Br6 Cl3 O34.98 Sn6 -","- C290 H276 Br12 Cl6 O69.96 Sn12 -","2","0.166667","","Chandrasekhar, V.; Thilagar, P.; Steiner, A.","Guest-Assisted Self-assembly of Organostannoxane Nanotubules on a Mica Surface","Crystal Growth & Design","2011","11","5","1446","","10.1021/cg2001927","","","0.71073","MoKα","","0.0692","0.0436","","","0.1046","0.1175","","","","","","1.013","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500729","11.6","0.001","13.569","0.0012","23.303","0.002","90","","90.567","0.002","90","","3667.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(m-hydroxybenzoic acid).bis(triphenylphosphine)","","- C43 H36 O5 P2 -","- C43 H36 O5 P2 -","- C172 H144 O20 P8 -","4","1","","Lemmerer, Andreas; Adsmond, Daniel A.; Bernstein, Joel","An Investigation of the Hydrogen-Bond Preferences and Co-crystallization Behavior of Three Didonor Compounds.","Crystal Growth & Design","2011","11","5","2011","","10.1021/cg2002145","","","0.71073","MoKα","","0.1598","0.0483","","","0.1104","0.1579","","","","","","0.871","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500730","10.32","0.003","21.133","0.007","7.825","0.003","90","","102.105","0.006","90","","1668.6","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","((RS)-mandelic acid).(acridine)","","- C21 H17 N O3 -","- C21 H17 N O3 -","- C84 H68 N4 O12 -","4","1","","Lemmerer, Andreas; Adsmond, Daniel A.; Bernstein, Joel","An Investigation of the Hydrogen-Bond Preferences and Co-crystallization Behavior of Three Didonor Compounds.","Crystal Growth & Design","2011","11","5","2011","","10.1021/cg2002145","","","0.71073","MoKα","","0.0926","0.0488","","","0.1267","0.1553","","","","","","1.095","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500731","30.962","0.004","7.3707","0.001","11.2227","0.0015","90","","107.777","0.006","90","","2438.9","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(4-hydroxybenzoic acid).(nicotinamide)","","- C13 H12 N2 O4 -","- C13 H12 N2 O4 -","- C104 H96 N16 O32 -","8","1","","Lemmerer, Andreas; Adsmond, Daniel A.; Bernstein, Joel","An Investigation of the Hydrogen-Bond Preferences and Co-crystallization Behavior of Three Didonor Compounds.","Crystal Growth & Design","2011","11","5","2011","","10.1021/cg2002145","","","0.71073","MoKα","","0.0621","0.0412","","","0.117","0.1307","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500732","10.3512","0.0016","16.252","0.0015","19.239","0.002","72.012","0.009","82.716","0.011","72.597","0.011","2935.3","0.7","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C102 H158 F6 N24 Ni3 O25 -","- C102 H130 F6 N24 Ni3 O25 -","- C102 H130 F6 N24 Ni3 O25 -","1","0.5","","Meng, Xian-Rui; Zhong, Di-Chang; Jiang, Long; Li, Huan-Yong; Lu, Tong-Bu","Unprecedented Tuning of Structures and Gas Sorption Properties of Two 2D Nickel Metal−Organic Frameworks via Altering the Positions of Fluorine Atoms in Azamacrocyclic Ligands","Crystal Growth & Design","2011","11","5","2020","","10.1021/cg2002157","","","1.54178","CuKα","","0.1328","0.0893","","","0.2258","0.2553","","","","","","1.051","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500733","16.5659","0.0006","17.3791","0.0005","18.8432","0.0006","112.489","0.003","92.471","0.003","102.115","0.003","4854.8","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C93 H125 F6 N21 Ni3 O16 -","- C93 H125 F6 N21 Ni3 O16 -","- C186 H250 F12 N42 Ni6 O32 -","2","1","","Meng, Xian-Rui; Zhong, Di-Chang; Jiang, Long; Li, Huan-Yong; Lu, Tong-Bu","Unprecedented Tuning of Structures and Gas Sorption Properties of Two 2D Nickel Metal−Organic Frameworks via Altering the Positions of Fluorine Atoms in Azamacrocyclic Ligands","Crystal Growth & Design","2011","11","5","2020","","10.1021/cg2002157","","","1.54178","CuKα","","0.0496","0.0418","","","0.1181","0.1221","","","","","","1.052","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500734","18.64","0.0018","18.64","0.0018","18.64","0.0019","90","0.0017","90","0.0016","90","0.0016","6476.5","1.1","293","2","293","2","","","","","","","","5","P 41 3 2","P 4bd 2ab 3","213","","","","- C9 H3 Co2 N12 O6 -","- C9 H3 Co2 N12 O6 -","- C36 H12 Co8 N48 O24 -","4","0.166667","","Li, Mei-Na; Du, Dong-Ying; Yang, Guang-Sheng; Li, Shun-Li; Lan, Ya-Qian; Shao, Kui-Zhan; Qin, Jun-Sheng; Su, Zhong-Min","3D Chiral Microporous (10,3)-a Topology Metal‒Organic Framework Containing Large Helical Channels","Crystal Growth & Design","2011","11","6","2510","","10.1021/cg2002223","","","0.71069","MoKα","","0.0891","0.0417","","","0.0969","0.1112","","","","","","0.894","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4500735","23.482","0.003","16.7231","0.0018","7.7066","0.0008","90","","104.716","0.002","90","","2927","0.6","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H21 N O10 Zn2 -","- C32 H21 N O10 Zn2 -","- C128 H84 N4 O40 Zn8 -","4","0.5","","Qu, Ling-Ling; Zhu, You-Long; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng","Solvent-Induced Synthesis of Zinc(II) and Manganese(II) Coordination Polymers with a Semirigid Tetracarboxylic Acid","Crystal Growth & Design","2011","11","6","2444","","10.1021/cg200229h","","","0.71073","MoKα","","0.0757","0.0563","","","0.1421","0.1483","","","","","","1.096","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500736","9.3243","0.0009","26.939","0.003","14.4535","0.0014","90","","93.068","0.001","90","","3625.3","0.6","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C60 H54 O29 Zn4 -","- C60 H54 O29 Zn4 -","- C120 H108 O58 Zn8 -","2","0.5","","Qu, Ling-Ling; Zhu, You-Long; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng","Solvent-Induced Synthesis of Zinc(II) and Manganese(II) Coordination Polymers with a Semirigid Tetracarboxylic Acid","Crystal Growth & Design","2011","11","6","2444","","10.1021/cg200229h","","","0.71073","MoKα","","0.0762","0.0451","","","0.0925","0.0987","","","","","","1.013","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500737","8.6801","0.0011","28.708","0.004","13.9279","0.0018","90","","90.91","0.002","90","","3470.2","0.8","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 Mn2 O14 -","- C30 H26 Mn2 O14 -","- C120 H104 Mn8 O56 -","4","1","","Qu, Ling-Ling; Zhu, You-Long; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng","Solvent-Induced Synthesis of Zinc(II) and Manganese(II) Coordination Polymers with a Semirigid Tetracarboxylic Acid","Crystal Growth & Design","2011","11","6","2444","","10.1021/cg200229h","","","0.71073","MoKα","","0.0646","0.0491","","","0.1327","0.138","","","","","","1.077","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500738","10.4542","0.0008","13.814","0.001","13.9456","0.0011","77.074","0.001","78.232","0.001","76.91","0.001","1886.8","0.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H42 Mn N2 O14 -","- C38 H42 Mn N2 O14 -","- C76 H84 Mn2 N4 O28 -","2","1","","Qu, Ling-Ling; Zhu, You-Long; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng","Solvent-Induced Synthesis of Zinc(II) and Manganese(II) Coordination Polymers with a Semirigid Tetracarboxylic Acid","Crystal Growth & Design","2011","11","6","2444","","10.1021/cg200229h","","","0.71073","MoKα","","0.0802","0.0613","","","0.1403","0.1456","","","","","","1.081","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500739","27.636","0.007","4.7444","0.0011","19.233","0.005","90","","122.929","0.002","90","","2116.6","0.9","120","","120","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H28 N4 O9 -","- C18 H28 N4 O9 -","- C72 H112 N16 O36 -","4","0.5","","Kohmoto, Shigeo; Okuyama, Shinpei; Yokota, Nobuyuki,; Takahashi, Masahiro; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao","Generation of Zwitterionic Water Channels: Biszwitterionic Imidazolium Carboxylates as Hydrogen-Bonding Acceptors","Crystal Growth & Design","2011","11","9","3698","","10.1021/cg200232b","","","0.71073","MoKα","","0.0572","0.0381","","","0.0813","0.0905","","","","","","1.028","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500740","4.7129","0.0013","10.011","0.003","12.908","0.004","69.426","0.003","87.476","0.003","81.127","0.003","563.3","0.3","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H24 N4 O8 -","- C22 H24 N4 O8 -","- C22 H24 N4 O8 -","1","0.5","","Kohmoto, Shigeo; Okuyama, Shinpei; Yokota, Nobuyuki,; Takahashi, Masahiro; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao","Generation of Zwitterionic Water Channels: Biszwitterionic Imidazolium Carboxylates as Hydrogen-Bonding Acceptors","Crystal Growth & Design","2011","11","9","3698","","10.1021/cg200232b","","","0.71073","MoKα","","0.0767","0.056","","","0.1431","0.1571","","","","","","1.051","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500741","9.5978","0.0014","9.7222","0.0014","13.736","0.002","85.692","0.002","77.323","0.002","73.387","0.002","1198.2","0.3","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H20 N4 O9.5 -","- C22 H20 N4 O9.5 -","- C44 H40 N8 O19 -","2","1","","Kohmoto, Shigeo; Okuyama, Shinpei; Yokota, Nobuyuki,; Takahashi, Masahiro; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao","Generation of Zwitterionic Water Channels: Biszwitterionic Imidazolium Carboxylates as Hydrogen-Bonding Acceptors","Crystal Growth & Design","2011","11","9","3698","","10.1021/cg200232b","","","0.71073","MoKα","","0.0894","0.0592","","","0.1602","0.1813","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500742","7.166","0.002","16.621","0.005","10.8","0.004","90","","107.616","0.004","90","","1226","0.7","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H22 N4 O8 -","- C24 H22 N4 O8 -","- C48 H44 N8 O16 -","2","1","","Kohmoto, Shigeo; Okuyama, Shinpei; Yokota, Nobuyuki,; Takahashi, Masahiro; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao","Generation of Zwitterionic Water Channels: Biszwitterionic Imidazolium Carboxylates as Hydrogen-Bonding Acceptors","Crystal Growth & Design","2011","11","9","3698","","10.1021/cg200232b","","","0.71073","MoKα","","0.0848","0.0553","","","0.1353","0.1524","","","","","","0.993","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500743","13.7495","0.0019","13.7495","0.0019","25.533","0.005","90","","90","","90","","4827","1.3","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C60 H94 N12 Ni4 O25 -","- C60 H94 N12 Ni4 O25 -","- C120 H188 N24 Ni8 O50 -","2","0.25","","Guo, Jingjing; Li, Xinhua; Moorefield, Charles N.; Newkome, George R.","Novel Twofold Interpenetrating Channel Framework Based on Metal Tetramer Subunits","Crystal Growth & Design","2011","11","7","2695","","10.1021/cg200242n","","","0.71073","MoKα","","0.0979","0.0709","","","0.1696","0.1834","","","","","","1.027","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500744","13.7561","0.0003","13.7561","0.0003","25.5306","0.0012","90","","90","","90","","4831.2","0.3","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C60 H86 Cu4 N12 O21 -","- C60 H86 Cu4 N12 O21 -","- C120 H172 Cu8 N24 O42 -","2","0.25","","Guo, Jingjing; Li, Xinhua; Moorefield, Charles N.; Newkome, George R.","Novel Twofold Interpenetrating Channel Framework Based on Metal Tetramer Subunits","Crystal Growth & Design","2011","11","7","2695","","10.1021/cg200242n","","","0.71073","MoKα","","0.1297","0.1266","","","0.2867","0.2888","","","","","","1.271","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500745","13.7327","0.0015","13.7327","0.0015","25.466","0.006","90","","90","","90","","4802.6","1.4","298","2","298","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C60 H96 N12 Ni4 O26 -","- C60 H96 N12 Ni4 O26 -","- C120 H192 N24 Ni8 O52 -","2","0.25","","Guo, Jingjing; Li, Xinhua; Moorefield, Charles N.; Newkome, George R.","Novel Twofold Interpenetrating Channel Framework Based on Metal Tetramer Subunits","Crystal Growth & Design","2011","11","7","2695","","10.1021/cg200242n","","","0.71073","MoKα","","0.187","0.1533","","","0.3268","0.3551","","","","","","1.16","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500746","24.5078","0.0015","6.2205","0.0004","7.2839","0.0005","90","","90","","90","","1110.44","0.12","569","2","569","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 N2 O2 -","- C12 H14 N2 O2 -","- C48 H56 N8 O8 -","4","1","","Amharar, Youness; Petit, Samuel; Sanselme, Morgane; Cartigny, Yohann; Petit, Marie-Noëlle; Coquerel, Gérard","Crystal Structures, Dehydration Mechanism, and Chiral Discrimination in the Solid State of a Hydantoin Derivative","Crystal Growth & Design","2011","11","6","2453","","10.1021/cg200243y","","x-ray","0.71073","MoKα","","0.0324","0.032","","","0.0885","0.0889","","","","","","1.065","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500747","15.774","0.01","6.181","0.004","16.277","0.008","90","","126.02","0.04","90","","1283.6","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C48 H64 N8 O12 -","4","1","","Amharar, Youness; Petit, Samuel; Sanselme, Morgane; Cartigny, Yohann; Petit, Marie-Noëlle; Coquerel, Gérard","Crystal Structures, Dehydration Mechanism, and Chiral Discrimination in the Solid State of a Hydantoin Derivative","Crystal Growth & Design","2011","11","6","2453","","10.1021/cg200243y","","","0.71073","MoKα","","0.0878","0.0556","","","0.1534","0.1827","","","","","","1.051","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500748","11.2492","0.0002","11.3536","0.0003","13.3378","0.0008","65.508","0.003","81.846","0.006","60.791","0.002","1349.16","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H30 Ag4 N10 O32 W10 -","- C20 H30 Ag4 N10 O32 W10 -","- C20 H30 Ag4 N10 O32 W10 -","1","0.5","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","0.71073","MoKα","","0.0267","0.0255","","","0.0609","0.0613","","","","","","1.229","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500749","20.5131","0.0002","20.5131","0.0002","33.4645","0.0005","90","","90","","120","","12194.9","0.2","150","2","150","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C24 H41 Ag4 N12 O60 Sb W18 -","- C24 H36 Ag3.96 N12 O60 Sb W18 -","- C144 H216 Ag23.76 N72 O360 Sb6 W108 -","6","0.166667","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","1.54178","CuKα","","0.0529","0.0452","","","0.1321","0.1405","","","","","","1.125","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500750","20.5547","0.0009","20.5547","0.0009","33.1479","0.0019","90","","90","","120","","12128.6","1","150","2","150","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C24 H36 Ag4 Bi N12 O60 W18 -","- C22.2 H30.6 Ag3.93 Bi N10.2 O60 W18 -","- C133.2 H183.6 Ag23.58 Bi6 N61.2 O360 W108 -","6","0.166667","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","0.71073","MoKα","","0.0753","0.0543","","","0.1327","0.1571","","","","","","1.122","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500751","13.318","0.003","23.362","0.005","23.198","0.005","90","","95.652","0.009","90","","7183","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H70 N7 O66 Sb W18 -","- C13.5 H47.5 N7 O66 Sb W18 -","- C54 H190 N28 O264 Sb4 W72 -","4","1","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","0.71073","MoKα","","0.0634","0.0415","","","0.0816","0.0886","","","","","","1.041","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500752","12.8261","0.0006","13.0348","0.0005","13.37","0.0005","73.647","0.003","61.499","0.004","89.952","0.003","1861.13","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H80 Bi N7 O71 W18 -","- C14 Bi N7 O71 W18 -","- C14 Bi N7 O71 W18 -","1","0.5","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","0.71073","MoKα","","0.0379","0.032","","","0.0801","0.0819","","","","","","1.071","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500753","16.5543","0.0003","20.5284","0.0003","22.6908","0.0003","92.776","0.001","109.43","0.001","108.94","0.001","6771.7","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H179 N10 O60 Sb W18 -","- C37.7 N6 O60 Sb W18 -","- C75.4 N12 O120 Sb2 W36 -","2","1","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","0.71073","MoKα","","0.0641","0.0394","","","0.1085","0.1137","","","","","","0.93","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500754","42.0448","0.0003","42.0448","0.0003","15.6967","0.0002","90","","90","","90","","27748.1","0.5","150","2","150","2","","","","","","","","6","I 4","I 4","79","","","","- C86 H192 Bi N8 O60 W18 -","- C58.2 Bi N5 O60 W18 -","- C465.6 Bi8 N40 O480 W144 -","8","1","","McGlone, Thomas; Streb, Carsten; Busquets-Fité, Martí; Yan, Jun; Gabb, David; Long, De-Liang; Cronin, Leroy","Silver Linked Polyoxometalate Open Frameworks (Ag-POMOFs) for the Directed Fabrication of Silver Nanomaterials","Crystal Growth & Design","2011","11","6","2471","","10.1021/cg2002496","","","0.71073","MoKα","","0.0657","0.0389","","","0.0787","0.0822","","","","","","0.903","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500755","25.5852","0.0015","29.62","0.0018","58.413","0.004","90","","90","","90","","44267","5","293","2","293","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C20 H16 Cl Cu3 Mo N4 O S3 -","- C20 H16 Cl Cu3 Mo N4 O S3 -","- C640 H512 Cl32 Cu96 Mo32 N128 O32 S96 -","32","1","","Han, Yi; Zhang, Zhenhua; Liu, Yanyan; Niu, Yunyin; Ding, Degang; Wu, Benlai; Hou, Hongwei; Fan, Yaoting","External Template-Assisted Self-Assembly:Design and Synthesis of 4,4′-bipy-Based Mo(W)/Cu/S Heterothiometallic Polymeric Clusters Directed by 1,1′-Bis(pyridinium)methylene Cation","Crystal Growth & Design","2011","11","8","3448","","10.1021/cg200250m","","","0.71073","MoKα","","0.1116","0.053","","","0.1492","0.1572","","","","","","1.016","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500756","25.569","0.004","29.638","0.004","58.594","0.009","90","","90","","90","","44403","11","296","2","296","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C20 H16 Cl Cu3 N4 O S3 W -","- C20 H16 Cl Cu3 N4 O S3 W -","- C640 H512 Cl32 Cu96 N128 O32 S96 W32 -","32","1","","Han, Yi; Zhang, Zhenhua; Liu, Yanyan; Niu, Yunyin; Ding, Degang; Wu, Benlai; Hou, Hongwei; Fan, Yaoting","External Template-Assisted Self-Assembly:Design and Synthesis of 4,4′-bipy-Based Mo(W)/Cu/S Heterothiometallic Polymeric Clusters Directed by 1,1′-Bis(pyridinium)methylene Cation","Crystal Growth & Design","2011","11","8","3448","","10.1021/cg200250m","","","0.71073","MoKα","","0.0945","0.0526","","","0.1172","0.1253","","","","","","1.011","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500757","9.783","0.011","14.226","0.016","19.58","0.02","72.595","0.014","78.897","0.014","87.935","0.014","2551","5","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H31 Cu3 Mo N8 O2 S4 -","- C34 H31 Cu3 Mo N8 O2 S4 -","- C68 H62 Cu6 Mo2 N16 O4 S8 -","2","1","","Han, Yi; Zhang, Zhenhua; Liu, Yanyan; Niu, Yunyin; Ding, Degang; Wu, Benlai; Hou, Hongwei; Fan, Yaoting","External Template-Assisted Self-Assembly:Design and Synthesis of 4,4′-bipy-Based Mo(W)/Cu/S Heterothiometallic Polymeric Clusters Directed by 1,1′-Bis(pyridinium)methylene Cation","Crystal Growth & Design","2011","11","8","3448","","10.1021/cg200250m","","","0.71073","MoKα","","0.1002","0.0547","","","0.1453","0.1614","","","","","","0.958","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500758","40.669","0.003","9.7097","0.0007","24.7394","0.0019","90","","105.023","0.001","90","","9435.3","1.2","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H41 Cu3 N9 O4 S4 W -","- C35 H41 Cu3 N9 O4 S4 W -","- C280 H328 Cu24 N72 O32 S32 W8 -","8","1","","Han, Yi; Zhang, Zhenhua; Liu, Yanyan; Niu, Yunyin; Ding, Degang; Wu, Benlai; Hou, Hongwei; Fan, Yaoting","External Template-Assisted Self-Assembly:Design and Synthesis of 4,4′-bipy-Based Mo(W)/Cu/S Heterothiometallic Polymeric Clusters Directed by 1,1′-Bis(pyridinium)methylene Cation","Crystal Growth & Design","2011","11","8","3448","","10.1021/cg200250m","","","0.71073","MoKα","","0.0473","0.0358","","","0.1059","0.1149","","","","","","1.009","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500759","7.068","0.005","8.481","0.006","14.32","0.01","84.287","0.009","78.229","0.009","69.272","0.008","785.6","1","250","","250","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 N2 O5 -","- C17 H16 N2 O5 -","- C34 H32 N4 O10 -","2","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Ureadicarboxylic Acid as a Versatile Folding Unit for Construction of Zigzag-type Architecture","Crystal Growth & Design","2011","11","5","1453","","10.1021/cg2002546","","","0.71073","MoKα","","0.0851","0.0626","","","0.1812","0.2009","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500760","20.222","0.002","6.6626","0.0007","18.9969","0.0019","90","","114.095","0.001","90","","2336.5","0.4","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 N4 O5 -","- C27 H24 N4 O5 -","- C108 H96 N16 O20 -","4","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Ureadicarboxylic Acid as a Versatile Folding Unit for Construction of Zigzag-type Architecture","Crystal Growth & Design","2011","11","5","1453","","10.1021/cg2002546","","","0.71073","MoKα","","0.0588","0.0399","","","0.0981","0.1101","","","","","","1.011","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500761","21.787","0.002","6.5789","0.0007","19.458","0.002","90","","115.136","0.001","90","","2524.9","0.4","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H26 N4 O5 -","- C29 H26 N4 O5 -","- C116 H104 N16 O20 -","4","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Ureadicarboxylic Acid as a Versatile Folding Unit for Construction of Zigzag-type Architecture","Crystal Growth & Design","2011","11","5","1453","","10.1021/cg2002546","","","0.71073","MoKα","","0.0759","0.0448","","","0.1074","0.1252","","","","","","1.038","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500762","26.1395","0.0011","6.5865","0.0003","19.047","0.0007","90","","101.757","0.003","90","","3210.5","0.2","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H32 N4 O5 -","- C41 H32 N4 O5 -","- C164 H128 N16 O20 -","4","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Ureadicarboxylic Acid as a Versatile Folding Unit for Construction of Zigzag-type Architecture","Crystal Growth & Design","2011","11","5","1453","","10.1021/cg2002546","","","0.71073","MoKα","","0.1636","0.0805","","","0.1688","0.1995","","","","","","1.066","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500763","11.0981","0.0003","11.5988","0.0003","21.6744","0.0006","90","","90","","90","","2790.03","0.13","173","","173","","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C28 H29 N5 O8 -","- C28 H29 N5 O8 -","- C112 H116 N20 O32 -","4","0.5","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Ureadicarboxylic Acid as a Versatile Folding Unit for Construction of Zigzag-type Architecture","Crystal Growth & Design","2011","11","5","1453","","10.1021/cg2002546","","","0.71073","MoKα","","0.0718","0.0592","","","0.1703","0.183","","","","","","1.039","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500764","11.3891","0.0006","11.3891","0.0006","26.872","0.003","90","","90","","120","","3018.6","0.4","296","2","296","2","","","","","","","","6","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C20 H15 Eu Li N3 O8 -","- C20 H15 Eu Li N3 O8 -","- C120 H90 Eu6 Li6 N18 O48 -","6","0.5","","Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E.","Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers","Crystal Growth & Design","2011","11","6","2485","2492","10.1021/cg200255r","","","0.71073","MoKα","","0.0167","0.0157","","","0.0366","0.037","","","","","","1.082","","","","has coordinates","180551","2020-10-21","18:00:00",""
"4500765","11.3686","0.0003","11.3686","0.0003","26.7353","0.0012","90","","90","","120","","2992.47","0.17","296","2","296","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C20 H15 Li N3 O8 Tb -","- C20 H15 Li N3 O8 Tb -","- C120 H90 Li6 N18 O48 Tb6 -","6","0.5","","Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E.","Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers","Crystal Growth & Design","2011","11","6","2485","2492","10.1021/cg200255r","","","0.71073","MoKα","","0.0177","0.0165","","","0.0384","0.0389","","","","","","1.133","","","","has coordinates","180551","2020-10-21","18:00:00",""
"4500766","11.6684","0.0003","11.6684","0.0003","27.714","0.0016","90","","90","","120","","3267.8","0.2","296","2","296","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C20 H15 Eu N3 Na O8 -","- C20 H15 Eu N3 Na O8 -","- C120 H90 Eu6 N18 Na6 O48 -","6","0.5","","Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E.","Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers","Crystal Growth & Design","2011","11","6","2485","2492","10.1021/cg200255r","","","0.71073","MoKα","","0.0586","0.0415","","","0.0803","0.0858","","","","","","1.053","","","","has coordinates","180551","2020-10-21","18:00:00",""
"4500767","11.6202","0.0007","11.6202","0.0007","27.55","0.003","90","","90","","120","","3221.7","0.4","296","2","296","2","","","","","","","","6","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C20 H15 N3 Na O8 Tb -","- C20 H15 N3 Na O8 Tb -","- C120 H90 N18 Na6 O48 Tb6 -","6","0.5","","Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E.","Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers","Crystal Growth & Design","2011","11","6","2485","2492","10.1021/cg200255r","","","0.71073","MoKα","","0.0239","0.0202","","","0.0422","0.0433","","","","","","1.063","","","","has coordinates","180551","2020-10-21","18:00:00",""
"4500768","10.6936","0.0009","14.702","0.0012","12.9661","0.0011","90","","106.313","0.001","90","","1956.4","0.3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 K N2 O8 Tb -","- C16 H14 K N2 O8 Tb -","- C64 H56 K4 N8 O32 Tb4 -","4","1","","Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E.","Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers","Crystal Growth & Design","2011","11","6","2485","2492","10.1021/cg200255r","","","0.71073","MoKα","","0.0304","0.024","","","0.0544","0.0572","","","","","","1.043","","","","has coordinates","180551","2020-10-21","18:00:00",""
"4500769","11.201","0.005","14.943","0.005","21.483","0.005","90","0.005","92.096","0.005","90","0.005","3593","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H50 N24 Ni2 O41 Si W12 -","- C32 H48 N24 Ni2 O41 Si W12 -","- C64 H96 N48 Ni4 O82 Si2 W24 -","2","0.5","","Wang, Xiu-li; Li, Jin; Tian, Ai-xiang; Zhao, Dan; Liu, Guo-cheng; Lin, Hong-yan","Assembly of Three NiII‒Bis(triazole) Complexes by Exerting the Linkage and Template Roles of Keggin Anions","Crystal Growth & Design","2011","11","8","3456","","10.1021/cg200261j","","","0.71069","MoKα","","0.0878","0.0671","","","0.1889","0.1983","","","","","","1.08","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500770","13.8427","0.0012","18.2148","0.0015","26.861","0.002","90","","94.172","0.001","90","","6754.8","1","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C60 H110 Mo24 N36 Ni2 O86 P2 -","- C60 H98 Mo24 N36 Ni2 O86 P2 -","- C120 H196 Mo48 N72 Ni4 O172 P4 -","2","0.5","","Wang, Xiu-li; Li, Jin; Tian, Ai-xiang; Zhao, Dan; Liu, Guo-cheng; Lin, Hong-yan","Assembly of Three NiII‒Bis(triazole) Complexes by Exerting the Linkage and Template Roles of Keggin Anions","Crystal Growth & Design","2011","11","8","3456","","10.1021/cg200261j","","","0.71073","MoKα","","0.0855","0.0561","","","0.1045","0.1116","","","","","","1.108","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500771","13.0024","0.0008","13.4765","0.0009","19.0107","0.0013","76.294","0.001","85.284","0.001","74.768","0.001","3121.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H88 Mo24 N30 Ni3 O94 P2 -","- C40 H60 Mo24 N30 Ni3 O94 P2 -","- C40 H60 Mo24 N30 Ni3 O94 P2 -","1","0.5","","Wang, Xiu-li; Li, Jin; Tian, Ai-xiang; Zhao, Dan; Liu, Guo-cheng; Lin, Hong-yan","Assembly of Three NiII‒Bis(triazole) Complexes by Exerting the Linkage and Template Roles of Keggin Anions","Crystal Growth & Design","2011","11","8","3456","","10.1021/cg200261j","","","0.71073","MoKα","","0.0785","0.056","","","0.1456","0.1692","","","","","","1.04","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500772","10.832","0.002","11.363","0.004","13.731","0.004","90","","94.53","0.02","90","","1684.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 Cu2 N11 O2 -","- C12 H11 Cu2 N11 O2 -","- C48 H44 Cu8 N44 O8 -","4","1","","Pinta, Noelia De la; Serna, Zurine; Madariaga, Gotzon; Urtiaga, M. Karmele; Fidalgo, M. Luz; Cortés, Roberto","Ferromagnetic Interactions in an Unusual 2D Coordination Polymer Including Di-2-pyridylketone-Methoxilated Anion, (1,1)-Azide, and Rare (1,1,3,3)-Azide Bridging Ligands","Crystal Growth & Design","2011","11","5","1458","","10.1021/cg200267x","","","0.71073","MoKα","","0.0634","0.0462","","","","0.1285","","","","","","1.095","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500773","22.6523","0.0006","22.6523","0.0006","65.9502","0.0016","90","","90","","120","","29307","1.3","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","Zn4O(Me4BPDC)3","","","- C54 H48 O13 Zn4 -","- C54 H48 O13 Zn4 -","- C648 H576 O156 Zn48 -","12","0.333333","","Park, Tae-Hong; Koh, Kyoungmoo; Wong-Foy, Antek G.; Matzger, Adam J.","Nonlinear Properties in Coordination Copolymers Derived from Randomly Mixed Ligands","Crystal Growth & Design","2011","11","6","2059","","10.1021/cg200271e","","","1.54187","CuKα","","0.1042","0.0824","","","0.2275","0.2391","","","","","","1.381","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500774","10.601","0.002","12.185","0.002","16.651","0.003","78.53","0.03","77.04","0.03","80.68","0.03","2038.6","0.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H32 Co2 N6 O6 S3 -","- C50 H32 Co2 N6 O6 S3 -","- C100 H64 Co4 N12 O12 S6 -","2","1","","Morgan, Ian S.; Jennings, Michael; Vindigni, Alessandro; Clérac, Rodolphe; Preuss, Kathryn E.","[TDNQ][CoCp*2] and [TDNQ]3[CoCp2]2; Radical Anions of a 1,2,5-Thiadiazolo-naphthoquinone","Crystal Growth & Design","2011","11","6","2520","","10.1021/cg2002783","","","0.71073","MoKα","","0.0604","0.0419","","","0.0954","0.1043","","","","","","1.041","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500775","10.359","0.003","11.832","0.003","15.753","0.004","90.486","0.005","102.525","0.004","105.695","0.004","1809.9","0.8","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H40 Cl6 Co N2 O2 S -","- C33 H40 Cl6 Co N2 O2 S -","- C66 H80 Cl12 Co2 N4 O4 S2 -","2","1","","Morgan, Ian S.; Jennings, Michael; Vindigni, Alessandro; Clérac, Rodolphe; Preuss, Kathryn E.","[TDNQ][CoCp*2] and [TDNQ]3[CoCp2]2; Radical Anions of a 1,2,5-Thiadiazolo-naphthoquinone","Crystal Growth & Design","2011","11","6","2520","","10.1021/cg2002783","","","0.71073","MoKα","","0.1389","0.0668","","","0.1424","0.1727","","","","","","0.998","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500776","8.0336","0.0011","5.5785","0.0007","51.75","0.008","90","","90","","90","","2319.2","0.6","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","DH74","","","- C29 H24 O6 Zn -","- C29 H24 O6 Zn -","- C116 H96 O24 Zn4 -","4","1","","Holden, Daniel L.; Goulding, Helen V.; Bacsa, John; Berry, Neil G.; Greeves, Nicholas; Stephenson, Richard A.; Harrington, Ross W.; Clegg, William; Fogg, Andrew M.","Unusual Hybrid Materials Prepared by the Oxidation of a Ketone","Crystal Growth & Design","2011","11","7","3013","","10.1021/cg200286t","","","0.71073","MoKα","","0.0746","0.0708","","","0.1498","0.1517","","","","","","1.153","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500777","48.786","0.009","5.6211","0.0011","16.53","0.003","90","","96.074","0.003","90","","4507.6","1.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","dh17","","","- C52 H42 O14 Zn5 -","- C52 H42 O14 Zn5 -","- C208 H168 O56 Zn20 -","4","0.5","","Holden, Daniel L.; Goulding, Helen V.; Bacsa, John; Berry, Neil G.; Greeves, Nicholas; Stephenson, Richard A.; Harrington, Ross W.; Clegg, William; Fogg, Andrew M.","Unusual Hybrid Materials Prepared by the Oxidation of a Ketone","Crystal Growth & Design","2011","11","7","3013","","10.1021/cg200286t","","","0.71073","MoKα","","0.0684","0.0426","","","0.0969","0.1058","","","","","","1.018","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500778","45.229","0.014","6.5476","0.0019","7.2194","0.0018","90","","90.32","0.02","90","","2137.9","1.1","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 Mg O6 -","- C26 H18 Mg O6 -","- C104 H72 Mg4 O24 -","4","0.5","","Holden, Daniel L.; Goulding, Helen V.; Bacsa, John; Berry, Neil G.; Greeves, Nicholas; Stephenson, Richard A.; Harrington, Ross W.; Clegg, William; Fogg, Andrew M.","Unusual Hybrid Materials Prepared by the Oxidation of a Ketone","Crystal Growth & Design","2011","11","7","3013","","10.1021/cg200286t","","","0.71073","MoKα","","0.2394","0.2054","","","0.5518","0.5659","","","","","","2.341","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500779","52.27","0.03","5.618","0.003","8.091","0.004","90","","94.773","0.006","90","","2368","2","120","2","120","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C29 H24 O6 Zn -","- C29 H24 O6 Zn -","- C116 H96 O24 Zn4 -","4","1","","Holden, Daniel L.; Goulding, Helen V.; Bacsa, John; Berry, Neil G.; Greeves, Nicholas; Stephenson, Richard A.; Harrington, Ross W.; Clegg, William; Fogg, Andrew M.","Unusual Hybrid Materials Prepared by the Oxidation of a Ketone","Crystal Growth & Design","2011","11","7","3013","","10.1021/cg200286t","","","0.6889","synchrotron","","0.096","0.0608","","","0.115","0.1312","","","","","","1.054","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500780","6.353","0.0002","6.5278","0.0002","8.3716","0.0002","80.297","0.001","78.226","0.001","89.048","0.001","334.956","0.017","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C12 H20 N4 O4 -","2","1","","Chambrier, Marie-Hélène; Bouhmaida, Nouzha; Bonhomme, François; Lebègue, Sébastien; Gillet, Jean-Michel; Jelsch, Christian; Ghermani, Nour Eddine","Electron and Electrostatic Properties of Three Crystal Forms of Piracetam","Crystal Growth & Design","2011","11","6","2528","","10.1021/cg200291t","","","0.71073","MoKα","","0.037","0.0258","","","0.0227","0.0242","","","","","","0.981","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500781","6.4539","0.0005","6.3857","0.0005","16.1814","0.001","90","","92.057","0.005","90","","666.45","0.08","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C24 H40 N8 O8 -","4","1","","Chambrier, Marie-Hélène; Bouhmaida, Nouzha; Bonhomme, François; Lebègue, Sébastien; Gillet, Jean-Michel; Jelsch, Christian; Ghermani, Nour Eddine","Electron and Electrostatic Properties of Three Crystal Forms of Piracetam","Crystal Growth & Design","2011","11","6","2528","","10.1021/cg200291t","","","0.71073","MoKα","","0.0352","0.0259","","","0.026","0.0273","","","","","","1.012","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500782","6.9234","0.0002","7.4453","0.0002","9.0909","0.0002","97.948","0.001","103.971","0.001","115.797","0.001","393.225","0.019","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C6 H12 N2 O3 -","- C6 H12 N2 O3 -","- C12 H24 N4 O6 -","2","1","","Chambrier, Marie-Hélène; Bouhmaida, Nouzha; Bonhomme, François; Lebègue, Sébastien; Gillet, Jean-Michel; Jelsch, Christian; Ghermani, Nour Eddine","Electron and Electrostatic Properties of Three Crystal Forms of Piracetam","Crystal Growth & Design","2011","11","6","2528","","10.1021/cg200291t","","","0.71073","MoKα","","0.0296","0.0243","","","0.0274","0.028","","","","","","1.35","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500783","19.973","0.002","38.081","0.004","24.667","0.005","90","","109.31","0.001","90","","17706","4","88","2","88","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C168 H156 Cl5 Cu17 N60 O6 -","- C168 Cl5 Cu17 N60 O6 -","- C672 Cl20 Cu68 N240 O24 -","4","0.5","","Fang, Zhen-Lan; Yu, Rong-Min; Wu, Xiao-Yuan; Huang, Jing-Shun; Lu, Can-Zhong","Microporous Metal‒Organic Frameworks: Structures, in Situ Formation of Ligand, and Crystal-to-Crystal Transformations","Crystal Growth & Design","2011","11","6","2546","","10.1021/cg200300x","","","0.71073","MoKα","","0.0694","0.064","","","0.2347","0.2511","","","","","","1.034","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500784","20.014","0.005","37.956","0.008","25.085","0.008","90","","109.384","0.003","90","","17976","8","88","2","88","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C168 H154 Cl5 Cu17 N60 O5 -","- C168 H144 Cl5 Cu17 N60 O5 -","- C672 H576 Cl20 Cu68 N240 O20 -","4","0.5","","Fang, Zhen-Lan; Yu, Rong-Min; Wu, Xiao-Yuan; Huang, Jing-Shun; Lu, Can-Zhong","Microporous Metal‒Organic Frameworks: Structures, in Situ Formation of Ligand, and Crystal-to-Crystal Transformations","Crystal Growth & Design","2011","11","6","2546","","10.1021/cg200300x","","","0.71073","MoKα","","0.0459","0.0395","","","0.0996","0.1124","","","","","","1.034","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500785","20.014","0.005","37.956","0.008","25.085","0.008","90","","109.384","0.003","90","","17976","8","88","2","88","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C168 H154 Cl5 Cu17 N60 O5 -","- C168 H144 Cl5 Cu17 N60 O5 -","- C672 H576 Cl20 Cu68 N240 O20 -","4","0.5","","Fang, Zhen-Lan; Yu, Rong-Min; Wu, Xiao-Yuan; Huang, Jing-Shun; Lu, Can-Zhong","Microporous Metal‒Organic Frameworks: Structures, in Situ Formation of Ligand, and Crystal-to-Crystal Transformations","Crystal Growth & Design","2011","11","6","2546","","10.1021/cg200300x","","","0.71073","MoKα","","0.0457","0.04","","","0.1052","0.11","","","","","","1.012","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500786","20.014","0.005","37.956","0.008","25.085","0.008","90","","109.384","0.003","90","","17976","8","88","2","88","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C168 H150 Cl5 Cu17 N60 O3 -","- C168 H144 Cl5 Cu17 N60 O3 -","- C672 H576 Cl20 Cu68 N240 O12 -","4","0.5","","Fang, Zhen-Lan; Yu, Rong-Min; Wu, Xiao-Yuan; Huang, Jing-Shun; Lu, Can-Zhong","Microporous Metal‒Organic Frameworks: Structures, in Situ Formation of Ligand, and Crystal-to-Crystal Transformations","Crystal Growth & Design","2011","11","6","2546","","10.1021/cg200300x","","","0.71073","MoKα","","0.0449","0.0393","","","0.1036","0.1082","","","","","","1.035","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500787","20.014","0.005","37.956","0.008","25.085","0.008","90","","109.384","0.003","90","","17976","8","88","2","88","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C168 H154 Br5 Cu17 N60 O5 -","- C168 H144 Br5 Cu17 N60 O5 -","- C672 H576 Br20 Cu68 N240 O20 -","4","0.5","","Fang, Zhen-Lan; Yu, Rong-Min; Wu, Xiao-Yuan; Huang, Jing-Shun; Lu, Can-Zhong","Microporous Metal‒Organic Frameworks: Structures, in Situ Formation of Ligand, and Crystal-to-Crystal Transformations","Crystal Growth & Design","2011","11","6","2546","","10.1021/cg200300x","","","0.71073","MoKα","","0.0497","0.0463","","","0.1525","0.1571","","","","","","1.089","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500788","20.015","0.003","38.064","0.006","25.197","0.006","90","","109.846","0.003","90","","18056","6","88","2","88","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C168 H150 Br5 Cu17 N60 O3 -","- C168 H144 Br5 Cu17 N60 O3 -","- C672 H576 Br20 Cu68 N240 O12 -","4","0.5","","Fang, Zhen-Lan; Yu, Rong-Min; Wu, Xiao-Yuan; Huang, Jing-Shun; Lu, Can-Zhong","Microporous Metal‒Organic Frameworks: Structures, in Situ Formation of Ligand, and Crystal-to-Crystal Transformations","Crystal Growth & Design","2011","11","6","2546","","10.1021/cg200300x","","","0.71073","MoKα","","0.0526","0.0438","","","0.1268","0.1363","","","","","","1.036","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500789","15.604","0.003","11.804","0.002","42.692","0.009","90","","92.43","0.03","90","","7856","3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C139 H139 Cl2 N25 Nd4 O40 -","- C139 H139 Cl2 N25 Nd4 O40 -","- C278 H278 Cl4 N50 Nd8 O80 -","2","0.5","","Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping","Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand","Crystal Growth & Design","2011","11","8","3479","","10.1021/cg200308k","","","0.71073","MoKα","","0.1125","0.0838","","","0.1924","0.2135","","","","","","1.113","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500790","13.003","0.003","16.449","0.003","40.207","0.008","90","","90","","90","","8600","3","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C122 H95 Cl2 Eu4 N19 O33 -","- C122 H95 Cl2 Eu4 N19 O33 -","- C244 H190 Cl4 Eu8 N38 O66 -","2","0.25","","Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping","Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand","Crystal Growth & Design","2011","11","8","3479","","10.1021/cg200308k","","","0.71073","MoKα","","0.1043","0.0793","","","0.1654","0.18","","","","","","1.028","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500791","12.768","0.003","16.619","0.003","39.917","0.008","90","","90","","90","","8470","3","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C120 H92 Cl2 N18 O33 Yb4 -","- C120 H92 Cl2 N18 O33 Yb4 -","- C240 H184 Cl4 N36 O66 Yb8 -","2","0.25","","Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping","Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand","Crystal Growth & Design","2011","11","8","3479","","10.1021/cg200308k","","","0.71073","MoKα","","0.0879","0.0787","","","0.2166","0.2285","","","","","","1.065","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500792","11.2863","0.0016","11.2863","0.0016","50.133","0.01","90","","90","","90","","6386","1.8","223","2","223","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C61 H50 N10 Nd O16 -","- C61 H50.04 N10 Nd O16 -","- C244 H200.16 N40 Nd4 O64 -","4","0.25","","Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping","Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand","Crystal Growth & Design","2011","11","8","3479","","10.1021/cg200308k","","","0.71073","MoKα","","0.1059","0.0822","","","0.1651","0.1782","","","","","","1.068","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500793","11.2815","0.0016","11.2815","0.0016","49.769","0.01","90","","90","","90","","6334.2","1.8","223","2","223","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C61 H50 Eu N10 O16 -","- C61 H50.04 Eu N10 O16 -","- C244 H200.16 Eu4 N40 O64 -","4","0.25","","Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping","Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand","Crystal Growth & Design","2011","11","8","3479","","10.1021/cg200308k","","","0.71073","MoKα","","0.0978","0.0791","","","0.1966","0.2124","","","","","","1.097","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500794","11.3086","0.0016","11.3086","0.0016","49.019","0.01","90","","90","","90","","6268.8","1.8","223","2","223","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C61 H50 N10 O16 Yb -","- C61 H50.04 N10 O16 Yb -","- C244 H200.16 N40 O64 Yb4 -","4","0.25","","Liu, Lei-Lei; Ren, Zhi-Gang; Zhu, Lian-Wen; Wang, Hui-Fang; Yan, Wen-Yan; Lang, Jian-Ping","Temperature-Driven Assembly of Ln(III) (Ln = Nd, Eu, Yb) Coordination Polymers of a Flexible Azo Calix[4]arene Polycarboxylate Ligand","Crystal Growth & Design","2011","11","8","3479","","10.1021/cg200308k","","","0.71073","MoKα","","0.0936","0.0771","","","0.1819","0.1935","","","","","","1.143","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500795","20.0403","0.0011","20.0403","0.0011","21.4606","0.0012","90","","90","","90","","8618.9","0.8","123","2","123","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C52 H40 I8 O14 Si8 -","- C48 H32 I8 O12 Si8 -","- C192 H128 I32 O48 Si32 -","4","0.25","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.0915","0.074","","","0.2186","0.2302","","","","","","1.134","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500796","28.054","0.002","15.6168","0.0011","22.3246","0.0016","90","","108.859","0.001","90","","9255.7","1.1","85","2","85","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C60 H40 I10 O15 Si10 -","- C60 H40 I10 O15 Si10 -","- C240 H160 I40 O60 Si40 -","4","0.5","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.0492","0.0461","","","0.1152","0.117","","","","","","1.058","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500797","32.082","0.009","14.704","0.004","28.755","0.008","90","","118.438","0.004","90","","11928","6","85","2","85","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C104 H88 I12 O18 Si12 -","- C104 H88 I12 O18 Si12 -","- C416 H352 I48 O72 Si48 -","4","0.5","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.1064","0.0919","","","0.2732","0.2885","","","","","","1.093","","","","has coordinates","179538","2020-10-21","18:00:00",""
"4500798","20.5738","0.001","20.5738","0.001","36.261","0.004","90","","90","","90","","15349","2","85","2","85","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H57 Br8 O12 Si8 -","- C64 H52 Br8 O12 Si8 -","- C512 H416 Br64 O96 Si64 -","8","0.5","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.0626","0.0526","","","0.146","0.153","","","","","","1.089","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500799","12.7172","0.0009","12.7392","0.0009","13.089","0.0009","97.592","0.001","109.075","0.001","116.231","0.001","1699.3","0.2","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H24 Br16 O12 S2 Si8 -","- C49 H24 Br16 O12 S2 Si8 -","- C49 H24 Br16 O12 S2 Si8 -","1","0.5","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.0313","0.027","","","0.0742","0.0765","","","","","","1.045","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4500800","15.5726","0.001","20.4685","0.0013","20.6449","0.0013","65.399","0.001","74.616","0.001","82.172","0.001","5766.3","0.6","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H36 Br24 Cl5 O12 Si8 -","- C54 H20 Br24 Cl2 O12 Si8 -","- C108 H40 Br48 Cl4 O24 Si16 -","2","1","","Roll, Mark F.; Kampf, Jeffrey W.; Laine, Richard M.","Halogen Bonding Motifs in Polyhedral Phenylsilsesquioxanes: Effects of Systematic Variations in Geometry or Substitution","Crystal Growth & Design","2011","11","10","4360","","10.1021/cg200312g","","","0.71073","MoKα","","0.0757","0.0629","","","0.1935","0.2024","","","","","","1.089","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500801","28.33","0.003","27.766","0.003","9.9055","0.0011","90","","90","","90","","7791.8","1.5","291","2","291","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C57 H56 N16 O16 Zn2 -","- C57 H56 N16 O16 Zn2 -","- C228 H224 N64 O64 Zn8 -","4","0.5","","Yao, Xiao-Qiang; Zhang, Ming-Dao; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Two Porous Zinc Coordination Polymers with (10,3) Topological Features Based on a N-Centered Tripodal Ligand and the Conversion of a (10,3)-d Subnet to a (10,3)-a Subnet","Crystal Growth & Design","2011","11","7","3039","","10.1021/cg200315f","","","0.71073","MoKα","","0.0797","0.0506","","","0.0959","0.1","","","","","","1.007","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500802","7.9114","0.0011","14.2572","0.0019","29.557","0.002","90","","90","","90","","3333.9","0.7","291","2","291","2","","","","","","","","5","P 2 2 21","P 2c 2","17","","","","- C59 H52 N16 O12 Zn2 -","- C59 H52 N16 O12 Zn2 -","- C118 H104 N32 O24 Zn4 -","2","0.5","","Yao, Xiao-Qiang; Zhang, Ming-Dao; Hu, Jin-Song; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen","Two Porous Zinc Coordination Polymers with (10,3) Topological Features Based on a N-Centered Tripodal Ligand and the Conversion of a (10,3)-d Subnet to a (10,3)-a Subnet","Crystal Growth & Design","2011","11","7","3039","","10.1021/cg200315f","","","0.71073","MoKα","","0.0845","0.0678","","","0.1412","0.1452","","","","","","1.067","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500803","9.4124","0.0019","14.645","0.003","12.444","0.004","90","","129.841","0.018","90","","1317.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-ethyl-3-methylimidazolium tetrachloroferrat(III)","","","- C6 H11 Cl4 Fe N2 -","- C6 H11 Cl4 Fe N2 -","- C24 H44 Cl16 Fe4 N8 -","4","1","","Bäcker, Tobias; Breunig, Oliver; Valldor, Martin; Merz, Klaus; Vasylyeva, Vera; Mudring, Anja-Verena","In-Situ Crystal Growth and Properties of the Magnetic Ionic Liquid [C2mim][FeCl4]","Crystal Growth & Design","2011","11","6","2564","","10.1021/cg200326n","","","0.71073","MoKα","","0.159","0.0982","","","0.2509","0.3296","","","","","","1.047","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500804","6.1337","0.0012","14.362","0.003","7.1111","0.0014","90","","91.33","0.03","90","","626.3","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H11 Cl4 Fe N2 -","- C6 H11 Cl4 Fe N2 -","- C12 H22 Cl8 Fe2 N4 -","2","1","","Bäcker, Tobias; Breunig, Oliver; Valldor, Martin; Merz, Klaus; Vasylyeva, Vera; Mudring, Anja-Verena","In-Situ Crystal Growth and Properties of the Magnetic Ionic Liquid [C2mim][FeCl4]","Crystal Growth & Design","2011","11","6","2564","","10.1021/cg200326n","","","0.71073","MoKα","","0.1857","0.1425","","","0.3397","0.3707","","","","","","2.116","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500805","12.3475","0.0005","11.1929","0.0005","28.6734","0.0012","90","","98.816","0.001","90","","3916","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H37 Mg3 N7 O16 -","- C33 H37 Mg3 N7 O16 -","- C132 H148 Mg12 N28 O64 -","4","1","","Banerjee, Debasis; Finkelstein, Jeffrey; Smirnov, A.; Forster, Paul M.; Borkowski, Lauren A.; Teat, Simon J.; Parise, John B.","Synthesis and Structural Characterization of Magnesium Based Coordination Networks in Different Solvents","Crystal Growth & Design","2011","11","6","2572","","10.1021/cg200327y","","","0.41328","synchrotron","","0.0769","0.053","","","0.1382","0.1517","","","","","","1.037","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500806","9.9364","0.0005","12.0694","0.0006","7.2763","0.0004","90","","106.497","0.0006","90","","836.7","0.08","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H7 Mg N O6 -","- C7 H7 Mg N O6 -","- C28 H28 Mg4 N4 O24 -","4","0.5","","Banerjee, Debasis; Finkelstein, Jeffrey; Smirnov, A.; Forster, Paul M.; Borkowski, Lauren A.; Teat, Simon J.; Parise, John B.","Synthesis and Structural Characterization of Magnesium Based Coordination Networks in Different Solvents","Crystal Growth & Design","2011","11","6","2572","","10.1021/cg200327y","","","0.7709","","","0.0537","0.052","","","0.1602","0.1621","","","","","","1.066","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500807","11.4799","0.0014","11.4799","0.0014","14.735","0.003","90","","90","","120","","1681.7","0.4","298","2","298","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C7 H3 Mg N O5 -","- C7 H3 Mg N O5 -","- C42 H18 Mg6 N6 O30 -","6","0.5","","Banerjee, Debasis; Finkelstein, Jeffrey; Smirnov, A.; Forster, Paul M.; Borkowski, Lauren A.; Teat, Simon J.; Parise, John B.","Synthesis and Structural Characterization of Magnesium Based Coordination Networks in Different Solvents","Crystal Growth & Design","2011","11","6","2572","","10.1021/cg200327y","","","0.71073","MoKα","","0.0275","0.0251","","","0.0711","0.0719","","","","","","1.128","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500808","13.7442","0.0014","14.2887","0.0015","14.1178","0.0014","90","","104.912","0.002","90","","2679.2","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H44 Mg4 N8 O26.5 -","- C40 H44 Mg4 N8 O26.504 -","- C80 H88 Mg8 N16 O53.008 -","2","0.5","","Banerjee, Debasis; Finkelstein, Jeffrey; Smirnov, A.; Forster, Paul M.; Borkowski, Lauren A.; Teat, Simon J.; Parise, John B.","Synthesis and Structural Characterization of Magnesium Based Coordination Networks in Different Solvents","Crystal Growth & Design","2011","11","6","2572","","10.1021/cg200327y","","","0.71073","MoKα","","0.0766","0.0477","","","0.1246","0.1396","","","","","","1.013","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500809","5.5343","0.0008","14.61","0.002","15.176","0.002","90","","92.342","0.002","90","","1226","0.3","200","2","200","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","","Waldschmidt, Audrey; Rietveld, Ivo; Couvrat, Nicolas; Dupray, Valérie; Sanselme, Morgane; Berton, Benjamin; Nicolai, Béatrice; Mahé, Nathalie; Petit, Samuel; Céolin, René; Coquerel, Gérard","About Aged Heterogeneous Liquid Inclusions Inside Organic Crystals in Relation to Crystal Formation, Structure, and Morphology","Crystal Growth & Design","2011","11","6","2580","","10.1021/cg200331n","","x-ray","0.71073","MoKα","","0.0414","0.0385","","","0.1042","0.1069","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500810","5.6103","0.0007","14.6856","0.0018","15.5496","0.0019","90","","92.043","0.002","90","","1280.3","0.3","293","2","293","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","","Waldschmidt, Audrey; Rietveld, Ivo; Couvrat, Nicolas; Dupray, Valérie; Sanselme, Morgane; Berton, Benjamin; Nicolai, Béatrice; Mahé, Nathalie; Petit, Samuel; Céolin, René; Coquerel, Gérard","About Aged Heterogeneous Liquid Inclusions Inside Organic Crystals in Relation to Crystal Formation, Structure, and Morphology","Crystal Growth & Design","2011","11","6","2580","","10.1021/cg200331n","","x-ray","0.71073","MoKα","","0.0528","0.0432","","","0.1242","0.1325","","","","","","1.005","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500811","8.477","0.005","8.795","0.005","8.929","0.005","92.248","0.005","95.825","0.005","98.076","0.005","654.7","0.6","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C5 H15 Ga N2 O8 P2 -","- C5 H15 Ga N2 O8 P2 -","- C10 H30 Ga2 N4 O16 P4 -","2","1","","Olshansky, Jacob H.; Blau, Samuel M.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","Understanding an Order‒Disorder Phase Transition in Ionothermally Synthesized Gallium Phosphates","Crystal Growth & Design","2011","11","7","3065","","10.1021/cg200332y","","","0.71073","MoKα","","0.0285","0.026","","0.0695","0.0677","0.0666","","","","","","1.0017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500812","8.451","0.0019","8.777","0.002","8.928","0.002","92.195","0.003","95.709","0.003","98.509","0.003","650.7","0.3","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C5 H15 Ga N2 O8 P2 -","- C5 H15 Ga N2 O8 P2 -","- C10 H30 Ga2 N4 O16 P4 -","2","1","","Olshansky, Jacob H.; Blau, Samuel M.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","Understanding an Order‒Disorder Phase Transition in Ionothermally Synthesized Gallium Phosphates","Crystal Growth & Design","2011","11","7","3065","","10.1021/cg200332y","","","0.71073","MoKα","","0.0301","0.027","","0.0749","0.0732","0.0722","","","","","","0.8254","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500813","15.1432","0.0017","8.9454","0.001","8.973","0.001","90","","90","","90","","1215.5","0.2","100","","100","","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C5 H15 Ga N2 O8 P2 -","- C5 H15 Ga N2 O8 P2 -","- C20 H60 Ga4 N8 O32 P8 -","4","0.5","","Olshansky, Jacob H.; Blau, Samuel M.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","Understanding an Order‒Disorder Phase Transition in Ionothermally Synthesized Gallium Phosphates","Crystal Growth & Design","2011","11","7","3065","","10.1021/cg200332y","","","0.71073","MoKα","","0.081","0.0574","","0.1124","0.1014","0.0933","","","","","","1.145","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500814","8.899","0.004","15.087","0.007","8.923","0.004","90","","90.114","0.007","90","","1198","0.9","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H15 Ga N2 O8 P2 -","- C5 H15 Ga N2 O8 P2 -","- C20 H60 Ga4 N8 O32 P8 -","4","1","","Olshansky, Jacob H.; Blau, Samuel M.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","Understanding an Order‒Disorder Phase Transition in Ionothermally Synthesized Gallium Phosphates","Crystal Growth & Design","2011","11","7","3065","","10.1021/cg200332y","","","0.71073","MoKα","","0.1098","0.0654","","0.1494","0.1285","0.1176","","","","","","0.9898","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500815","8.006","0.0005","9.3913","0.0005","13.4786","0.0008","74.611","0.003","75.053","0.003","86.102","0.003","944.02","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 N4 O5 S -","- C19 H20 N4 O5 S -","- C38 H40 N8 O10 S2 -","2","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0527","0.0458","","","0.118","0.1288","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500816","7.9671","0.0003","9.4629","0.0004","13.9432","0.0006","73.662","0.002","74.468","0.002","87.24","0.002","971.5","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 N4 O6 S -","- C19 H20 N4 O6 S -","- C38 H40 N8 O12 S2 -","2","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.049","0.0395","","","0.1312","0.1452","","","","","","1.176","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500817","8.107","0.0004","17.5194","0.0008","14.7732","0.0007","90","","93.767","0.003","90","","2093.7","0.17","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 Cl2 N4 O4 S -","- C19 H18 Cl2 N4 O4 S -","- C76 H72 Cl8 N16 O16 S4 -","4","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0734","0.0411","","","0.1","0.1309","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500818","8.6932","0.0004","17.0624","0.0007","14.2695","0.0006","90","","106.554","0.003","90","","2028.82","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N4 O4 S -","- C18 H22 N4 O4 S -","- C72 H88 N16 O16 S4 -","4","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0562","0.0412","","","0.123","0.1587","","","","","","0.91","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500819","11.4148","0.0007","20.1672","0.0012","14.8653","0.0009","90","","90","","90","","3422.1","0.4","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C30 H35 N9 O8 S2 -","- C30 H32 N9 O8 S2 -","- C120 H128 N36 O32 S8 -","4","0.5","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0402","0.0349","","","0.0994","0.1091","","","","","","0.812","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500820","12.1076","0.0008","13.5903","0.0009","14.7508","0.001","77.756","0.001","66.198","0.001","85.237","0.001","2170.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H22 N4 O5 S -","- C23 H22 N4 O5 S -","- C92 H88 N16 O20 S4 -","4","2","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0445","0.0355","","","0.0978","0.1064","","","","","","1.039","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500821","8.4321","0.0007","12.969","0.0011","17.5247","0.0016","90","","94.2","0.006","90","","1911.3","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N5 O3 S -","- C19 H21 N5 O3 S -","- C76 H84 N20 O12 S4 -","4","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0966","0.086","","","0.2174","0.2253","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500822","9.684","0.004","15.716","0.006","25.31","0.009","90","","90","","90","","3852","3","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H20 N6 O3 S -","- C18 H20 N6 O3 S -","- C144 H160 N48 O24 S8 -","8","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0862","0.0475","","","0.1094","0.142","","","","","","1.075","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500823","8.3238","0.0006","9.5864","0.0008","14.0808","0.0011","109.249","0.002","95.432","0.002","106.165","0.002","997.06","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 N5 O4 S -","- C19 H20 N5 O4 S -","- C38 H40 N10 O8 S2 -","2","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0614","0.0472","","","0.1551","0.1865","","","","","","0.783","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500824","8.5398","0.0004","18.2753","0.0007","13.3498","0.0005","90","","105.792","0.002","90","","2004.83","0.14","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H21 N5 O4 S -","- C19 H21 N5 O4 S -","- C76 H84 N20 O16 S4 -","4","2","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.0429","0.0361","","","0.0957","0.1014","","","","","","1.04","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500825","6.7701","0.0004","16.6846","0.0011","18.9656","0.0012","90","","90","","90","","2142.3","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H22 N4 O5 S -","- C23 H22 N4 O5 S -","- C92 H88 N16 O20 S4 -","4","1","","Ghosh, Soumyajit; Bag, Partha Pratim; Reddy, C. Malla","Co-Crystals of Sulfamethazine with Some Carboxylic Acids and Amides: Co-Former Assisted Tautomerism in an Active Pharmaceutical Ingredient and Hydrogen Bond Competition Study","Crystal Growth & Design","2011","11","8","3489","","10.1021/cg200334m","","","0.71073","MoKα","","0.029","0.0272","","","0.08","0.083","","","","","","0.895","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500826","9.9016","0.0019","16.818","0.003","23.978","0.005","90","","95.093","0.002","90","","3977.2","1.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H16 Cs2 F O24 P4 U2 -","- C28 H16 Cs2 F O24 P4 U2 -","- C112 H64 Cs8 F4 O96 P16 U8 -","4","1","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Layered and Three-Dimensional Framework Cesium and Barium Uranyl Carboxyphenylphosphonates","Crystal Growth & Design","2011","11","7","3072","","10.1021/cg200337w","","","0.71073","MoKα","","0.073","0.0385","","","0.0585","0.0635","","","","","","0.868","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500827","14.1905","0.0012","15.1412","0.0013","21.4178","0.0018","85.019","0.001","88.303","0.001","88.252","0.001","4580.7","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H32 Cs4 O59 P8 U6 -","- C56 H32 Cs4 O59 P8 U6 -","- C112 H64 Cs8 O118 P16 U12 -","2","1","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Layered and Three-Dimensional Framework Cesium and Barium Uranyl Carboxyphenylphosphonates","Crystal Growth & Design","2011","11","7","3072","","10.1021/cg200337w","","","0.71073","MoKα","","0.071","0.0396","","","0.0785","0.0851","","","","","","0.912","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500828","22.0556","0.0018","20.5225","0.0016","11.9563","0.0009","90","","90","","90","","5411.9","0.7","103","2","103","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C21 H12 Cs3 O28 P3 U3 -","- C21 H12 Cs3 O28 P3 U3 -","- C84 H48 Cs12 O112 P12 U12 -","4","0.5","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Layered and Three-Dimensional Framework Cesium and Barium Uranyl Carboxyphenylphosphonates","Crystal Growth & Design","2011","11","7","3072","","10.1021/cg200337w","","","0.71073","MoKα","","0.0603","0.0423","","","0.1222","0.1327","","","","","","1.072","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500829","8.2956","0.0008","12.9202","0.0013","23.109","0.002","90","","90","","90","","2476.8","0.4","100","2","100","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C14 H8 Ba F2 O16 P2 U2 -","- C14 H8 Ba F2 O16 P2 U2 -","- C56 H32 Ba4 F8 O64 P8 U8 -","4","0.5","","Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.","Layered and Three-Dimensional Framework Cesium and Barium Uranyl Carboxyphenylphosphonates","Crystal Growth & Design","2011","11","7","3072","","10.1021/cg200337w","","","0.71073","MoKα","","0.0515","0.0402","","","0.0837","0.086","","","","","","1.319","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500830","10.9737","0.0006","13.7663","0.0011","14.7029","0.0011","110.812","0.003","98.887","0.005","90.371","0.004","2046.7","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H94 N26 O40 U4 -","- C56 H90 N26 O40 U4 -","- C56 H90 N26 O40 U4 -","1","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.0321","0.0263","","","0.0691","0.0716","","","","","","1.027","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500831","10.8119","0.0003","13.8031","0.0003","15.1715","0.0004","72.374","0.001","86.505","0.001","89.934","0.002","2153.5","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H92 N26 O37 U4 -","- C58 H86 N26 O37 U4 -","- C58 H86 N26 O37 U4 -","1","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.049","0.0422","","","0.1143","0.117","","","","","","1.1","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500832","13.8427","0.0004","10.8346","0.0006","27.9882","0.0015","90","","97.554","0.003","90","","4161.2","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H98 N26 O40 U4 -","- C58 H94 N26 O40 U4 -","- C116 H188 N52 O80 U8 -","2","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.0872","0.0708","","","0.1588","0.1635","","","","","","1.204","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500833","19.8332","0.0019","17.3585","0.0013","16.4723","0.0013","90","","110.505","0.005","90","","5311.7","0.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C70 H104 N34 O46 U4 -","- C70 H96 N34 O46 U4 -","- C140 H192 N68 O92 U8 -","2","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.0802","0.0464","","","0.0986","0.1091","","","","","","0.983","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500834","12.573","0.0006","15.38","0.0006","20.3515","0.0009","88.261","0.002","89.67","0.002","73.475","0.002","3771.1","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H76 N25 O33.5 U3 -","- C52 H69 N25 O33.5 U3 -","- C104 H138 N50 O67 U6 -","2","1","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.0568","0.0419","","","0.1143","0.1225","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500835","14.1924","0.0009","14.4051","0.001","17.9721","0.0013","75.762","0.003","71.555","0.004","74.542","0.004","3306.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C104 H166 N28 O45 U4 -","- C104 H164 N28 O45 U4 -","- C104 H164 N28 O45 U4 -","1","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.064","0.0464","","","0.1159","0.1229","","","","","","1.055","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500836","11.4855","0.0006","17.7608","0.0009","17.8932","0.0004","81.984","0.003","81.888","0.003","71.627","0.002","3411.8","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C87 H143 Ca2 N25 O71 U8 -","- C87 H131 Ca2 N25 O71 U8 -","- C87 H131 Ca2 N25 O71 U8 -","1","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.0531","0.0398","","","0.0917","0.0968","","","","","","1.039","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500837","10.8713","0.0007","16.6696","0.0006","17.9276","0.001","100.306","0.003","95.584","0.003","91.732","0.004","3177.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C93 H147 N27 O62 Sr2 U6 -","- C93 H145 N27 O62 Sr2 U6 -","- C93 H145 N27 O62 Sr2 U6 -","1","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.0506","0.0428","","","0.1079","0.111","","","","","","1.13","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500838","10.9467","0.0004","17.8697","0.0008","18.8015","0.0008","95.149","0.002","99.457","0.003","90.872","0.003","3611.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C102 H162 N26 O66 Sr2 U8 -","- C102 H150 N26 O66 Sr2 U8 -","- C102 H150 N26 O66 Sr2 U8 -","1","0.5","","Thuéry, Pierre","Uranyl Ion Complexation by Aliphatic Dicarboxylic Acids in the Presence of Cucurbiturils as Additional Ligands or Structure-Directing Agents","Crystal Growth & Design","2011","11","6","2606","","10.1021/cg200349p","","","0.71073","MoKα","","0.049","0.0384","","","0.1038","0.1076","","","","","","1.05","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500839","4.9895","0.0003","11.2668","0.0006","13.4131","0.0008","89.004","0.002","97.499","0.002","100.658","0.002","734.66","0.07","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H15 N O8 -","- C16 H15 N O8 -","- C32 H30 N2 O16 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0718","0.0515","","","0.1243","0.1364","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500840","10.134","0.0004","10.3552","0.0004","10.7436","0.0006","78.1625","0.0016","89.43","0.002","65.239","0.003","998.34","0.08","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H19 La N2 O10 -","- C18 H19 La N2 O10 -","- C36 H38 La2 N4 O20 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.048","0.0365","","","0.0799","0.0848","","","","","","1.031","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500841","9.5211","0.0004","9.9835","0.0004","11.4843","0.0005","96.342","0.002","97.063","0.002","111.763","0.0019","991.6","0.07","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H37 N3 Nd2 O22 -","- C33 H37 N3 Nd2 O22 -","- C33 H37 N3 Nd2 O22 -","1","0.5","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0472","0.0394","","","0.0996","0.1042","","","","","","1.072","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500842","9.6047","0.0004","10.0427","0.0004","11.4589","0.0005","96.126","0.002","97.2065","0.0017","111.858","0.0019","1003.5","0.07","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H37 Ce2 N3 O22 -","- C33 H37 Ce2 N3 O22 -","- C33 H37 Ce2 N3 O22 -","1","0.5","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0538","0.0427","","","0.0972","0.102","","","","","","1.053","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500843","9.9873","0.0003","12.3715","0.0004","15.289","0.0007","98.1485","0.0016","108.836","0.0017","105.377","0.003","1669.55","0.11","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H21 N3 Ni O9 -","- C25 H21 N3 Ni O9 -","- C50 H42 N6 Ni2 O18 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0988","0.0596","","","0.1563","0.1693","","","","","","0.933","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500844","10.0171","0.0003","12.4196","0.0004","15.3363","0.0005","98.9554","0.0015","108.475","0.001","105.042","0.0015","1687.66","0.1","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H21 Co N3 O9 -","- C25 H21 Co N3 O9 -","- C50 H42 Co2 N6 O18 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.1061","0.0648","","","0.1723","0.1895","","","","","","0.944","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500845","19.8252","0.0005","22.6037","0.0005","14.7099","0.0004","90","","106.653","0.0013","90","","6315.4","0.3","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H23 N3 Ni O10 -","- C27 H23 N3 Ni O10 -","- C216 H184 N24 Ni8 O80 -","8","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.1154","0.0619","","","0.1478","0.1642","","","","","","0.909","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500846","9.7118","0.0002","10.7141","0.0002","12.0639","0.0003","87.8804","0.0006","84.6264","0.0006","69.6892","0.0007","1172.05","0.04","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H21 N3 O9 Zn -","- C25 H21 N3 O9 Zn -","- C50 H42 N6 O18 Zn2 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0423","0.0351","","","0.0923","0.0993","","","","","","1.048","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500847","8.88","0.0003","9.563","0.0004","13.438","0.0006","75.128","0.002","73.219","0.003","67.246","0.002","993.84","0.07","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H15 N2 O8 Zn -","- C21 H15 N2 O8 Zn -","- C42 H30 N4 O16 Zn2 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.1448","0.0736","","","0.191","0.2285","","","","","","1.07","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500848","8.6344","0.0004","13.7688","0.0006","15.5455","0.0009","89.0045","0.0017","89.3352","0.0019","77.349","0.002","1802.93","0.16","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H30 N4 O9 Zn -","- C33 H30 N4 O9 Zn -","- C66 H60 N8 O18 Zn2 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0933","0.062","","","0.1187","0.1287","","","","","","1.032","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500849","13.3976","0.0002","14.4423","0.0003","14.5635","0.0004","70.3962","0.0007","65.2936","0.0007","68.9087","0.0013","2330.82","0.09","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H43 Ag3 N7 O12 -","- C45 H43 Ag3 N7 O12 -","- C90 H86 Ag6 N14 O24 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.0977","0.055","","","0.1298","0.147","","","","","","0.962","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500850","9.8468","0.0002","14.091","0.0003","19.5261","0.0004","85.1605","0.0008","78.4046","0.0009","82.902","0.0012","2628.7","0.09","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H57 Ag3 N8 O16 -","- C51 H57 Ag3 N8 O16 -","- C102 H114 Ag6 N16 O32 -","2","1","","Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel","Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity","Crystal Growth & Design","2011","11","6","2621","","10.1021/cg200350j","","","0.71073","MoKα","","0.1052","0.0585","","","0.1447","0.1728","","","","","","1.001","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500851","11.211","0.003","12.244","0.003","8.541","0.002","90","","90","","90","","1172.4","0.5","298","2","298","2","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C17 H27 Cu4 N11 -","- C17 H25 Cu4 N11 -","- C34 H50 Cu8 N22 -","2","0.25","","Qin, Ying-Lian; Hou, Juan-Juan; Lv, Jin; Zhang, Xian-Ming","Organic Templated Cuprous Cyanide Open Frameworks Based on Cu2(CN)6Dimer with Strong and Long-Lived Luminescence","Crystal Growth & Design","2011","11","7","3101","","10.1021/cg200362c","","","0.71073","MoKα","","0.0529","0.0481","","","0.1109","0.1137","","","","","","1.174","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500852","11.361","0.007","12.393","0.008","8.44","0.006","90","","90","","90","","1188.3","1.4","298","2","298","2","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C19 H32 Cu4 N11 -","- C19 H30 Cu4 N11 -","- C38 H60 Cu8 N22 -","2","0.25","","Qin, Ying-Lian; Hou, Juan-Juan; Lv, Jin; Zhang, Xian-Ming","Organic Templated Cuprous Cyanide Open Frameworks Based on Cu2(CN)6Dimer with Strong and Long-Lived Luminescence","Crystal Growth & Design","2011","11","7","3101","","10.1021/cg200362c","","","0.71073","MoKα","","0.0445","0.0345","","","0.1038","0.1216","","","","","","1.266","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500853","16.3232","0.0016","8.7492","0.0009","10.9207","0.0011","90","","90","","90","","1559.6","0.3","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C11 H16 Cu3 N7 -","- C11 H16 Cu3 N7 -","- C44 H64 Cu12 N28 -","4","0.5","","Qin, Ying-Lian; Hou, Juan-Juan; Lv, Jin; Zhang, Xian-Ming","Organic Templated Cuprous Cyanide Open Frameworks Based on Cu2(CN)6Dimer with Strong and Long-Lived Luminescence","Crystal Growth & Design","2011","11","7","3101","","10.1021/cg200362c","","","0.71073","MoKα","","0.0699","0.0586","","","0.1583","0.1651","","","","","","1.069","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500854","14.444","0.0018","12.5254","0.0015","13.3074","0.0016","90","","90","","90","","2407.5","0.5","140","2","140","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C11 H14 Cu4 N8 -","- C12 H15 Cu4 N7 -","- C48 H60 Cu16 N28 -","4","0.5","","Qin, Ying-Lian; Hou, Juan-Juan; Lv, Jin; Zhang, Xian-Ming","Organic Templated Cuprous Cyanide Open Frameworks Based on Cu2(CN)6Dimer with Strong and Long-Lived Luminescence","Crystal Growth & Design","2011","11","7","3101","","10.1021/cg200362c","","","0.71073","MoKα","","0.0912","0.0861","","","0.2363","0.2539","","","","","","1.184","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500855","49.052","0.006","9.5736","0.0011","20.209","0.002","90","","103.244","0.001","90","","9237.8","1.8","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C96 H90 Co6 N10 O33 -","- C96 H90 Co6 N10 O33 -","- C384 H360 Co24 N40 O132 -","4","0.5","","Ma, Lu-Fang; Li, Cheng-Peng; Wang, Li-Ya; Du, Miao","CoIIand ZnIICoordination Frameworks with Benzene-1,2,3-tricarboxylate Tecton and Flexible Dipyridyl Co-Ligand: A New Type of Entangled Architecture and a Unique 4-Connected Topological Network","Crystal Growth & Design","2011","11","8","3309","","10.1021/cg200366a","","","0.71073","MoKα","","0.0499","0.0349","","","0.0803","0.0883","","","","","","1.024","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500856","9.8885","0.0011","10.9627","0.0012","17.946","0.002","90","","91.271","0.001","90","","1945","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H16 N2 O7 Zn2 -","- C21 H16 N2 O7 Zn2 -","- C84 H64 N8 O28 Zn8 -","4","1","","Ma, Lu-Fang; Li, Cheng-Peng; Wang, Li-Ya; Du, Miao","CoIIand ZnIICoordination Frameworks with Benzene-1,2,3-tricarboxylate Tecton and Flexible Dipyridyl Co-Ligand: A New Type of Entangled Architecture and a Unique 4-Connected Topological Network","Crystal Growth & Design","2011","11","8","3309","","10.1021/cg200366a","","","0.71073","MoKα","","0.0539","0.0356","","","0.0801","0.0892","","","","","","1.031","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500857","21.209","0.002","22.825","0.002","18.1999","0.0018","90","","90","","90","","8810.5","1.4","291","2","291","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C126 H120 F0 N2 O71 Zn14 -","- C126 H120 N2 O71 Zn14 -","- C252 H240 N4 O142 Zn28 -","2","0.25","","Qin, Ling; Hu, Jin-Song; Li, Yi-Zhi; Zheng, He-Gen","Three New Coordination Polymers Based on One Reduced Symmetry Tripodal Linker","Crystal Growth & Design","2011","11","7","3115","","10.1021/cg2003673","","","0.71073","MoKα","","0.0835","0.0544","","","0.1123","0.1187","","","","","","1.029","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500858","7.1422","0.0016","21.211","0.005","22.181","0.005","62.412","0.004","81.392","0.004","89.538","0.004","2937.5","1.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H39 Cd3 N O17 -","- C46 H39 Cd3 N O17 -","- C92 H78 Cd6 N2 O34 -","2","1","","Qin, Ling; Hu, Jin-Song; Li, Yi-Zhi; Zheng, He-Gen","Three New Coordination Polymers Based on One Reduced Symmetry Tripodal Linker","Crystal Growth & Design","2011","11","7","3115","","10.1021/cg2003673","","","0.71073","MoKα","","0.0856","0.0518","","","0.1452","0.1696","","","","","","1.058","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4500859","24.636","0.003","12.0873","0.0016","24.464","0.003","90","","115.818","0.002","90","","6557.8","1.4","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H26 Co N4 O6 -","- C39 H26 Co N4 O6 -","- C312 H208 Co8 N32 O48 -","8","1","","Qin, Ling; Hu, Jin-Song; Li, Yi-Zhi; Zheng, He-Gen","Three New Coordination Polymers Based on One Reduced Symmetry Tripodal Linker","Crystal Growth & Design","2011","11","7","3115","","10.1021/cg2003673","","","0.71073","MoKα","","0.097","0.0565","","","0.0766","0.0831","","","","","","1.005","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500860","11.226","0.002","21.458","0.004","22.428","0.004","106.694","0.002","92.651","0.002","104.983","0.001","4956.4","1.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C128 H98 O4 -","- C128 H98 O4 -","- C256 H196 O8 -","2","1","","O’Brien, Zachary J.; Natarajan, Arunkumar; Khan, Saeed; Garcia-Garibay, Miguel A.","Synthesis and Solid-State Rotational Dynamics of Molecular Gyroscopes with a Robust and Low Density Structure Built with a Phenylene Rotator and a Tri(meta-terphenyl)methyl Stator","Crystal Growth & Design","2011","11","6","2654","","10.1021/cg200373g","","","0.71073","MoKα","","0.1172","0.0636","","","0.1454","0.1724","","","","","","1.016","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500861","10.1535","0.0004","13.2333","0.0006","23.732","0.0013","90","","90","","90","","3188.7","0.3","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H24 Cl2 N6 O8 Ru -","- C30 H24 Cl2 N6 O8 Ru -","- C120 H96 Cl8 N24 O32 Ru4 -","4","1","","Cheung, Eugene Y.; Fujii, Kotaro; Guo, Fang; Harris, Kenneth D. M.; Hasebe, Sayoko; Kuroda, Reiko","Structural Chemistry of a New Chiral Anhydrous Phase of Ru(bipy)3(ClO4)2Established from Powder X-ray Diffraction Analysis","Crystal Growth & Design","2011","11","8","3313","","10.1021/cg200379h","powder diffraction","x-ray","1.54056","","","","","","","","","0.05921","","4.84","","","","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500862","18.82","0.016","7.292","0.006","23.444","0.015","90","","123.17","0.05","90","","2693","4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25.5 H13 F9 O6 Zn -","- C25.5 H13 F9 O6 Zn -","- C102 H52 F36 O24 Zn4 -","4","1","","Wu, Ya-Pan; Li, Dong-Sheng; Fu, Feng; Dong, Wen-Wen; Zhao, Jun; Zou, Kun; Wang, Yao-Yu","Stoichiometry of N-Donor Ligand Mediated Assembly in the ZnII-Hfipbb System: From a 2-Fold Interpenetrating Pillared-Network to Unique (3,4)-Connected Isomeric Nets","Crystal Growth & Design","2011","11","9","3850","","10.1021/cg200389q","","","0.71073","MoKα","","0.1178","0.0987","","","0.2914","0.3077","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500863","12.3826","0.0005","13.7119","0.0005","26.2216","0.001","90","","92.075","0.001","90","","4449.2","0.3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H26 F12 N2 O9 S Zn2 -","- C44 H26 F12 N2 O9 S Zn2 -","- C176 H104 F48 N8 O36 S4 Zn8 -","4","1","","Wu, Ya-Pan; Li, Dong-Sheng; Fu, Feng; Dong, Wen-Wen; Zhao, Jun; Zou, Kun; Wang, Yao-Yu","Stoichiometry of N-Donor Ligand Mediated Assembly in the ZnII-Hfipbb System: From a 2-Fold Interpenetrating Pillared-Network to Unique (3,4)-Connected Isomeric Nets","Crystal Growth & Design","2011","11","9","3850","","10.1021/cg200389q","","","0.71073","MoKα","","0.0579","0.0511","","","0.1576","0.1654","","","","","","1.044","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500864","24.768","0.004","13.071","0.002","27.906","0.004","90","","97.138","0.002","90","","8964","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H26 F12 N2 O9 S Zn2 -","- C44 H26 F12 N2 O9 S Zn2 -","- C352 H208 F96 N16 O72 S8 Zn16 -","8","1","","Wu, Ya-Pan; Li, Dong-Sheng; Fu, Feng; Dong, Wen-Wen; Zhao, Jun; Zou, Kun; Wang, Yao-Yu","Stoichiometry of N-Donor Ligand Mediated Assembly in the ZnII-Hfipbb System: From a 2-Fold Interpenetrating Pillared-Network to Unique (3,4)-Connected Isomeric Nets","Crystal Growth & Design","2011","11","9","3850","","10.1021/cg200389q","","","0.71073","MoKα","","0.0905","0.0528","","","0.1254","0.138","","","","","","0.998","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500865","7.7757","0.0001","25.7669","0.0004","9.9187","0.0002","90","","90","","90","","1987.27","0.06","293","2","293","2","","","","","","","synthesis as described","5","C m c m","-C 2c 2","63","rp231","","","- C12 Co N10 O4 W -","- C12 Co N10 O4 W -","- C48 Co4 N40 O16 W4 -","4","0.25","","Podgajny, Robert; Choraży, Szymon; Nitek, Wojciech; Budziak, Andrzej; Rams, Michał; Gómez-García, Carlos J.; Oszajca, Marcin; Łasocha, Wiesław; Sieklucka, Barbara","Humidity-Driven Reversible Transformation and Guest Inclusion in a Two-Dimensional Coordination Framework Tailored by Organic Polyamine Cation","Crystal Growth & Design","2011","11","9","3866","","10.1021/cg2004062","","x-ray","0.71073","MoKα","","0.0591","0.0382","","","0.0763","0.0836","","","","","","1.111","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500866","8.0583","0.0005","26.3886","0.0015","9.1939","0.0005","90","","90","","90","","1955.1","0.2","353","2","353","2","","","","","","","synthesis as described","4","C m c m","-C 2c 2","63","rp231_353","","","- C24 Co2 N20 W2 -","- C24 Co2 N20 W2 -","- C48 Co4 N40 W4 -","2","0.125","","Podgajny, Robert; Choraży, Szymon; Nitek, Wojciech; Budziak, Andrzej; Rams, Michał; Gómez-García, Carlos J.; Oszajca, Marcin; Łasocha, Wiesław; Sieklucka, Barbara","Humidity-Driven Reversible Transformation and Guest Inclusion in a Two-Dimensional Coordination Framework Tailored by Organic Polyamine Cation","Crystal Growth & Design","2011","11","9","3866","","10.1021/cg2004062","","x-ray","0.71073","MoKα","","0.0532","0.0466","","","0.1169","0.1205","","","","","","1.106","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500867","7.922","0.0005","26.552","0.0014","9.2897","0.0004","90","","90","","90","","1954.04","0.18","293","","293","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- C12 Co N10 W -","- C12 Co N10 W -","- C48 Co4 N40 W4 -","4","0.25","","Podgajny, Robert; Choraży, Szymon; Nitek, Wojciech; Budziak, Andrzej; Rams, Michał; Gómez-García, Carlos J.; Oszajca, Marcin; Łasocha, Wiesław; Sieklucka, Barbara","Humidity-Driven Reversible Transformation and Guest Inclusion in a Two-Dimensional Coordination Framework Tailored by Organic Polyamine Cation","Crystal Growth & Design","2011","11","9","3866","","10.1021/cg2004062","powder diffraction","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500868","18.903","0.007","19.534","0.006","12.847","0.003","90","","129.327","0.011","90","","3670","2","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Co2(OA)(dib)2(H2O)]","","- C20 H14 Co N4 O5 -","- C20 H14 Co N4 O5 -","- C160 H112 Co8 N32 O40 -","8","1","","Chu, Qian; Su, Zhi; Fan, Jian; Okamura, Taka-aki; Lv, Gao-Chao; Liu, Guang-Xiang; Sun, Wei-Yin; Ueyama, Norikazu","Novel Cobalt(II) Coordination Polymers Constructed from 3,3′,4,4′-Oxydiphthalic Acid and N-Donor Ligands: Syntheses, Crystal Structures, and Magnetic Properties","Crystal Growth & Design","2011","11","9","3885","","10.1021/cg200416y","","","0.71075","MoKα","","0.0479","0.0378","","","0.0882","0.0936","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500869","10.81","0.004","24.347","0.006","17.19","0.005","90","","122.205","0.012","90","","3828","2","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Co2(OA)(bbi)2]-3(H2O)","","- C36 H40 Co2 N8 O12 -","- C36 H36 Co2 N8 O12 -","- C144 H144 Co8 N32 O48 -","4","1","","Chu, Qian; Su, Zhi; Fan, Jian; Okamura, Taka-aki; Lv, Gao-Chao; Liu, Guang-Xiang; Sun, Wei-Yin; Ueyama, Norikazu","Novel Cobalt(II) Coordination Polymers Constructed from 3,3′,4,4′-Oxydiphthalic Acid and N-Donor Ligands: Syntheses, Crystal Structures, and Magnetic Properties","Crystal Growth & Design","2011","11","9","3885","","10.1021/cg200416y","","","0.71075","MoKα","","0.1041","0.0632","","","0.1274","0.1435","","","","","","1.033","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500870","13.503","0.002","8.3507","0.0012","25.517","0.004","90","","101.973","0.003","90","","2814.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H54 Co3 N4 O26 -","- C56 H50 Co3 N4 O26 -","- C112 H100 Co6 N8 O52 -","2","0.5","","Chu, Qian; Su, Zhi; Fan, Jian; Okamura, Taka-aki; Lv, Gao-Chao; Liu, Guang-Xiang; Sun, Wei-Yin; Ueyama, Norikazu","Novel Cobalt(II) Coordination Polymers Constructed from 3,3′,4,4′-Oxydiphthalic Acid and N-Donor Ligands: Syntheses, Crystal Structures, and Magnetic Properties","Crystal Growth & Design","2011","11","9","3885","","10.1021/cg200416y","","","0.71073","MoKα","","0.0895","0.0578","","","0.1122","0.1223","","","","","","1.001","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500871","11.3653","0.001","8.8027","0.0008","26.09","0.002","90","","102.322","0.002","90","","2550.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Co2(OA)(dpe)(H2O)2]","","- C28 H20 Co2 N2 O11 -","- C28 H20 Co2 N2 O11 -","- C112 H80 Co8 N8 O44 -","4","1","","Chu, Qian; Su, Zhi; Fan, Jian; Okamura, Taka-aki; Lv, Gao-Chao; Liu, Guang-Xiang; Sun, Wei-Yin; Ueyama, Norikazu","Novel Cobalt(II) Coordination Polymers Constructed from 3,3′,4,4′-Oxydiphthalic Acid and N-Donor Ligands: Syntheses, Crystal Structures, and Magnetic Properties","Crystal Growth & Design","2011","11","9","3885","","10.1021/cg200416y","","","0.71073","MoKα","","0.0575","0.0482","","","0.1163","0.1224","","","","","","1.003","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500872","6.574","0.006","12.213","0.007","31.326","0.009","90","","90","","90","","2515","3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H43 N3 O5 -","- C23 H43 N3 O5 -","- C92 H172 N12 O20 -","4","1","","André, Vânia; Cunha-Silva, Luís; Duarte, M. Teresa; Santos, Pedro Paulo","First Crystal Structures of the Antihypertensive Drug Perindopril Erbumine: A Novel Hydrated Form and Polymorphs α and β","Crystal Growth & Design","2011","11","9","3703","","10.1021/cg200430z","","","0.71069","MoKα","","0.1918","0.1526","","","0.3855","0.4119","","","","","","1.606","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500873","12.203","0.005","6.419","0.003","17.12","0.007","90","","97.065","0.011","90","","1330.8","1","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H43 N3 O5 -","- C23 H43 N3 O5 -","- C46 H86 N6 O10 -","2","1","","André, Vânia; Cunha-Silva, Luís; Duarte, M. Teresa; Santos, Pedro Paulo","First Crystal Structures of the Antihypertensive Drug Perindopril Erbumine: A Novel Hydrated Form and Polymorphs α and β","Crystal Growth & Design","2011","11","9","3703","","10.1021/cg200430z","","","0.71069","MoKα","","0.3277","0.1185","","","0.2664","0.3283","","","","","","0.861","","","","has coordinates","176810","2020-10-21","18:00:00",""
"4500874","6.578","0.003","12.104","0.005","16.729","0.007","97.92","0.15","94.76","0.16","91.32","0.16","1313.9","1.1","150","2","150","2","","","","","","","","4","P 1","P 1","1","","","","- C46 H86 N6 O12.5 -","- C46 H86 N6 O12.5 -","- C46 H86 N6 O12.5 -","1","1","","André, Vânia; Cunha-Silva, Luís; Duarte, M. Teresa; Santos, Pedro Paulo","First Crystal Structures of the Antihypertensive Drug Perindopril Erbumine: A Novel Hydrated Form and Polymorphs α and β","Crystal Growth & Design","2011","11","9","3703","","10.1021/cg200430z","","","0.71069","MoKα","","0.1259","0.0658","","","0.138","0.1581","","","","","","0.943","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500875","9.43","0.0008","9.43","0.0008","24.337","0.004","90","","90","","120","","1874.2","0.4","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","K0.6Mg0.6Mo3O12Sc1.4","","","- K0.6 Mg0.6 Mo3 O12 Sc1.4 -","- K0.6 Mg0.6 Mo3 O12 Sc1.4 -","- K3.6 Mg3.6 Mo18 O72 Sc8.4 -","6","0.166667","","Wang, Guojian; Huang, Yisheng; Zhang, Lizhen; Guo, Shengping; Xu, Gang; Lin, Zhoubin; Wang, Guofu","Growth, Structure, and Optical Properties of the Cr3+:K0.6(Mg0.3Sc0.7)2(MoO4)3Crystal","Crystal Growth & Design","2011","11","9","3895","","10.1021/cg200438p","","","0.71073","MoKα","","0.0156","0.015","","","0.0604","0.061","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500876","13.873","0.0014","13.873","0.0014","13.812","0.003","90","","90","","90","","2658.3","0.7","298","2","298","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C9 H9.5 Cd0.75 Na1.5 O9.25 -","- C9 H9.5 Cd0.75 Na1.5 O9.25 -","- C72 H76 Cd6 Na12 O74 -","8","1","","Fu, Ying; Su, Jie; Zou, Zhibo; Yang, Sihai; Li, Guobao; Liao, Fuhui; Lin, Jianhua","Syntheses, Structures, and Gas Adsorption Properties of Two Novel Cadmium‒Sodium Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands","Crystal Growth & Design","2011","11","8","3529","","10.1021/cg200443p","","","0.71073","MoKα","","0.0711","0.066","","","0.1961","0.2023","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500877","14.644","0.003","13.655","0.003","17.683","0.004","90","","111.63","0.03","90","","3287","1.4","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C29 H25 Cd3 N Na2 O22 -","- C29 H25 Cd3 N Na2 O22 -","- C116 H100 Cd12 N4 Na8 O88 -","4","1","","Fu, Ying; Su, Jie; Zou, Zhibo; Yang, Sihai; Li, Guobao; Liao, Fuhui; Lin, Jianhua","Syntheses, Structures, and Gas Adsorption Properties of Two Novel Cadmium‒Sodium Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands","Crystal Growth & Design","2011","11","8","3529","","10.1021/cg200443p","","","0.71073","MoKα","","0.043","0.0425","","","0.1616","0.1619","","","","","","1.005","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500878","13.7528","0.0011","10.7643","0.0009","18.0328","0.0014","90","","109.034","0.001","90","","2523.6","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 Mn N4 O2 S2 -","- C26 H18 Mn N4 O2 S2 -","- C104 H72 Mn4 N16 O8 S8 -","4","0.5","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0338","0.0312","","","0.0833","0.0853","","","","","","1.016","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4500879","8.148","0.006","13.341","0.009","13.685","0.009","62.342","0.011","87.107","0.013","82.933","0.013","1307.6","1.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H19 N4 Ni O2.5 S2 -","- C26 H18 N4 Ni O2.5 S2 -","- C52 H36 N8 Ni2 O5 S4 -","2","1","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.1448","0.1098","","","0.2355","0.2544","","","","","","1.222","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500880","8.999","0.002","10.75","0.003","13.169","0.003","90","","90.178","0.004","90","","1274","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 Cu N4 O2 S2 -","- C26 H18 Cu N4 O2 S2 -","- C52 H36 Cu2 N8 O4 S4 -","2","0.5","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0573","0.0376","","","0.1034","0.1225","","","","","","0.774","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500881","13.914","0.003","10.605","0.003","17.861","0.006","90","","108.927","0.007","90","","2493","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 N4 O2 S2 Zn -","- C26 H18 N4 O2 S2 Zn -","- C104 H72 N16 O8 S8 Zn4 -","4","0.5","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0319","0.0285","","","0.0919","0.0995","","","","","","0.956","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500882","8.6476","0.0002","12.7504","0.0003","15.8872","0.0004","90","","90","","90","","1751.73","0.07","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H9 Mn N7 O -","- C16 H9 Mn N7 O -","- C64 H36 Mn4 N28 O4 -","4","1","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0506","0.0353","","","0.0807","0.0879","","","","","","0.992","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4500883","8.4837","0.0002","12.7231","0.0002","15.5816","0.0003","90","","90","","90","","1681.86","0.06","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H9 Co N7 O -","- C16 H9 Co N7 O -","- C64 H36 Co4 N28 O4 -","4","1","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0302","0.0258","","","0.0582","0.0602","","","","","","1.048","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500884","8.3767","0.0012","12.9906","0.0018","15.469","0.002","90","","90","","90","","1683.3","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H9 Cu N7 O -","- C16 H9 Cu N7 O -","- C64 H36 Cu4 N28 O4 -","4","1","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0293","0.0271","","","0.064","0.0648","","","","","","1.039","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500885","8.4574","0.0011","12.7306","0.0017","15.689","0.002","90","","90","","90","","1689.2","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H9 N7 O Zn -","- C16 H9 N7 O Zn -","- C64 H36 N28 O4 Zn4 -","4","1","","Ghosh, Totan; Chattopadhyay, Tanmay; Das, Sudhanshu; Mondal, Sandip; Suresh, Eringathodi; Zangrando, Ennio; Das, Debasis","Thiocyanate and Dicyanamide Anion Controlled Nuclearity in Mn, Co, Ni, Cu, and Zn Metal Complexes with Hemilabile Ligand 2-Benzoylpyridine","Crystal Growth & Design","2011","11","7","3198","","10.1021/cg2004485","","","0.71073","MoKα","","0.0323","0.0288","","","0.0721","0.0735","","","","","","1.054","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500886","18.9358","0.0004","81.0567","0.0019","5.8548","0.0001","90","","90","","90","","8986.4","0.3","173","2","173","2","","","","","","","synthesis as described","5","F d d 2","F 2 -2d","43","","","","- C25 H36 Fe N2 O2 -","- C25 H36 Fe N2 O2 -","- C400 H576 Fe16 N32 O32 -","16","1","","Coles, Martyn P.; Stokes, Francesca A.; Kingsbury, Benjamin F. K.; Day, Benjamin M.; Hitchcock, Peter B.","Planar Chirality and Helical Polymers: Ferrocenyl-Substituted Amidinium‒Carboxylate Salts","Crystal Growth & Design","2011","11","7","3206","","10.1021/cg200451c","","x-ray","0.71073","MoKα","","0.0376","0.0319","","","0.0824","0.0925","","","","","","1.129","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500887","9.6024","0.0002","11.2793","0.0002","13.0451","0.0003","88.804","0.001","79.869","0.001","69.421","0.001","1300.82","0.05","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C28 H42 Fe N2 O2 -","- C28 H42 Fe N2 O2 -","- C56 H84 Fe2 N4 O4 -","2","1","","Coles, Martyn P.; Stokes, Francesca A.; Kingsbury, Benjamin F. K.; Day, Benjamin M.; Hitchcock, Peter B.","Planar Chirality and Helical Polymers: Ferrocenyl-Substituted Amidinium‒Carboxylate Salts","Crystal Growth & Design","2011","11","7","3206","","10.1021/cg200451c","","x-ray","0.71073","MoKα","","0.0458","0.0397","","","0.0987","0.1033","","","","","","0.995","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500888","12.1788","0.0004","10.3248","0.0003","21.0704","0.0007","90","","90.713","0.002","90","","2649.26","0.15","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H38 Fe N2 O2 -","- C30 H38 Fe N2 O2 -","- C120 H152 Fe4 N8 O8 -","4","1","","Coles, Martyn P.; Stokes, Francesca A.; Kingsbury, Benjamin F. K.; Day, Benjamin M.; Hitchcock, Peter B.","Planar Chirality and Helical Polymers: Ferrocenyl-Substituted Amidinium‒Carboxylate Salts","Crystal Growth & Design","2011","11","7","3206","","10.1021/cg200451c","","x-ray","0.71073","MoKα","","0.0725","0.0447","","","0.0899","0.1008","","","","","","1.024","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500889","23.8115","0.0008","10.25","0.0003","24.8877","0.0009","90","","98.17","0","90","","6012.6","0.3","173","2","173","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H44 Fe N2 O2 -","- C33 H44 Fe N2 O2 -","- C264 H352 Fe8 N16 O16 -","8","1","","Coles, Martyn P.; Stokes, Francesca A.; Kingsbury, Benjamin F. K.; Day, Benjamin M.; Hitchcock, Peter B.","Planar Chirality and Helical Polymers: Ferrocenyl-Substituted Amidinium‒Carboxylate Salts","Crystal Growth & Design","2011","11","7","3206","","10.1021/cg200451c","","x-ray","0.71073","MoKα","","0.0509","0.0391","","","0.0942","0.1015","","","","","","1.024","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500890","12.0543","0.0003","11.6052","0.0002","17.7228","0.0005","90","","90","","90","","2479.29","0.1","173","2","173","2","","","","","","","synthesis as described","6","P n a 21","P 2c -2n","33","","","","- C25 H33 F3 Fe N2 O2 -","- C25 H33 F3 Fe N2 O2 -","- C100 H132 F12 Fe4 N8 O8 -","4","1","","Coles, Martyn P.; Stokes, Francesca A.; Kingsbury, Benjamin F. K.; Day, Benjamin M.; Hitchcock, Peter B.","Planar Chirality and Helical Polymers: Ferrocenyl-Substituted Amidinium‒Carboxylate Salts","Crystal Growth & Design","2011","11","7","3206","","10.1021/cg200451c","","x-ray","0.71073","MoKα","","0.0465","0.0395","","","0.0967","0.1027","","","","","","0.848","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500891","15.6033","0.0002","15.6033","0.0002","8.8392","0.0001","90","","90","","120","","1863.7","0.04","298","2","293","2","","","","","","","see text","4","P 3 c 1","P 3 -2""c","158","","","","- Cd12.01 Na11.99 O90 S18 -","- Cd12.014 Na11.986 O90.006 S18 -","- Cd12.014 Na11.986 O90.006 S18 -","1","0.166667","","Saha, Dipankar; Madras, Giridhar; Guru Row, Tayur N.","Manipulation of the Hydration Levels in Minerals of Sodium Cadmium Bisulfate toward the Design of Functional Materials","Crystal Growth & Design","2011","11","7","3213","","10.1021/cg2004613","","","0.71073","MoKα","","0.0231","0.0213","","","0.053","0.0536","","","","","","1.039","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500892","5.5314","0.0002","8.4624","0.0003","11.3048","0.0004","90","","99.411","0.004","90","","522.04","0.03","298","2","298","2","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- Cd H8 Na2 O12 S2 -","- Cd H8 Na2 O12 S2 -","- Cd2 H16 Na4 O24 S4 -","2","0.5","","Saha, Dipankar; Madras, Giridhar; Guru Row, Tayur N.","Manipulation of the Hydration Levels in Minerals of Sodium Cadmium Bisulfate toward the Design of Functional Materials","Crystal Growth & Design","2011","11","7","3213","","10.1021/cg2004613","","","0.71073","MoKα","","0.021","0.018","","","0.043","0.0444","","","","","","1.069","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500893","5.9085","0.0003","13.0165","0.0005","5.5636","0.0002","90","","106.215","0.005","90","","410.86","0.03","293","2","298","2","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- Cd H4 Na2 O10 S2 -","- Cd H4 Na2 O10 S2 -","- Cd2 H8 Na4 O20 S4 -","2","0.5","","Saha, Dipankar; Madras, Giridhar; Guru Row, Tayur N.","Manipulation of the Hydration Levels in Minerals of Sodium Cadmium Bisulfate toward the Design of Functional Materials","Crystal Growth & Design","2011","11","7","3213","","10.1021/cg2004613","","","0.71073","MoKα","","0.0194","0.0189","","","0.0528","0.0532","","","","","","1.152","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500894","7.3067","0.0004","11.1954","0.0006","11.4438","0.0006","72.426","0.004","73.791","0.004","83.348","0.004","856.45","0.08","293","2","293","2","","","","","","","","6","P 1","P 1","1","catena-[(mu2-4,4^'^-bipyridyl)-(tri-aqua)-(sulfato-zinc(II))] [(mu2-4,4^'^-bipyridyl)-(di-aqua)-(di-sulfato-zinc(II))] [hexa-aqua-zinc(II)]","catena-[(mu2-4,4^'^-bipyridyl)-(tri-aqua)-(sulfato-zinc(II))] [(mu2-4,4^'^-bipyridyl)-(di-aqua)-(di-sulfato-zinc(II))] [hexa-aqua-zinc(II)]","","- C20 H38 N4 O23 S3 Zn3 -","- C20 H38 N4 O23 S3 Zn3 -","- C20 H38 N4 O23 S3 Zn3 -","1","1","","Croitor, Lilia; Coropceanu, Eduard B.; Siminel, Anatolii V.; Kravtsov, Victor Ch.; Fonari, Marina S.","Polymeric Zn(II) and Cd(II) Sulfates with Bipyridine and Dioxime Ligands: Supramolecular Isomerism, Chirality, and Luminescence","Crystal Growth & Design","2011","11","8","3536","","10.1021/cg200465f","","","0.71073","MoKα","","0.0271","0.0258","","","0.0613","0.0628","","","","","","1.009","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4500895","20.971","0.0011","9.2303","0.0005","11.4429","0.0008","90","","110.431","0.007","90","","2075.6","0.2","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","catena-{(mu2-4,4^'^-bipyridyl)-(1,2-cyclohexanedione dioxime)- (sulfato-zinc(II))} semihydrate dimethylformamide solvate","catena-{(mu2-4,4^'^-bipyridyl)-(1,2-cyclohexanedione dioxime)- (sulfato-zinc(II))} semihydrate dimethylformamide solvate","","- C35 H45 N9 O14 S2 Zn2 -","- C35 H38 N9 O14 S2 Zn2 -","- C70 H76 N18 O28 S4 Zn4 -","2","0.5","","Croitor, Lilia; Coropceanu, Eduard B.; Siminel, Anatolii V.; Kravtsov, Victor Ch.; Fonari, Marina S.","Polymeric Zn(II) and Cd(II) Sulfates with Bipyridine and Dioxime Ligands: Supramolecular Isomerism, Chirality, and Luminescence","Crystal Growth & Design","2011","11","8","3536","","10.1021/cg200465f","","","0.71073","MoKα","","0.0486","0.04","","","0.0693","0.0748","","","","","","1.026","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500896","9.8002","0.0008","9.3425","0.0009","23.47","0.004","90","","91.317","0.011","90","","2148.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(mu2-1,2-bis(4-pyridyl)-ethane)- (1,2-cyclohexanedione dioxime)-(sulfato-zinc(II))","(mu2-1,2-bis(4-pyridyl)-ethane)- (1,2-cyclohexanedione dioxime)-(sulfato-zinc(II))","","- C18 H22 N4 O6 S Zn -","- C18 H22 N4 O6 S Zn -","- C72 H88 N16 O24 S4 Zn4 -","4","1","","Croitor, Lilia; Coropceanu, Eduard B.; Siminel, Anatolii V.; Kravtsov, Victor Ch.; Fonari, Marina S.","Polymeric Zn(II) and Cd(II) Sulfates with Bipyridine and Dioxime Ligands: Supramolecular Isomerism, Chirality, and Luminescence","Crystal Growth & Design","2011","11","8","3536","","10.1021/cg200465f","","","0.71073","MoKα","","0.1237","0.0769","","","0.1692","0.1832","","","","","","0.972","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500897","9.5841","0.0003","10.0629","0.0003","23.0354","0.0009","90","","90","","90","","2221.62","0.13","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","catena-(mu2-1,2-bis(4-pyridyl)-ethane)- (1,2-cyclohexanedione dioxime)-(sulfato-cadmium(II))","catena-(mu2-1,2-bis(4-pyridyl)-ethane)- (1,2-cyclohexanedione dioxime)-(sulfato-cadmium(II))","","- C18 H22 Cd N4 O6 S -","- C18 H22 Cd N4 O6 S -","- C72 H88 Cd4 N16 O24 S4 -","4","1","","Croitor, Lilia; Coropceanu, Eduard B.; Siminel, Anatolii V.; Kravtsov, Victor Ch.; Fonari, Marina S.","Polymeric Zn(II) and Cd(II) Sulfates with Bipyridine and Dioxime Ligands: Supramolecular Isomerism, Chirality, and Luminescence","Crystal Growth & Design","2011","11","8","3536","","10.1021/cg200465f","","","0.71073","MoKα","","0.0669","0.0401","","","0.0637","0.0749","","","","","","0.991","","","","has coordinates,has disorder","179539","2020-10-21","18:00:00",""
"4500898","12.2897","0.0005","10.3757","0.0004","16.3811","0.0009","90","","125.598","0.003","90","","1698.47","0.15","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","methoxo-(4-methoxysalicylaldehyde-4-phenylthiosemicarbazonato(2-))- oxo-vanadium(V)","","- C16 H16 N3 O4 S V -","- C16 H16 N3 O4 S V -","- C64 H64 N12 O16 S4 V4 -","4","1","","Rubčić, Mirta; Milić, Dalibor; Pavlović, Gordana; Cindrić, Marina","Conformational Diversity of Thiosemicarbazonatovanadium(V) Complexes in the Solid State: From Polymorphism to Isostructurality","Crystal Growth & Design","2011","11","12","5227","","10.1021/cg200466b","","","0.71073","MoKα","","0.0694","0.0368","","","0.0757","0.0812","","","","","","0.886","","","","has coordinates","179539","2020-10-21","18:00:00",""
"4500899","7.2239","0.0011","9.693","0.002","13.592","0.003","87.323","0.018","86.732","0.015","71.447","0.017","900.4","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","ethoxo-(4-methoxysalicylaldehyde-4-phenylthiosemicarbazonato(2-))- oxo-vanadium(V)","","- C17 H18 N3 O4 S V -","- C17 H18 N3 O4 S V -","- C34 H36 N6 O8 S2 V2 -","2","1","","Rubčić, Mirta; Milić, Dalibor; Pavlović, Gordana; Cindrić, Marina","Conformational Diversity of Thiosemicarbazonatovanadium(V) Complexes in the Solid State: From Polymorphism to Isostructurality","Crystal Growth & Design","2011","11","12","5227","","10.1021/cg200466b","","","0.71073","MoKα","","0.1048","0.0534","","","0.1161","0.1303","","","","","","0.886","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500900","12.4255","0.0003","15.7746","0.0004","18.5559","0.0005","90","","96.51","0.002","90","","3613.64","0.16","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","ethoxo-(4-methoxysalicylaldehyde-4-phenylthiosemicarbazonato(2-))- oxo-vanadium(V)","","- C17 H18 N3 O4 S V -","- C17 H18 N3 O4 S V -","- C136 H144 N24 O32 S8 V8 -","8","2","","Rubčić, Mirta; Milić, Dalibor; Pavlović, Gordana; Cindrić, Marina","Conformational Diversity of Thiosemicarbazonatovanadium(V) Complexes in the Solid State: From Polymorphism to Isostructurality","Crystal Growth & Design","2011","11","12","5227","","10.1021/cg200466b","","","0.7107","MoKα","","0.0412","0.0279","","","0.0737","0.0765","","","","","","0.966","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500901","12.3684","0.0003","15.9862","0.0004","19.1848","0.0005","90","","97.975","0.002","90","","3756.6","0.16","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","propoxo-(4-methoxysalicylaldehyde-4-phenylthiosemicarbazonato(2-))- oxo-vanadium(V)","","- C18 H20 N3 O4 S V -","- C18 H20 N3 O4 S V -","- C144 H160 N24 O32 S8 V8 -","8","2","","Rubčić, Mirta; Milić, Dalibor; Pavlović, Gordana; Cindrić, Marina","Conformational Diversity of Thiosemicarbazonatovanadium(V) Complexes in the Solid State: From Polymorphism to Isostructurality","Crystal Growth & Design","2011","11","12","5227","","10.1021/cg200466b","","","0.71073","MoKα","","0.0405","0.0284","","","0.0743","0.0772","","","","","","1.059","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500902","9.7545","0.0011","12.9941","0.0014","30.452","0.003","88.183","0.008","80.838","0.009","89.875","0.009","3808.6","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","propoxo-(4-methoxysalicylaldehyde-4-phenylthiosemicarbazonato(2-))- oxo-vanadium(V)","","- C18 H20 N3 O4 S V -","- C18 H20 N3 O4 S V -","- C144 H160 N24 O32 S8 V8 -","8","4","","Rubčić, Mirta; Milić, Dalibor; Pavlović, Gordana; Cindrić, Marina","Conformational Diversity of Thiosemicarbazonatovanadium(V) Complexes in the Solid State: From Polymorphism to Isostructurality","Crystal Growth & Design","2011","11","12","5227","","10.1021/cg200466b","","","0.71073","MoKα","","0.1442","0.0827","","","0.195","0.2379","","","","","","0.985","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500903","9.528","0.0004","10.0721","0.0004","10.5449","0.0003","95.344","0.003","110.811","0.004","95.371","0.004","933.06","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","1-{2-[(2-Hydroxy-4-methoxy-benzylidene)-hydrazono]-4-methyl-3-phenyl- -2,3-dihydro-thiazol-5-yl}-ethanone","","- C20 H19 N3 O3 S -","- C20 H19 N3 O3 S -","- C40 H38 N6 O6 S2 -","2","1","","Rubčić, Mirta; Milić, Dalibor; Pavlović, Gordana; Cindrić, Marina","Conformational Diversity of Thiosemicarbazonatovanadium(V) Complexes in the Solid State: From Polymorphism to Isostructurality","Crystal Growth & Design","2011","11","12","5227","","10.1021/cg200466b","","","0.71073","MoKα","","0.0922","0.0508","","","0.1175","0.1393","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500904","27.6739","0.0015","13.1598","0.0006","8.6462","0.0004","90","","95.435","0.003","90","","3134.6","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Cu N2 O6 -","- C11 H13 Cu N2 O6 -","- C88 H104 Cu8 N16 O48 -","8","1","","Dey, Rajdip; Haldar, Ritesh; Maji, Tapas Kumar; Ghoshal, Debajyoti","Three-Dimensional Robust Porous Coordination Polymer with Schiff Base Site on the Pore Wall: Synthesis, Single-Crystal-to-Single-Crystal Reversibility, and Selective CO2Adsorption","Crystal Growth & Design","2011","11","9","3905","","10.1021/cg2004672","","","0.71073","MoKα","","0.0942","0.0503","","","0.1471","0.1877","","","","","","1.036","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500905","27.733","0.002","13.1588","0.0009","8.6333","0.0007","90","","95.217","0.006","90","","3137.5","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H11 Cu N2 O4 -","- C11 H11 Cu N2 O4 -","- C88 H88 Cu8 N16 O32 -","8","1","","Dey, Rajdip; Haldar, Ritesh; Maji, Tapas Kumar; Ghoshal, Debajyoti","Three-Dimensional Robust Porous Coordination Polymer with Schiff Base Site on the Pore Wall: Synthesis, Single-Crystal-to-Single-Crystal Reversibility, and Selective CO2Adsorption","Crystal Growth & Design","2011","11","9","3905","","10.1021/cg2004672","","","0.71073","MoKα","","0.1122","0.0811","","","0.2238","0.253","","","","","","1.067","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500906","27.633","0.005","13.153","0.005","8.641","0.005","90","","95.5","0.005","90","","3126","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Cu N2 O6 -","- C11 H13 Cu N2 O6 -","- C88 H104 Cu8 N16 O48 -","8","1","","Dey, Rajdip; Haldar, Ritesh; Maji, Tapas Kumar; Ghoshal, Debajyoti","Three-Dimensional Robust Porous Coordination Polymer with Schiff Base Site on the Pore Wall: Synthesis, Single-Crystal-to-Single-Crystal Reversibility, and Selective CO2Adsorption","Crystal Growth & Design","2011","11","9","3905","","10.1021/cg2004672","","","0.71073","MoKα","","0.1134","0.0613","","","0.1658","0.1908","","","","","","1.05","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500907","11.6252","0.0005","7.101","0.0003","13.7442","0.0005","90","","106.871","0.003","90","","1085.76","0.08","153","2","153","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- B11 Li6 O22 Rb5 -","- B11 Li6 O22 Rb5 -","- B22 Li12 O44 Rb10 -","2","0.5","","Yang, Yun; Pan, Shilie; Han, Jian; Hou, Xueling; Zhou, Zhongxiang; Zhao, Wenwu; Chen, Zhaohui; Zhang, Min","A New Lithium Rubidium Borate Li6Rb5B11O22with Isolated B11O22Building Blocks","Crystal Growth & Design","2011","11","9","3912","","10.1021/cg200471b","","","0.71073","MoKα","","0.0371","0.0326","","","0.0624","0.0642","","","","","","0.951","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500908","17.3726","0.0007","17.3726","0.0007","10.0243","0.0008","90","","90","","120","","2620.1","0.3","298","0.2","298","0.2","","","","","","","","5","P -6 2 c","P -6c -2c","190","","","","- C9 H3 N O9 Sr2 -","- C9 H3 N O9 Sr2 -","- C54 H18 N6 O54 Sr12 -","6","0.5","","Lee, Dong Woo; Jo, Vinna; Ok, Kang Min","Sr2[C6H3(CO2)3(NO3)]·DMF: One-Dimensional Nano-Channel in a New Non-Centrosymmetric Strontium‒Organic Framework with High Thermal Stability","Crystal Growth & Design","2011","11","7","2698","","10.1021/cg200503d","","","0.71073","MoKα","","0.0454","0.0419","","","0.1512","0.1523","","","","","","1.247","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500909","5.955","0.004","9.929","0.009","19.717","0.005","90","","95.841","0.005","90","","1159.8","1.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H13 Cu N3 O5 -","- C9 H13 Cu N3 O5 -","- C36 H52 Cu4 N12 O20 -","4","1","","Seth, Saikat Kumar; Saha, Indranil; Estarellas, Carolina; Frontera, Antonio; Kar, Tanusree; Mukhopadhyay, Subrata","Supramolecular Self-Assembly of M-IDA Complexes Involving Lone-Pair···π Interactions: Crystal Structures, Hirshfeld Surface Analysis, and DFT Calculations [H2IDA = iminodiacetic acid, M = Cu(II), Ni(II)]","Crystal Growth & Design","2011","11","7","3250","","10.1021/cg200506q","","","0.71073","MoKα","","0.0412","0.0376","","","0.0973","0.0995","","","","","","1.062","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500910","5.063","0.002","11.085","0.001","11.423","0.002","114.762","0.002","94.467","0.002","91.743","0.001","579","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H28 N6 Ni O10 -","- C18 H28 N6 Ni O10 -","- C18 H28 N6 Ni O10 -","1","0.5","","Seth, Saikat Kumar; Saha, Indranil; Estarellas, Carolina; Frontera, Antonio; Kar, Tanusree; Mukhopadhyay, Subrata","Supramolecular Self-Assembly of M-IDA Complexes Involving Lone-Pair···π Interactions: Crystal Structures, Hirshfeld Surface Analysis, and DFT Calculations [H2IDA = iminodiacetic acid, M = Cu(II), Ni(II)]","Crystal Growth & Design","2011","11","7","3250","","10.1021/cg200506q","","","0.71073","MoKα","","0.0836","0.0608","","","0.1587","0.1919","","","","","","1.216","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500911","12.396","0.009","13.007","0.008","14.582","0.009","63.911","0.018","89.96","0.03","79.954","0.019","2072","2","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 N2 Ni4 O32 -","- C24 H24 N2 Ni4 O32 -","- C48 H48 N4 Ni8 O64 -","2","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Han, Dong; Feng, Rui; Hong, Mao-Chun","Construction of 5-Aminodiacetic Isophthalate Based Nickel(II) Complexes with Diverse Topologies through Modulating the Auxiliary Ligands","Crystal Growth & Design","2011","11","7","3273","","10.1021/cg200511q","","","0.71073","MoKα","","0.1","0.0711","","","0.171","0.1966","","","","","","1.062","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500912","15.3745","0.001","20.4521","0.0014","18.0331","0.0013","90","","93.104","0.004","90","","5662","0.7","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H16 N3 Ni1.5 O14.5 -","- C22 H16 N3 Ni1.5 O14.5 -","- C176 H128 N24 Ni12 O116 -","8","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Han, Dong; Feng, Rui; Hong, Mao-Chun","Construction of 5-Aminodiacetic Isophthalate Based Nickel(II) Complexes with Diverse Topologies through Modulating the Auxiliary Ligands","Crystal Growth & Design","2011","11","7","3273","","10.1021/cg200511q","","","0.71073","MoKα","","0.0788","0.0661","","","0.1985","0.2117","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4500913","12.4225","0.0004","12.9981","0.0002","14.779","0.0001","64.384","0.008","80.885","0.012","79.562","0.012","2107.54","0.18","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C29 H44 N3 Ni4 O30 -","- C29 H44 N3 Ni4 O30 -","- C58 H88 N6 Ni8 O60 -","2","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Han, Dong; Feng, Rui; Hong, Mao-Chun","Construction of 5-Aminodiacetic Isophthalate Based Nickel(II) Complexes with Diverse Topologies through Modulating the Auxiliary Ligands","Crystal Growth & Design","2011","11","7","3273","","10.1021/cg200511q","","","0.71073","MoKα","","0.0529","0.0452","","","0.1176","0.128","","","","","","1.069","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500914","17.6574","0.0004","17.6574","0.0004","18.6518","0.0009","90","","90","","90","","5815.3","0.3","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C25 H21 N3 Ni2 O10.5 -","- C25 H21 N3 Ni2 O10.5 -","- C200 H168 N24 Ni16 O84 -","8","1","","Ma, Jie; Jiang, Fei-Long; Chen, Lian; Wu, Ming-Yan; Zhang, Shu-Quan; Han, Dong; Feng, Rui; Hong, Mao-Chun","Construction of 5-Aminodiacetic Isophthalate Based Nickel(II) Complexes with Diverse Topologies through Modulating the Auxiliary Ligands","Crystal Growth & Design","2011","11","7","3273","","10.1021/cg200511q","","","0.71073","MoKα","","0.051","0.0471","","","0.1336","0.1402","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500915","12.1207","0.0006","18.8019","0.0009","13.2832","0.0007","90","","91.632","0.001","90","","3025.9","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","1","","","- C24 H34 N10 Na O7 S0.5 -","- C24 H34 N10 Na O7 S0.5 -","- C96 H136 N40 Na4 O28 S2 -","4","1","","Rajbanshi, Arbin; Moyer, Bruce A.; Custelcean, Radu","Sulfate Separation from Aqueous Alkaline Solutions by Selective Crystallization of Alkali Metal Coordination Capsules","Crystal Growth & Design","2011","11","7","2702","","10.1021/cg200515w","","","0.71073","MoKα","","0.0678","0.0513","","","0.1153","0.1248","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500916","11.9118","0.0007","18.5604","0.0011","12.836","0.0007","90","","91.64","0.001","90","","2836.7","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","2","","","- C24 H32 K N10 O6 S0.5 -","- C24 H32 K N10 O6 S0.5 -","- C96 H128 K4 N40 O24 S2 -","4","1","","Rajbanshi, Arbin; Moyer, Bruce A.; Custelcean, Radu","Sulfate Separation from Aqueous Alkaline Solutions by Selective Crystallization of Alkali Metal Coordination Capsules","Crystal Growth & Design","2011","11","7","2702","","10.1021/cg200515w","","","0.71073","MoKα","","0.0688","0.0471","","","0.1086","0.1198","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500917","8.4436","0.0005","12.2377","0.0008","13.6622","0.0008","95.355","0.001","100.076","0.001","105.052","0.001","1327.89","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","L1-2H2O","","","- C24 H34 N10 O5 -","- C24 H34 N10 O5 -","- C48 H68 N20 O10 -","2","1","","Rajbanshi, Arbin; Moyer, Bruce A.; Custelcean, Radu","Sulfate Separation from Aqueous Alkaline Solutions by Selective Crystallization of Alkali Metal Coordination Capsules","Crystal Growth & Design","2011","11","7","2702","","10.1021/cg200515w","","","0.71073","MoKα","","0.0855","0.0625","","","0.1286","0.1421","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500918","12.1305","0.0004","12.3277","0.0003","15.7747","0.0005","90","","106.318","0.004","90","","2263.94","0.13","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H46 Br8 N6 O4 -","- C38 H46 Br8 N6 O4 -","- C76 H92 Br16 N12 O8 -","2","0.5","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Supramolecular Organic Frameworks of Brominated Bisphenol Derivatives with Organoamines","Crystal Growth & Design","2011","11","8","3551","","10.1021/cg200520w","","","0.71073","MoKα","","0.1522","0.0416","","","0.0595","0.067","","","","","","0.858","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500919","12.557","0.004","19.349","0.005","8.173","0.003","90","","97.837","0.004","90","","1967.2","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 Br8 N2 O8 -","- C32 H38 Br8 N2 O8 -","- C64 H76 Br16 N4 O16 -","2","0.5","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Supramolecular Organic Frameworks of Brominated Bisphenol Derivatives with Organoamines","Crystal Growth & Design","2011","11","8","3551","","10.1021/cg200520w","","","0.71073","MoKα","","0.0515","0.0425","","","0.0973","0.1023","","","","","","1.095","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500920","13.9298","0.0005","15.3719","0.0005","17.7673","0.0008","90","","105.553","0.004","90","","3665.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 Br8 N2 O5 -","- C32 H30 Br8 N2 O5 -","- C128 H120 Br32 N8 O20 -","4","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Supramolecular Organic Frameworks of Brominated Bisphenol Derivatives with Organoamines","Crystal Growth & Design","2011","11","8","3551","","10.1021/cg200520w","","","0.71073","MoKα","","0.109","0.0323","","","0.0689","0.091","","","","","","0.574","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500921","8.0454","0.0003","11.2431","0.0006","12.4087","0.0007","99.128","0.004","104.349","0.004","91.335","0.004","1071.34","0.1","571","2","571","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 Br4 N4 O2 -","- C19 H20 Br4 N4 O2 -","- C38 H40 Br8 N8 O4 -","2","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Supramolecular Organic Frameworks of Brominated Bisphenol Derivatives with Organoamines","Crystal Growth & Design","2011","11","8","3551","","10.1021/cg200520w","","","0.71073","MoKα","","0.0685","0.0364","","","0.0698","0.0738","","","","","","0.902","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500922","7.3315","0.0004","11.6404","0.0008","14.9647","0.0011","103.659","0.006","102.636","0.005","90.701","0.005","1208.18","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H24 Br4 N4 O2 -","- C21 H24 Br4 N4 O2 -","- C42 H48 Br8 N8 O4 -","2","1","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Supramolecular Organic Frameworks of Brominated Bisphenol Derivatives with Organoamines","Crystal Growth & Design","2011","11","8","3551","","10.1021/cg200520w","","","0.71073","MoKα","","0.1041","0.0452","","","0.0958","0.1054","","","","","","0.908","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500923","13.575","0.0019","16.7167","0.0019","18.585","0.003","64.667","0.004","81.375","0.006","72.956","0.006","3643","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H24.667 Br4 N4 O2.333 -","- C21 H24.6667 Br4 N4 O2.33333 -","- C126 H148 Br24 N24 O14 -","6","3","","Lü, Jian; Han, Li-Wei; Lin, Jing-Xiang; Cao, Rong","Supramolecular Organic Frameworks of Brominated Bisphenol Derivatives with Organoamines","Crystal Growth & Design","2011","11","8","3551","3557","10.1021/cg200520w","","","0.71073","MoKα","","0.0653","0.0397","","","0.0774","0.084","","","","","","0.809","","","","has coordinates","211064","2020-10-21","18:00:00",""
"4500924","10.3963","0.0016","13.3282","0.0019","13.693","0.004","65.698","0.018","78.834","0.018","71.073","0.013","1631.7","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H58 Ag4 N30 O8 -","- C60 H58 Ag4 N30 O8 -","- C60 H58 Ag4 N30 O8 -","1","0.5","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0329","0.0288","","","0.0834","0.0982","","","","","","1.176","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500925","10.553","0.002","13.529","0.003","14.104","0.003","107.6","0.03","104.36","0.03","110.89","0.03","1643.9","1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H58 Ag4 N30 O8 -","- C62 H58 Ag4 N30 O8 -","- C62 H58 Ag4 N30 O8 -","1","0.5","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0403","0.0288","","","0.068","0.0918","","","","","","0.907","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500926","12.864","0.003","14.555","0.003","11.752","0.002","90","","90","","90","","2200.4","0.8","173","2","173","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C22 H20 Ag N10 O2 -","- C22 H20 Ag N10 O2 -","- C88 H80 Ag4 N40 O8 -","4","0.5","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.1057","0.0841","","","0.2323","0.2595","","","","","","1.161","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500927","8.95","0.0018","9.3917","0.0019","10.029","0.002","71.54","0.03","68.88","0.03","74.74","0.03","735.2","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H17 Ag N5 O3 -","- C13 H17 Ag N5 O3 -","- C26 H34 Ag2 N10 O6 -","2","1","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0399","0.0299","","","0.0771","0.1091","","","","","","1.133","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500928","20.9002","0.0009","7.5329","0.0003","19.6558","0.0007","90","","96.561","0.001","90","","3074.3","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H15 Ag N5 O3 -","- C14 H15 Ag N5 O3 -","- C112 H120 Ag8 N40 O24 -","8","1","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0337","0.0293","","","0.0782","0.082","","","","","","0.843","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500929","21.698","0.004","7.4193","0.0015","19.443","0.004","90","","101.59","0.03","90","","3066.2","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H11 Ag N5 O4 -","- C12 H10.5 Ag N5 O4 -","- C96 H84 Ag8 N40 O32 -","8","1","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0411","0.0378","","","0.1203","0.1415","","","","","","1.101","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500930","13.387","0.0014","32.4616","0.0016","10.381","0.002","90","0.002","118.94","0.002","90","0.002","3947.9","0.9","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C35 H31 Ag2 N15 O13 -","- C35 H31 Ag2 N15 O13 -","- C140 H124 Ag8 N60 O52 -","4","1","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0277","0.0275","","","0.0701","0.0703","","","","","","0.979","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500931","9.6559","0.0007","11.2106","0.0009","12.0882","0.001","81.934","0.002","81.997","0.002","77.019","0.0019","1254.58","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H21 Ag2 N10 O5 -","- C23 H21 Ag2 N10 O5 -","- C46 H42 Ag4 N20 O10 -","2","1","","Hao, Hong-Jun; Sun, Di; Li, Yun-Hua; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Effect of Different Carboxylates on a Series of Ag(I) Coordination Compounds with Benzoguanamine Ligand","Crystal Growth & Design","2011","11","8","3564","","10.1021/cg200534x","","","0.71073","MoKα","","0.0789","0.0502","","","0.1295","0.1736","","","","","","1.153","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500932","26.9173","0.0003","22.13","0.0002","11.3881","0.0001","90","","90","","90","","6783.66","0.11","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C36 H58 N29 Na3 O43 U2 -","- C36 H56 N29 Na3 O43 U2 -","- C144 H224 N116 Na12 O172 U8 -","4","0.5","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.0512","0.0339","","","0.0971","0.1033","","","","","","1.053","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500933","12.549","0.0004","16.2908","0.001","21.7839","0.0013","98.551","0.002","105.403","0.003","102.939","0.003","4080.4","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C39.5 H71.5 N24 Na1.5 O52 U6 -","- C39.5 H45.5 N24 Na1.5 O52 U6 -","- C79 H91 N48 Na3 O104 U12 -","2","1","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.0714","0.0569","","","0.1557","0.1625","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500934","27.3529","0.0013","27.3529","0.0013","12.2825","0.0005","90","","90","","120","","7958.4","0.6","150","2","150","2","","","","","","","","6","P -3","-P 3","147","","","","- C120 H153 K3 N75 O64.5 U3 -","- C120 H147 K3 N75 O64.5 U3 -","- C240 H294 K6 N150 O129 U6 -","2","0.333333","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.0606","0.0462","","","0.1161","0.1221","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500935","13.4555","0.0002","15.234","0.0002","17.7989","0.0003","69.0525","0.0005","89.3447","0.0005","88.9214","0.0011","3406.66","0.09","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H112 Cs4 N56 O84 U6 -","- C72 H100 Cs4 N56 O84 U6 -","- C72 H100 Cs4 N56 O84 U6 -","1","0.5","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.0519","0.0464","","","0.1356","0.1396","","","","","","1.032","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500936","15.1238","0.0002","21.4542","0.0005","26.8055","0.0006","90","","90","","90","","8697.6","0.3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C48 H92 N25 Na3 O60 S4 U2 -","- C48 H86 N25 Na3 O60 S4 U2 -","- C192 H344 N100 Na12 O240 S16 U8 -","4","1","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.0415","0.0327","","","0.0714","0.0736","","","","","","1.032","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500937","15.4467","0.0005","15.8288","0.0003","16.1585","0.0005","90","","113.284","0.002","90","","3629.03","0.18","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H66 N24 Na2 O44 S4 U2 -","- C48 H66 N24 Na2 O44 S4 U2 -","- C96 H132 N48 Na4 O88 S8 U4 -","2","0.5","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.038","0.0262","","","0.0607","0.0636","","","","","","0.995","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500938","15.4882","0.0004","16.1531","0.0005","16.2434","0.0004","90","","113.876","0.002","90","","3716.05","0.18","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H66 K2 N24 O44 S4 U2 -","- C48 H66 K2 N24 O44 S4 U2 -","- C96 H132 K4 N48 O88 S8 U4 -","2","0.5","","Thuéry, Pierre","Uranyl‒Alkali Metal Ion Heterometallic Complexes with Cucurbit[6]uril and a Sulfonated Catechol","Crystal Growth & Design","2011","11","7","3282","","10.1021/cg2005375","","","0.71073","MoKα","","0.0332","0.0245","","","0.0603","0.0624","","","","","","1.049","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500939","24.7397","0.0002","7.5123","0.0001","14.976","0.0002","90","","90.949","0.001","90","","2782.94","0.06","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-amino-4,6-dimethylpyrimidine-2-methylbenzoic acid","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C112 H136 N24 O16 -","8","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.1213","0.056","","","0.1484","0.1779","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500940","26.9424","0.0012","7.3192","0.0003","14.3603","0.0006","90","","92.473","0.004","90","","2829.2","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-amino-4,6-dimethylpyrimidine-3-methylbenzoic acid","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C112 H136 N24 O16 -","8","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.1035","0.0598","","","0.1814","0.2134","","","","","","1.055","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500941","26.6684","0.0004","7.3762","0.0001","14.249","0.0002","90","","99.869","0.002","90","","2761.46","0.07","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-amino-4-chloro-6-methylpyrimidine-4-chlorobenzoic acid","","- C12 H11 Cl2 N3 O2 -","- C12 H11 Cl2 N3 O2 -","- C96 H88 Cl16 N24 O16 -","8","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0926","0.0484","","","0.1283","0.1522","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500942","26.502","0.0004","7.4361","0.0001","14.3922","0.0002","90","","98.915","0.001","90","","2802.03","0.07","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-amino-4,6-dimethylpyrimidine-4-chlorobenzoic acid","","- C13 H14 Cl N3 O2 -","- C13 H14 Cl N3 O2 -","- C104 H112 Cl8 N24 O16 -","8","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0637","0.0471","","","0.133","0.1473","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500943","7.5335","0.0013","8.1173","0.0012","21.321","0.002","90","","103.213","0.006","90","","1269.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidine-benzoic acid","","- C12 H12 Cl N3 O2 -","- C12 H12 Cl N3 O2 -","- C48 H48 Cl4 N12 O8 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0688","0.0482","","","0.1481","0.1668","","","","","","1.088","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500944","7.526","0.005","8.809","0.005","21.362","0.005","90","","102.732","0.015","90","","1381.4","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidine-3-methylbenzoic acid","","- C13 H14 Cl N3 O2 -","- C13 H14 Cl N3 O2 -","- C52 H56 Cl4 N12 O8 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.1208","0.0613","","","0.1443","0.1741","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500945","7.851","0.0001","24.191","0.0004","8.3116","0.0001","90","","120.591","0.001","90","","1358.87","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4,6-dimethylpyrimidine-2-chlorobenzoic acid","","- C13 H14 Cl N3 O2 -","- C13 H14 Cl N3 O2 -","- C52 H56 Cl4 N12 O8 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0785","0.0481","","","0.1295","0.1467","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500946","7.7594","0.0003","24.3335","0.0007","8.2817","0.0003","90","","120.61","0.003","90","","1345.8","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidine-2-chlorobenzoic acid","","- C12 H11 Cl2 N3 O2 -","- C12 H11 Cl2 N3 O2 -","- C48 H44 Cl8 N12 O8 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0883","0.0509","","","0.1333","0.1535","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500947","7.9118","0.0001","24.0539","0.0004","8.2112","0.0001","90","","119.926","0.001","90","","1354.32","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidine-2-methylbenzoic acid","","- C13 H14 Cl N3 O2 -","- C13 H14 Cl N3 O2 -","- C52 H56 Cl4 N12 O8 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0719","0.0486","","","0.1409","0.156","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500948","6.8705","0.0012","7.4812","0.0014","13.716","0.002","81.763","0.009","80.563","0.009","84.009","0.009","685.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4,6-dimethylpyrimidine-4-nitrobenzoic acid","","- C13 H14 N4 O4 -","- C13 H14 N4 O4 -","- C26 H28 N8 O8 -","2","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0676","0.047","","","0.1256","0.1385","","","","","","1.056","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500949","6.9797","0.0004","7.3469","0.0004","13.7131","0.0007","80.291","0.003","78.448","0.003","85.491","0.003","678.35","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-amino-4-chloro-6-methylpyrimidine-4-nitrobenzoic acid","","- C12 H11 Cl N4 O4 -","- C12 H11 Cl N4 O4 -","- C24 H22 Cl2 N8 O8 -","2","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0706","0.0514","","","0.1422","0.16","","","","","","1.066","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500950","6.9651","0.0001","7.5279","0.0002","13.2985","0.0003","94.254","0.001","92.751","0.001","98.482","0.001","686.52","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4,6-dimethylpyrimidine-3-nitrobenzoic acid","","- C13 H14 N4 O4 -","- C13 H14 N4 O4 -","- C26 H28 N8 O8 -","2","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0657","0.05","","","0.1496","0.1666","","","","","","1.071","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500951","11.1623","0.0005","7.4613","0.0003","17.0269","0.0008","90","","93.404","0.003","90","","1415.59","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidinephthalic acid","","- C13 H12 Cl N3 O4 -","- C13 H12 Cl N3 O4 -","- C52 H48 Cl4 N12 O16 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0764","0.0547","","","0.1463","0.1648","","","","","","1.042","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500952","6.0521","0.0012","7.965","0.0016","30.415","0.005","90","","97.137","0.011","90","","1454.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidinecinnamic acid","","- C14 H14 Cl N3 O2 -","- C14 H14 Cl N3 O2 -","- C56 H56 Cl4 N12 O8 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0897","0.0517","","","0.1662","0.1991","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500953","9.8924","0.0003","15.0036","0.0004","11.3404","0.0004","90","","121.196","0.002","90","","1439.78","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-4-chloro-6-methylpyrimidine-3-nitrobenzoic acid","","- C12 H11 Cl N4 O4 -","- C12 H11 Cl N4 O4 -","- C48 H44 Cl4 N16 O16 -","4","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0567","0.0426","","","0.1216","0.1363","","","","","","1.054","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500954","7.5499","0.0001","8.9221","0.0001","11.1715","0.0002","104.4","0.001","99.632","0.001","94.909","0.001","712.204","0.018","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-amino-4-chloro-6-methylpyrimidine-anisic acid","","- C13 H14 Cl N3 O3 -","- C13 H14 Cl N3 O3 -","- C26 H28 Cl2 N6 O6 -","2","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.0902","0.0486","","","0.1445","0.1737","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500955","8.6811","0.0001","11.5513","0.0002","11.5896","0.0002","87.227","0.001","77.166","0.001","81.834","0.001","1121.49","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4,6-dimethylpyrimidine-cinnamic acid (1/2)","","- C24 H25 N3 O4 -","- C24 H25 N3 O4 -","- C48 H50 N6 O8 -","2","1","","Ebenezer, Samuel; Muthiah, P. Thomas; Butcher, Ray J.","Design of a Series of Isostructural Co-Crystals with Aminopyrimidines: Isostructurality through Chloro/Methyl Exchange and Studies on Supramolecular Architectures","Crystal Growth & Design","2011","11","8","3579","","10.1021/cg200539a","","","0.71073","MoKα","","0.1042","0.0492","","","0.127","0.1525","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500956","7.094","0.0008","7.6307","0.0008","10.9005","0.0012","70.738","0.002","83.647","0.002","65.339","0.002","505.98","0.1","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C4 H8 O2 -","- C4 H8 O2 -","- C16 H32 O8 -","4","2","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0372","0.0349","","","0.0759","0.0772","","","","","","1.002","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500957","20.9055","0.0009","13.4391","0.0006","9.3136","0.0004","90","","90","","90","","2616.7","0.2","100","2","100","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C5 H10 O3 -","- C5 H10 O3 -","- C80 H160 O48 -","16","4","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0282","0.0245","","","0.0566","0.0584","","","","","","1.046","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500958","13.787","0.003","5.9735","0.0011","16.925","0.003","90","","90","","90","","1393.9","0.5","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C8 H8 O2 -","- C8 H8 O2 -","- C64 H64 O16 -","8","1","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0446","0.0379","","","0.0849","0.0894","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500959","5.8124","0.0004","7.532","0.0005","16.655","0.0011","90","","90","","90","","729.14","0.08","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C8 H8 O2 -","- C8 H8 O2 -","- C32 H32 O8 -","4","1","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0272","0.0264","","","0.064","0.0647","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500960","7.2","0.004","10.03","0.005","11.485","0.006","69.285","0.007","88.979","0.008","72.307","0.007","735.3","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H8 Cl2 F4 Hg2 O2 -","- C10 H8 Cl2 F4 Hg2 O2 -","- C20 H16 Cl4 F8 Hg4 O4 -","2","1","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0416","0.0335","","","0.075","0.0768","","","","","","1.001","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500961","20.4533","0.0013","7.3948","0.0005","26.5695","0.0018","90","","91.684","0.001","90","","4016.8","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H10 Cl4 F8 Hg4 O3 -","- C17 H10 Cl4 F8 Hg4 O3 -","- C102 H60 Cl24 F48 Hg24 O18 -","6","1.5","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0621","0.0416","","","0.0867","0.0947","","","","","","1.033","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500962","16.4902","0.0018","15.8412","0.0017","6.7903","0.0007","90","","111.642","0.001","90","","1648.8","0.3","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C14 H8 Cl2 F4 Hg2 O2 -","- C14 H8 Cl2 F4 Hg2 O2 -","- C56 H32 Cl8 F16 Hg8 O8 -","4","1","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.0291","0.0261","","","0.0558","0.0571","","","","","","1.026","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500963","7.024","0.005","7.837","0.005","31.1","0.02","88.446","0.007","88.373","0.006","89.507","0.007","1711","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H8 Cl2 F4 Hg2 O2 -","- C14 H8 Cl2 F4 Hg2 O2 -","- C56 H32 Cl8 F16 Hg8 O8 -","4","2","","Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V.","Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters","Crystal Growth & Design","2011","11","9","3964","","10.1021/cg200547k","","","0.71073","MoKα","","0.1586","0.1385","","","0.3005","0.3109","","","","","","1.054","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500964","15.775","0.005","9.796","0.002","20.695","0.005","90","","94.896","0.011","90","","3186.4","1.4","223.1","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C42 H31 O4 -","- C42 H31 O4 -","- C168 H124 O16 -","4","1","","Kasugai, Kenta; Hashimoto, Suzumi; Imai, Kazunori; Sakon, Aya; Fujii, Kotaro; Uekusa, Hidehiro; Hayashi, Naoto; Kobayashi, Keiji","Supramolecular Networks in Crystalline Inclusion Complexes Formed from a New Host: 2,2-Bis(4-hydroxy-3-phenylphenyl)-1H-indene-1,3(2H)-dione","Crystal Growth & Design","2011","11","9","4044","","10.1021/cg200554f","","","0.71075","MoKα","","","0.0431","","","","0.0107","","","","","","0.943","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500965","9.3881","0.0019","26.515","0.006","11.103","0.003","90","","97.768","0.01","90","","2738.5","1.1","223.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C34 H24 Cl2 O4 -","- C34 H24 Cl2 O4 -","- C136 H96 Cl8 O16 -","4","2","","Kasugai, Kenta; Hashimoto, Suzumi; Imai, Kazunori; Sakon, Aya; Fujii, Kotaro; Uekusa, Hidehiro; Hayashi, Naoto; Kobayashi, Keiji","Supramolecular Networks in Crystalline Inclusion Complexes Formed from a New Host: 2,2-Bis(4-hydroxy-3-phenylphenyl)-1H-indene-1,3(2H)-dione","Crystal Growth & Design","2011","11","9","4044","","10.1021/cg200554f","","","0.71075","MoKα","","","0.0604","","","","0.0985","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500966","9.343","0.004","11.137","0.006","14.234","0.006","112.231","0.018","96.642","0.014","98.164","0.019","1333.7","1.1","223.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C35 H28 O5 -","- C35 H28 O5 -","- C70 H56 O10 -","2","1","","Kasugai, Kenta; Hashimoto, Suzumi; Imai, Kazunori; Sakon, Aya; Fujii, Kotaro; Uekusa, Hidehiro; Hayashi, Naoto; Kobayashi, Keiji","Supramolecular Networks in Crystalline Inclusion Complexes Formed from a New Host: 2,2-Bis(4-hydroxy-3-phenylphenyl)-1H-indene-1,3(2H)-dione","Crystal Growth & Design","2011","11","9","4044","","10.1021/cg200554f","","","0.71075","MoKα","","","0.0658","","","","0.2158","","","","","","1.002","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500967","21.60117","0.00018","12.83936","0.00012","8.86864","0.00006","90","","90","","90","","2459.67","0.04","","","293","","","","101.3","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C33 H22 O4 -","- C33 H22 O4 -","- C132 H88 O16 -","4","1","","Kasugai, Kenta; Hashimoto, Suzumi; Imai, Kazunori; Sakon, Aya; Fujii, Kotaro; Uekusa, Hidehiro; Hayashi, Naoto; Kobayashi, Keiji","Supramolecular Networks in Crystalline Inclusion Complexes Formed from a New Host: 2,2-Bis(4-hydroxy-3-phenylphenyl)-1H-indene-1,3(2H)-dione","Crystal Growth & Design","2011","11","9","4044","","10.1021/cg200554f","powder diffraction","x-ray","1.1961","synchrotron","","","","","","","","0.05861","","1.78","","","","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500968","10.846","0.002","13.732","0.003","14.625","0.003","63.47","0.03","86.17","0.03","70.77","0.03","1831.8","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H60 N14 O20 Pr2 S4 -","- C66 H60 N14 O20 Pr2 S4 -","- C66 H60 N14 O20 Pr2 S4 -","1","0.5","","Lu, Huijie; Zhu, Yanyan; Chen, Nan; Gao, Yongchao; Guo, Xiaofang; Li, Gang; Tang, Mingsheng","Ligand-Directed Assembly of a Series of Complexes Bearing Thiourea-Based Carboxylates","Crystal Growth & Design","2011","11","12","5241","","10.1021/cg200564d","","","0.71073","MoKα","","0.0514","0.0426","","","0.0932","0.1101","","","","","","1.123","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500969","11.081","0.002","13.384","0.003","14.003","0.003","64.73","0.03","77.09","0.03","79.67","0.03","1822.2","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C65 H56 N14 Nd2 O19 S4 -","- C65 H56 N14 Nd2 O19 S4 -","- C65 H56 N14 Nd2 O19 S4 -","1","0.5","","Lu, Huijie; Zhu, Yanyan; Chen, Nan; Gao, Yongchao; Guo, Xiaofang; Li, Gang; Tang, Mingsheng","Ligand-Directed Assembly of a Series of Complexes Bearing Thiourea-Based Carboxylates","Crystal Growth & Design","2011","11","12","5241","","10.1021/cg200564d","","","0.71073","MoKα","","0.0659","0.0537","","","0.1455","0.1643","","","","","","1.022","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500970","10.865","0.002","13.541","0.003","14.535","0.003","63.62","0.03","86.44","0.03","70.7","0.03","1799","0.9","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H60 Ho2 N14 O20 S4 -","- C66 H60 Ho2 N14 O20 S4 -","- C66 H60 Ho2 N14 O20 S4 -","1","0.5","","Lu, Huijie; Zhu, Yanyan; Chen, Nan; Gao, Yongchao; Guo, Xiaofang; Li, Gang; Tang, Mingsheng","Ligand-Directed Assembly of a Series of Complexes Bearing Thiourea-Based Carboxylates","Crystal Growth & Design","2011","11","12","5241","","10.1021/cg200564d","","","0.71073","MoKα","","0.0409","0.0315","","","0.0642","0.0674","","","","","","1.005","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500971","14.868","0.006","16.93","0.007","22.725","0.01","90","","99.218","0.005","90","","5646","4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H64 Cu12 N12 O28 S6 -","- C66 H54 Cu12 N12 O28 S6 -","- C132 H108 Cu24 N24 O56 S12 -","2","0.5","","Lu, Huijie; Zhu, Yanyan; Chen, Nan; Gao, Yongchao; Guo, Xiaofang; Li, Gang; Tang, Mingsheng","Ligand-Directed Assembly of a Series of Complexes Bearing Thiourea-Based Carboxylates","Crystal Growth & Design","2011","11","12","5241","","10.1021/cg200564d","","","0.71073","MoKα","","0.1577","0.0713","","","0.1736","0.1905","","","","","","1.024","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500972","11.199","0.0007","11.199","0.0007","26.231","0.004","90","","90","","120","","2849.1","0.5","296","2","296","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C34 H34 Cu3 N4 O10 S2 -","- C34 H34 Cu3 N4 O10 S2 -","- C102 H102 Cu9 N12 O30 S6 -","3","0.5","","Lu, Huijie; Zhu, Yanyan; Chen, Nan; Gao, Yongchao; Guo, Xiaofang; Li, Gang; Tang, Mingsheng","Ligand-Directed Assembly of a Series of Complexes Bearing Thiourea-Based Carboxylates","Crystal Growth & Design","2011","11","12","5241","","10.1021/cg200564d","","","0.71073","MoKα","","0.0369","0.028","","","0.0414","0.0426","","","","","","1.061","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500973","7.7286","0.0004","10.0328","0.0006","13.4998","0.0008","90","","90","","90","","1046.77","0.1","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H12 Ag N4 O4 P -","- C6 H12 Ag N4 O4 P -","- C24 H48 Ag4 N16 O16 P4 -","4","1","","Kirillov, Alexander M.; Wieczorek, Sabina W.; Lis, Agnieszka; Guedes da Silva, M. Fátima C.; Florek, Magdalena; Król, Jarosław; Staroniewicz, Zdzisław; Smoleński, Piotr; Pombeiro, Armando J. L.","1,3,5-Triaza-7-phosphaadamantane-7-oxide (PTA═O): New Diamondoid Building Block for Design of Three-Dimensional Metal‒Organic Frameworks","Crystal Growth & Design","2011","11","7","2711","","10.1021/cg200571y","","","0.71073","MoKα","","0.0169","0.0165","","","0.048","0.0481","","","","","","1.166","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500974","16.6597","0.0007","10.3551","0.0004","6.9008","0.0003","90","","90","","90","","1190.48","0.09","296","2","296","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C6 H14 Ag2 N3 O6 P S -","- C6 H14 Ag2 N3 O6 P S -","- C24 H56 Ag8 N12 O24 P4 S4 -","4","1","","Kirillov, Alexander M.; Wieczorek, Sabina W.; Lis, Agnieszka; Guedes da Silva, M. Fátima C.; Florek, Magdalena; Król, Jarosław; Staroniewicz, Zdzisław; Smoleński, Piotr; Pombeiro, Armando J. L.","1,3,5-Triaza-7-phosphaadamantane-7-oxide (PTA═O): New Diamondoid Building Block for Design of Three-Dimensional Metal‒Organic Frameworks","Crystal Growth & Design","2011","11","7","2711","","10.1021/cg200571y","","","0.71073","MoKα","","0.0193","0.0188","","","0.0465","0.0468","","","","","","0.956","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500975","3.9","0.001","20.07","0.004","14.489","0.003","90","","97.58","0.03","90","","1124.2","0.4","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","phenanthridine fumaric acid 2:1","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C60 H44 N4 O8 -","4","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.71073","MoKα","","0.1024","0.0462","","0.1681","0.1088","0.1088","","","","","","0.9876","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500976","11.299","0.002","13.591","0.003","15.293","0.003","78.55","0.03","75.83","0.03","75.89","0.03","2184.1","0.9","173","","173","","","","","","","","","4","P -1","-P 1","2","","phenanthridine fumaric acid 4:1.5","","- C58 H42 N4 O6 -","- C58 H42 N4 O6 -","- C116 H84 N8 O12 -","2","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.71073","MoKα","","0.1284","0.0609","","0.1896","0.1506","0.1536","","","","","","1.0412","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500977","4.901","0.001","17.21","0.003","13.989","0.003","90","","90.9","0.03","90","","1179.8","0.4","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","phenanthridine succinic acid 2:1","","- C15 H12 N O2 -","- C15 H12 N O2 -","- C60 H48 N4 O8 -","4","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.7107","MoKα","","0.0806","0.0375","","0.1308","0.099","0.0962","","","","","","1.0653","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500978","11.915","0.002","3.8719","0.0008","17.285","0.004","90","","91.79","0.03","90","","797","0.3","173","","173","","","","","","","","","4","P 1 c 1","P -2yc","7","","phenanthridine isophthalic acid 1:1","","- C21 H15 N O4 -","- C21 H15 N O4 -","- C42 H30 N2 O8 -","2","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.71073","MoKα","","0.0625","0.0437","","0.117","0.1056","0.112","","","","","","1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4500979","5.712","0.001","8.131","0.002","14.943","0.003","90","","93.42","0.03","90","","692.8","0.3","173","","173","","","","","","","","","4","P 1 21 1","P 2yb","4","","phenanthridinium maleate","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C34 H26 N2 O8 -","2","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.71073","MoKα","","0.0452","0.0342","","0.0891","0.0851","0.0829","","","","","","1.0103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500980","5.584","0.001","10.23","0.002","10.962","0.002","75.17","0.03","84.53","0.03","86.35","0.03","602.1","0.2","173","","173","","","","","","","","","4","P -1","-P 1","2","","phenanthridinium oxalate","","- C15 H11 N O4 -","- C15 H11 N O4 -","- C30 H22 N2 O8 -","2","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.71073","MoKα","","0.0889","0.0448","","0.1378","0.106","0.1011","","","","","","1.0248","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500981","7.557","0.002","9.469","0.002","18.562","0.004","90","","95.51","0.03","90","","1322.1","0.5","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","phenanthridinium oxalate monohydrate","","- C15 H13 N O5 -","- C15 H13 N O5 -","- C60 H52 N4 O20 -","4","1","","Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese","Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations","Crystal Growth & Design","2011","11","9","4009","","10.1021/cg200573m","","","0.7107","MoKα","","0.0803","0.0384","","0.0925","0.0772","0.0772","","","","","","1.0274","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4500982","21.6735","0.0005","21.6735","0.0005","21.6735","0.0005","90","","90","","90","","10180.9","0.4","150","2","150","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C30 H23 N3 Ni3 O15 -","- C30 H19 N3 Ni3 O14.99 -","- C240 H152 N24 Ni24 O119.92 -","8","0.166667","","Jiang, Guiyuan; Wu, Tao; Zheng, Shou-Tian; Zhao, Xiang; Lin, Qipu; Bu, Xianhui; Feng, Pingyun","A Nine-Connected Mixed-Ligand Nickel-Organic Framework and Its Gas Sorption Properties","Crystal Growth & Design","2011","11","9","3713","","10.1021/cg200579j","","","0.71073","MoKα","","0.0587","0.0521","","","0.1635","0.1738","","","","","","1.137","","","","has coordinates,has disorder","179540","2020-10-21","18:00:00",""
"4500983","18.1284","0.0007","8.8472","0.0003","26.6561","0.0009","90","","108.349","0.004","90","","4057.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C82 H74 Co4 N8 O29 -","- C82 H72 Co4 N8 O29 -","- C164 H144 Co8 N16 O58 -","2","0.25","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71073","MoKα","","0.0581","0.0291","","","0.0376","0.0397","","","","","","0.725","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500984","9.9686","0.0012","9.3686","0.0007","24.551","0.003","90","","90.215","0.011","90","","2292.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C41 H39 N4 Ni2 O18 -","- C41 H30.994 N4 Ni2 O18 -","- C82 H61.988 N8 Ni4 O36 -","2","0.5","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71073","MoKα","","0.1362","0.0598","","","0.1305","0.1442","","","","","","0.81","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4500985","10.1977","0.0008","9.3925","0.0007","24.4616","0.0017","90","","91.926","0.007","90","","2341.7","0.3","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C41 H37 Co2 N4 O17 -","- C41 H31 Co2 N4 O17 -","- C82 H62 Co4 N8 O34 -","2","1","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71073","MoKα","","0.1598","0.0668","","","0.1552","0.1797","","","","","","0.768","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500986","16.8478","0.0008","17.0353","0.0009","8.0615","0.0005","90","","90","","90","","2313.7","0.2","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C86 H70 Cu4 N8 O35 -","- C86 H64 Cu4 N8 O35 -","- C86 H64 Cu4 N8 O35 -","1","0.25","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71073","MoKα","","0.0809","0.0441","","","0.1026","0.1099","","","","","","0.707","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500987","16.272","0.005","16.272","0.005","29.936","0.005","90","0.005","90","0.005","90","0.005","7926","4","293","2","293","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","","- C45 H28 Co2 N4 O20 -","- C45 H20 Co2 N4 O20 -","- C360 H160 Co16 N32 O160 -","8","0.25","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71069","MoKα","","0.0888","0.0365","","","0.0711","0.0758","","","","","","0.788","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500988","14.8271","0.0007","14.287","0.0007","27.5557","0.0014","90","","97.689","0.005","90","","5784.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H54 Cd N4 O29 -","- C52 H38 Cd N4 O29 -","- C208 H152 Cd4 N16 O116 -","4","1","","Guo, Jiao; Ma, Jian-Fang; Liu, Bo; Kan, Wei-Qiu; Yang, Jin","A Series of 2D and 3D Metal‒Organic Frameworks Based on a Flexible Tetrakis(4-pyridyloxymethylene)methane Ligand and Polycarboxylates: Syntheses, Structures, and Photoluminescent Properties","Crystal Growth & Design","2011","11","8","3609","","10.1021/cg200581w","","","0.71073","MoKα","","0.1768","0.0841","","","0.1539","0.1844","","","","","","1.155","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4500989","12.1799","0.0007","16.0955","0.0012","21.5932","0.0018","90","","90","","90","","4233.2","0.5","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C18 H56 Ge4 N12 Ni2 O S10 -","- C18 H56 Ge4 N12 Ni2 O S10 -","- C72 H224 Ge16 N48 Ni8 O4 S40 -","4","1","","Liu, Guang-Ning; Lin, Jian-Di; Xu, Zhong-Ning; Liu, Zhi-Fa; Guo, Guo-Cong; Huang, Jin-Shun","Spontaneous Resolution of a New Thiogermanate Containing Chiral Binuclear Nickel(II) Complexes with Achiral Triethylenetetramine Ligands: A Unique Water-Mediated Supramolecular Hybrid Helix","Crystal Growth & Design","2011","11","8","3318","","10.1021/cg2005826","","","0.71073","MoKα","","0.078","0.0496","","","0.1114","0.1273","","","","","","0.999","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500990","12.151","0.002","15.996","0.003","21.588","0.004","90","","90","","90","","4196","1.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C18 H56 Ge4 N12 Ni2 O S10 -","- C18 H56 Ge4 N12 Ni2 O S10 -","- C72 H224 Ge16 N48 Ni8 O4 S40 -","4","1","","Liu, Guang-Ning; Lin, Jian-Di; Xu, Zhong-Ning; Liu, Zhi-Fa; Guo, Guo-Cong; Huang, Jin-Shun","Spontaneous Resolution of a New Thiogermanate Containing Chiral Binuclear Nickel(II) Complexes with Achiral Triethylenetetramine Ligands: A Unique Water-Mediated Supramolecular Hybrid Helix","Crystal Growth & Design","2011","11","8","3318","","10.1021/cg2005826","","","0.71073","MoKα","","0.0418","0.0379","","","0.103","0.1065","","","","","","1.009","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4500991","22.266","0.005","22.266","0.005","22.266","0.005","90","","90","","90","","11039","4","130","2","130","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- C50 H90 N2 O18 Zn2 -","- C18 H6 O12 Zn2 -","- C144 H48 O96 Zn16 -","8","0.0833333","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.5418","CuKα","","0.1037","0.0978","","","0.2731","0.2795","","","","","","1.086","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500992","22.2434","0.0011","22.2434","0.0011","22.2434","0.0011","90","","90","","90","","11005.3","0.9","130","2","130","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- C50 H92 Co2 N2 O19 -","- C18 H6 Co2 O12 -","- C144 H48 Co16 O96 -","8","0.0833333","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.54184","CuKα","","0.1545","0.125","","","0.3577","0.3805","","","","","","1.238","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500993","23.4246","0.0006","23.4246","0.0006","21.3264","0.0012","90","","90","","90","","11702","0.8","130","2","130","2","","","","","","","","5","I 41/a c d :1","I 4bw 2aw -1bw","142","","","","- C50 H104 Mn2 N2 O25 -","- C18 H6 Mn2 O12 -","- C144 H48 Mn16 O96 -","8","0.25","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.54184","CuKα","","0.1509","0.1252","","","0.3471","0.3675","","","","","","1.196","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500994","22.1014","0.0013","22.1014","0.0013","22.1014","0.0013","90","","90","","90","","10795.9","1.1","130","2","130","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- C50 H86 N2 Ni2 O16 -","- C18 H6 Ni2 O12 -","- C144 H48 Ni16 O96 -","8","0.0833333","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.54184","CuKα","","0.1121","0.1048","","","0.3997","0.4083","","","","","","1.722","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500995","22.1408","0.001","22.1408","0.001","22.1408","0.001","90","","90","","90","","10853.8","0.8","130","2","130","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- C50 H96 Fe2 N2 O21 -","- C18 H6 Fe2 O12 -","- C144 H48 Fe16 O96 -","8","0.0833333","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.54184","CuKα","","0.1194","0.0991","","","0.2797","0.3104","","","","","","1.089","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500996","22.215","0.003","22.215","0.003","22.215","0.003","90","","90","","90","","10963","3","130","2","130","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- C52 H86 N2 O14 Zn2 -","- C18 H6 O12 Zn2 -","- C144 H48 O96 Zn16 -","8","0.0833333","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.54184","CuKα","","0.141","0.0873","","","0.2152","0.2317","","","","","","0.826","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500997","22.7292","0.0006","22.7292","0.0006","22.7292","0.0006","90","","90","","90","","11742.3","0.5","130","2","130","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C58 H104 Cl6 Mn2 N2 O20 -","- C18 Cl6 Mn2 O12 -","- C144 Cl48 Mn16 O96 -","8","0.166667","","Abrahams, Brendan F.; Hudson, Timothy A.; McCormick, Laura J.; Robson, Richard","Coordination Polymers of 2,5-Dihydroxybenzoquinone and Chloranilic Acid with the (10,3)-aTopology","Crystal Growth & Design","2011","11","7","2717","","10.1021/cg2005908","","","1.54184","CuKα","","0.1366","0.0954","","","0.2272","0.2441","","","","","","1.077","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500998","5.601","0.0006","13.344","0.001","31.751","0.002","90","","90","","90","","2373.1","0.3","293","2","293","2","","","","","","","","4","P b c 21","P 2c -2b","29","Barium uranyl piroarsenate","","","- As6 Ba4 O25 U2 -","- As6 Ba4 O25 U2 -","- As24 Ba16 O100 U8 -","4","1","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Depmeier, Wulf","Structural Complexity of Barium Uranyl Arsenates: Synthesis, Structure, and Topology of Ba4[(UO2)2(As2O7)3], Ba3[(UO2)2(AsO4)2(As2O7)], and Ba5Ca[(UO2)8(AsO4)4O8]","Crystal Growth & Design","2011","11","7","3295","","10.1021/cg200592s","","","0.71073","MoKα","","0.0475","0.0441","","","0.117","0.1226","","","","","","1.05","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4500999","19.246","0.002","9.536","0.001","9.619","0.001","90","","95.585","0.006","90","","1757","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Barium uranyl mixed arsenate","","","- As4 Ba3 O19 U2 -","- As4 Ba3 O19 U2 -","- As16 Ba12 O76 U8 -","4","0.5","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Depmeier, Wulf","Structural Complexity of Barium Uranyl Arsenates: Synthesis, Structure, and Topology of Ba4[(UO2)2(As2O7)3], Ba3[(UO2)2(AsO4)2(As2O7)], and Ba5Ca[(UO2)8(AsO4)4O8]","Crystal Growth & Design","2011","11","7","3295","","10.1021/cg200592s","","","0.71073","MoKα","","0.0501","0.049","","","0.1309","0.132","","","","","","1.097","","","","has coordinates","179540","2020-10-21","18:00:00",""
"4501000","12.073","0.001","12.838","0.001","13.472","0.001","90","","116.969","0.003","90","","1861","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","barium calcium uranyl arsenate","","","- As4 Ba5 Ca O40 U8 -","- As4 Ba5 Ca O40 U8 -","- As8 Ba10 Ca2 O80 U16 -","2","0.5","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Depmeier, Wulf","Structural Complexity of Barium Uranyl Arsenates: Synthesis, Structure, and Topology of Ba4[(UO2)2(As2O7)3], Ba3[(UO2)2(AsO4)2(As2O7)], and Ba5Ca[(UO2)8(AsO4)4O8]","Crystal Growth & Design","2011","11","7","3295","","10.1021/cg200592s","","","0.71073","MoKα","","0.0619","0.0584","","","0.1149","0.1169","","","","","","1.333","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501001","4.9382","0.0007","12.6849","0.0018","14.696","0.002","108.041","0.001","92.996","0.002","97.953","0.002","862.5","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H6 F4 I2 N2 O -","- C17 H6 F4 I2 N2 O -","- C34 H12 F8 I4 N4 O2 -","2","1","","Ji, Baoming; Wang, Weizhou; Deng, Dongsheng; Zhang, Yu","Symmetrical Bifurcated Halogen Bond: Design and Synthesis","Crystal Growth & Design","2011","11","8","3622","","10.1021/cg200603z","","","0.71073","MoKα","","0.0323","0.025","","","0.0585","0.0626","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501002","5.3613","0.0013","15.321","0.004","11.904","0.003","90","","101.207","0.002","90","","959.2","0.4","296","2","296","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C9 H3 F2 I N O -","- C9 H3 F2 I N O -","- C36 H12 F8 I4 N4 O4 -","4","1","","Ji, Baoming; Wang, Weizhou; Deng, Dongsheng; Zhang, Yu","Symmetrical Bifurcated Halogen Bond: Design and Synthesis","Crystal Growth & Design","2011","11","8","3622","","10.1021/cg200603z","","","0.71073","MoKα","","0.0376","0.0267","","","0.0659","0.0732","","","","","","1.008","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501003","13.985","0.002","15.55","0.003","4.6026","0.0007","90","","101.769","0.002","90","","979.9","0.3","296","2","296","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C18 H14 F4 I2 N4 -","- C18 H14 F4 I2 N4 -","- C36 H28 F8 I4 N8 -","2","0.25","","Ji, Baoming; Wang, Weizhou; Deng, Dongsheng; Zhang, Yu","Symmetrical Bifurcated Halogen Bond: Design and Synthesis","Crystal Growth & Design","2011","11","8","3622","","10.1021/cg200603z","","","0.71073","MoKα","","0.0196","0.0183","","","0.0448","0.046","","","","","","1.049","","","","has coordinates","259535","2020-12-04","06:05:01",""
"4501004","8.1331","0.0006","14.6556","0.001","16.8257","0.0012","90","","90","","90","","2005.5","0.2","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 N4 O7 S Zn -","- C17 H18 N4 O7 S Zn -","- C68 H72 N16 O28 S4 Zn4 -","4","1","","Liu, Qing-Yan; Wang, Yu-Ling; Zhang, Na; Jiang, Yun-Liang; Wei, Jia-Jia; Luo, Feng","Spontaneous Resolution in the Ionothermal Synthesis of Homochiral Zn(II) Metal‒Organic Frameworks with (10,3)-aTopology Constructed from Achiral 5-Sulfoisophthalate","Crystal Growth & Design","2011","11","9","3717","","10.1021/cg200606r","","","0.71073","MoKα","","0.0495","0.0347","","","0.0695","0.0738","","","","","","1.018","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501005","8.1331","0.0006","14.6556","0.001","16.8257","0.0012","90","","90","","90","","2005.5","0.2","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 N4 O7 S Zn -","- C17 H18 N4 O7 S Zn -","- C68 H72 N16 O28 S4 Zn4 -","4","1","","Liu, Qing-Yan; Wang, Yu-Ling; Zhang, Na; Jiang, Yun-Liang; Wei, Jia-Jia; Luo, Feng","Spontaneous Resolution in the Ionothermal Synthesis of Homochiral Zn(II) Metal‒Organic Frameworks with (10,3)-aTopology Constructed from Achiral 5-Sulfoisophthalate","Crystal Growth & Design","2011","11","9","3717","","10.1021/cg200606r","","","0.71073","MoKα","","0.0303","0.0277","","","0.0688","0.0699","","","","","","1.017","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501006","9.4","0.002","7.337","0.002","10.007","0.003","90","","105.25","0.02","90","","665.9","0.3","120","2","120","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C3 H7 Cl N6 -","- C3 H7 Cl N6 -","- C12 H28 Cl4 N24 -","4","1","","Naik, Anil D.; Tinant, Bernard; Léonard, Alexandre; Marchand-Brynaert, Jacqueline; Su, Bao-Lian; Garcia, Yann","(Di)-aminoguanidine Functionalization through Transamination: An Avenue to an Auspicious Class of Supramolecular Synthons","Crystal Growth & Design","2011","11","9","4034","","10.1021/cg200612j","","","0.71069","MoKα","","0.0344","0.0332","","","0.0825","0.0839","","","","","","1.045","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501007","6.183","0.002","6.205","0.002","8.795","0.003","83.75","0.02","78.82","0.02","86.52","0.02","328.78","0.19","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H8 Cl N5 O -","- C2 H8 Cl N5 O -","- C4 H16 Cl2 N10 O2 -","2","1","","Naik, Anil D.; Tinant, Bernard; Léonard, Alexandre; Marchand-Brynaert, Jacqueline; Su, Bao-Lian; Garcia, Yann","(Di)-aminoguanidine Functionalization through Transamination: An Avenue to an Auspicious Class of Supramolecular Synthons","Crystal Growth & Design","2011","11","9","4034","","10.1021/cg200612j","","","0.71069","MoKα","","0.0457","0.043","","","0.1146","0.1209","","","","","","1.243","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501008","13.358","0.002","9.694","0.005","10.999","0.003","90","","123.03","0.03","90","","1194.1","0.8","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H10 Cl2 N10 Zn -","- C4 H10 Cl2 N10 Zn -","- C16 H40 Cl8 N40 Zn4 -","4","0.5","","Naik, Anil D.; Tinant, Bernard; Léonard, Alexandre; Marchand-Brynaert, Jacqueline; Su, Bao-Lian; Garcia, Yann","(Di)-aminoguanidine Functionalization through Transamination: An Avenue to an Auspicious Class of Supramolecular Synthons","Crystal Growth & Design","2011","11","9","4034","","10.1021/cg200612j","","","0.71069","MoKα","","0.0409","0.0382","","","0.1004","0.1017","","","","","","1.166","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501009","7.1364","0.0005","11.4297","0.0009","11.7485","0.001","62.658","0.004","75.568","0.005","88.56","0.005","819.91","0.12","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C11 H12 Cl Cu K N2 O8 S -","- C11 H12 Cl Cu K N2 O8 S -","- C22 H24 Cl2 Cu2 K2 N4 O16 S2 -","2","1","","Kopylovich, Maximilian N.; Karabach, Yauhen Yu.; Mahmudov, Kamran T.; Haukka, Matti; Kirillov, Alexander M.; Figiel, Paweł J.; Pombeiro, Armando J. L.","Heterometallic Copper(II)‒Potassium 3D Coordination Polymers Driven by Multifunctionalized Azo Derivatives of β-Diketones","Crystal Growth & Design","2011","11","10","4247","","10.1021/cg200615s","","","0.71073","MoKα","","0.0942","0.0697","","","0.1726","0.1894","","","","","","1.069","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501010","12.6476","0.0002","6.6691","0.0001","20.3388","0.0003","90","","96.917","0.001","90","","1703.05","0.04","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H14 Cu K N3 O11 S -","- C11 H14 Cu K N3 O11 S -","- C44 H56 Cu4 K4 N12 O44 S4 -","4","1","","Kopylovich, Maximilian N.; Karabach, Yauhen Yu.; Mahmudov, Kamran T.; Haukka, Matti; Kirillov, Alexander M.; Figiel, Paweł J.; Pombeiro, Armando J. L.","Heterometallic Copper(II)‒Potassium 3D Coordination Polymers Driven by Multifunctionalized Azo Derivatives of β-Diketones","Crystal Growth & Design","2011","11","10","4247","","10.1021/cg200615s","","","0.71073","MoKα","","0.0391","0.0288","","","0.0714","0.0757","","","","","","1.067","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501011","19.136","0.011","19.813","0.012","5.177","0.003","90","","90","","90","","1963","2","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H23 N O2 S -","- C22 H23 N O2 S -","- C88 H92 N4 O8 S4 -","4","1","","Eccles, Kevin S.; Elcoate, Curtis J.; Maguire, Anita R.; Lawrence, Simon E.","Unzipping the Dimer in Primary Amides by Cocrystallization with Sulfoxides","Crystal Growth & Design","2011","11","10","4433","","10.1021/cg2006277","","","0.71073","MoKα","","0.0807","0.0431","","","0.0822","0.0942","","","","","","0.999","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501012","18.71","0.11","20.13","0.05","5.197","0.016","90","","90","","90","","1957","14","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H23 N O2 S -","- C22 H23 N O2 S -","- C88 H92 N4 O8 S4 -","4","1","","Eccles, Kevin S.; Elcoate, Curtis J.; Maguire, Anita R.; Lawrence, Simon E.","Unzipping the Dimer in Primary Amides by Cocrystallization with Sulfoxides","Crystal Growth & Design","2011","11","10","4433","","10.1021/cg2006277","","","0.71073","MoKα","","0.0926","0.0466","","","0.0838","0.0991","","","","","","0.985","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501013","18.822","0.003","19.735","0.003","5.1366","0.0006","90","","90","","90","","1908","0.5","135","2","135","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C21 H20 Cl N O2 S -","- C21 H20 Cl N O2 S -","- C84 H80 Cl4 N4 O8 S4 -","4","1","","Eccles, Kevin S.; Elcoate, Curtis J.; Maguire, Anita R.; Lawrence, Simon E.","Unzipping the Dimer in Primary Amides by Cocrystallization with Sulfoxides","Crystal Growth & Design","2011","11","10","4433","","10.1021/cg2006277","","","0.71073","MoKα","","0.0723","0.0466","","","0.0866","0.0961","","","","","","1.019","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501014","14.6467","0.001","14.6467","0.001","13.7488","0.0012","90","","90","","90","","2949.5","0.4","173","2","173","2","","","","","","","","6","P 4/n :2","-P 4a","85","","","","- C58 H60 Co2 N2 O12 S4 -","- C58 H60 Co2 N2 O12 S4 -","- C116 H120 Co4 N4 O24 S8 -","2","0.25","","Kim, Kihwan; Park, Sunhong; Park, Ki-Min; Lee, Shim Sung","Thiacalix[4]arene-Based Three-Dimensional Coordination Polymers Incorporating Neutral Bridging Coligands","Crystal Growth & Design","2011","11","9","4059","","10.1021/cg2006315","","","0.71073","MoKα","","0.0952","0.0773","","","0.2159","0.2269","","","","","","1.071","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501015","22.6129","0.0003","22.6129","0.0003","45.2251","0.0006","90","","90","","90","","23125.5","0.5","173","2","173","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C68 H76 Co2 N4 O16 S4 -","- C68 H76 Co2 N4 O16 S4 -","- C544 H608 Co16 N32 O128 S32 -","8","0.25","","Kim, Kihwan; Park, Sunhong; Park, Ki-Min; Lee, Shim Sung","Thiacalix[4]arene-Based Three-Dimensional Coordination Polymers Incorporating Neutral Bridging Coligands","Crystal Growth & Design","2011","11","9","4059","","10.1021/cg2006315","","","0.71073","MoKα","","0.0723","0.0465","","","0.1215","0.128","","","","","","1.014","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501016","12.7259","0.0002","36.7932","0.0006","20.4626","0.0004","90","","116.104","0.001","90","","8603.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C144 H172 Co3 N12 Na2 O38 S8 -","- C144 H164 Co3 N12 Na2 O38 S8 -","- C288 H328 Co6 N24 Na4 O76 S16 -","2","0.5","","Kim, Kihwan; Park, Sunhong; Park, Ki-Min; Lee, Shim Sung","Thiacalix[4]arene-Based Three-Dimensional Coordination Polymers Incorporating Neutral Bridging Coligands","Crystal Growth & Design","2011","11","9","4059","","10.1021/cg2006315","","","0.71073","MoKα","","0.1184","0.0748","","","0.2205","0.2547","","","","","","1.041","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501017","20.3454","0.0016","14.9971","0.0012","22.4622","0.0017","90","","103.852","0.005","90","","6654.4","0.9","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C120 H166 Cd4 N8 O32 S8 -","- C120 H166 Cd4 N8 O32 S8 -","- C240 H332 Cd8 N16 O64 S16 -","2","0.5","","Kim, Kihwan; Park, Sunhong; Park, Ki-Min; Lee, Shim Sung","Thiacalix[4]arene-Based Three-Dimensional Coordination Polymers Incorporating Neutral Bridging Coligands","Crystal Growth & Design","2011","11","9","4059","","10.1021/cg2006315","","","0.71073","MoKα","","0.1917","0.0758","","","0.1708","0.234","","","","","","1.032","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501018","7.0118","0.0013","7.3848","0.0017","9.9023","0.0017","95.805","0.002","106.502","0.003","110.677","0.002","448.21","0.15","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","4,7-dimethyl-2H-chromen-2-one","","- C11 H10 O2 -","- C11 H10 O2 -","- C22 H20 O4 -","2","1","","Seth, Saikat Kumar; Sarkar, Debayan; Jana, Atish Dipankar; Kar, Tanusree","On the Possibility of Tuning Molecular Edges To Direct Supramolecular Self-Assembly in Coumarin Derivatives through Cooperative Weak Forces: Crystallographic and Hirshfeld Surface Analyses","Crystal Growth & Design","2011","11","11","4837","","10.1021/cg2006343","","","0.71073","MoKα","","0.0552","0.0424","","","0.116","0.1273","","","","","","1.066","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501019","7.038","0.0011","9.396","0.003","13.358","0.0011","90","","98.932","0.006","90","","872.6","0.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","8-hydroxy-4,7-dimethyl-2H-chromen-2-one","","- C11 H10 O3 -","- C11 H10 O3 -","- C44 H40 O12 -","4","1","","Seth, Saikat Kumar; Sarkar, Debayan; Jana, Atish Dipankar; Kar, Tanusree","On the Possibility of Tuning Molecular Edges To Direct Supramolecular Self-Assembly in Coumarin Derivatives through Cooperative Weak Forces: Crystallographic and Hirshfeld Surface Analyses","Crystal Growth & Design","2011","11","11","4837","","10.1021/cg2006343","","","0.71073","MoKα","","0.0345","0.0333","","","0.0945","0.0962","","","","","","1.066","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501020","12.529","0.008","12.889","0.003","12.689","0.004","90","","115.679","0.002","90","","1846.7","1.4","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","6-methoxy-7-methyl-2H-chromen-2-one","","- C11 H10 O3 -","- C11 H10 O3 -","- C88 H80 O24 -","8","1","","Seth, Saikat Kumar; Sarkar, Debayan; Jana, Atish Dipankar; Kar, Tanusree","On the Possibility of Tuning Molecular Edges To Direct Supramolecular Self-Assembly in Coumarin Derivatives through Cooperative Weak Forces: Crystallographic and Hirshfeld Surface Analyses","Crystal Growth & Design","2011","11","11","4837","","10.1021/cg2006343","","","0.71073","MoKα","","0.0597","0.0444","","","0.1221","0.1363","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501021","4.1622","0.0005","10.5891","0.0013","21.932","0.003","90","","91.696","0.004","90","","966.2","0.2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 O3 -","- C12 H10 O3 -","- C48 H40 O12 -","4","1","","Seth, Saikat Kumar; Sarkar, Debayan; Jana, Atish Dipankar; Kar, Tanusree","On the Possibility of Tuning Molecular Edges To Direct Supramolecular Self-Assembly in Coumarin Derivatives through Cooperative Weak Forces: Crystallographic and Hirshfeld Surface Analyses","Crystal Growth & Design","2011","11","11","4837","","10.1021/cg2006343","","","0.71073","MoKα","","0.0473","0.0365","","","0.0898","0.097","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501022","7.0532","0.0003","14.0806","0.0006","12.0234","0.0006","90","","90.999","0.001","90","","1193.9","0.09","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H11 N O4 -","- C15 H11 N O4 -","- C60 H44 N4 O16 -","4","2","","Reger, Daniel L.; Debreczeni, Agota; Horger, Jacob J.; Smith, Mark D.","Structures of Bifunctional Molecules Containing Two Very Different Supramolecular Synthons: Carboxylic Acid and Strong π···π Stacking 1,8-Naphthalimide Ring","Crystal Growth & Design","2011","11","9","4068","","10.1021/cg200636k","","","0.71073","MoKα","","0.0304","0.0293","","","0.0756","0.077","","","","","","1.054","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501023","8.3327","0.0003","18.8237","0.0007","7.0193","0.0003","90","","91.799","0.001","90","","1100.45","0.07","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 N O4 -","- C14 H9 N O4 -","- C56 H36 N4 O16 -","4","1","","Reger, Daniel L.; Debreczeni, Agota; Horger, Jacob J.; Smith, Mark D.","Structures of Bifunctional Molecules Containing Two Very Different Supramolecular Synthons: Carboxylic Acid and Strong π···π Stacking 1,8-Naphthalimide Ring","Crystal Growth & Design","2011","11","9","4068","","10.1021/cg200636k","","","0.71073","MoKα","","0.0443","0.0408","","","0.1084","0.1117","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501024","19.6828","0.0019","9.6776","0.0009","14.1849","0.0014","90","","114.061","0.002","90","","2467.2","0.4","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H11 N O4 -","- C15 H11 N O4 -","- C120 H88 N8 O32 -","8","1","","Reger, Daniel L.; Debreczeni, Agota; Horger, Jacob J.; Smith, Mark D.","Structures of Bifunctional Molecules Containing Two Very Different Supramolecular Synthons: Carboxylic Acid and Strong π···π Stacking 1,8-Naphthalimide Ring","Crystal Growth & Design","2011","11","9","4068","","10.1021/cg200636k","","","0.71073","MoKα","","0.0551","0.0431","","","0.1145","0.1238","","","","","","1.055","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501025","7.2902","0.0004","11.9959","0.0007","14.9283","0.0009","90","","102.195","0.001","90","","1276.06","0.13","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C64 H52 N4 O16 -","4","1","","Reger, Daniel L.; Debreczeni, Agota; Horger, Jacob J.; Smith, Mark D.","Structures of Bifunctional Molecules Containing Two Very Different Supramolecular Synthons: Carboxylic Acid and Strong π···π Stacking 1,8-Naphthalimide Ring","Crystal Growth & Design","2011","11","9","4068","","10.1021/cg200636k","","","0.71073","MoKα","","0.0427","0.0359","","","0.0984","0.1026","","","","","","1.079","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501026","12.7242","0.0006","20.4744","0.001","7.5919","0.0004","90","","114.921","0.001","90","","1793.69","0.15","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 N2 O5 -","- C22 H18 N2 O5 -","- C88 H72 N8 O20 -","4","0.5","","Reger, Daniel L.; Debreczeni, Agota; Horger, Jacob J.; Smith, Mark D.","Structures of Bifunctional Molecules Containing Two Very Different Supramolecular Synthons: Carboxylic Acid and Strong π···π Stacking 1,8-Naphthalimide Ring","Crystal Growth & Design","2011","11","9","4068","","10.1021/cg200636k","","","0.71073","MoKα","","0.0508","0.0416","","","0.1135","0.1201","","","","","","1.079","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501027","23.985","0.0008","23.985","0.0008","26.9081","0.0018","90","","90","","120","","13405.8","1.1","150","2","150","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C19 H11 N O4 -","- C19 H11 N O4 -","- C684 H396 N36 O144 -","36","1","","Reger, Daniel L.; Debreczeni, Agota; Horger, Jacob J.; Smith, Mark D.","Structures of Bifunctional Molecules Containing Two Very Different Supramolecular Synthons: Carboxylic Acid and Strong π···π Stacking 1,8-Naphthalimide Ring","Crystal Growth & Design","2011","11","9","4068","","10.1021/cg200636k","","","0.71073","MoKα","","0.0679","0.0351","","","0.0628","0.0712","","","","","","0.881","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501028","13.641","0.003","25.222","0.005","17","0.003","90","","103.37","0.03","90","","5690","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Hexamanganese(II)hydroxy undecabutyrate","Hexamanganese(II)hydroxy undecabutyrate","","- C44 H78 Mn6 O23 -","- C44 H78 Mn6 O23 -","- C176 H312 Mn24 O92 -","4","1","","Martínez Casado, F. J.; Fabelo, O.; Rodríguez-Velamazán, J. A.; Ramos Riesco, M.; Rodríguez Cheda, J. A.; Labrador, A.; Rodríguez-Blanco, C.; Campo, J.; Sánchez-Alarcos, V.; Müller, H.","Manganese(II) Butyrate-Based MOFs: Structures, Thermal and Magnetic Properties","Crystal Growth & Design","2011","11","9","4080","","10.1021/cg200649n","","","0.7514","Synchrotron","","0.0836","0.0766","","","0.2464","0.251","","","","","","1.039","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501029","14.65","0.003","25.263","0.005","17.207","0.003","90","","106.9","0.03","90","","6093","2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Hexamanganese(II)hydroxy undecabutyrate","Hexamanganese(II)hydroxy undecabutyrate","","- C44 H78 Mn6 O23 -","- C44 H78 Mn6 O23 -","- C176 H312 Mn24 O92 -","4","1","","Martínez Casado, F. J.; Fabelo, O.; Rodríguez-Velamazán, J. A.; Ramos Riesco, M.; Rodríguez Cheda, J. A.; Labrador, A.; Rodríguez-Blanco, C.; Campo, J.; Sánchez-Alarcos, V.; Müller, H.","Manganese(II) Butyrate-Based MOFs: Structures, Thermal and Magnetic Properties","Crystal Growth & Design","2011","11","9","4080","","10.1021/cg200649n","","","0.7514","Synchrotron","","0.0998","0.0889","","","0.2907","0.3003","","","","","","1.061","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501030","40.059","0.005","40.059","0.005","40.059","0.005","90","","90","","90","","64284","14","100","2","100","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","Pentamanganese(II) decabutyrate dihydrate","Manganese(II) butyrate hydrate (0.4)","","- C40 H74 Mn5 O22 -","- C40 H74 Mn5 O22 -","- C1920 H3552 Mn240 O1056 -","48","1","","Martínez Casado, F. J.; Fabelo, O.; Rodríguez-Velamazán, J. A.; Ramos Riesco, M.; Rodríguez Cheda, J. A.; Labrador, A.; Rodríguez-Blanco, C.; Campo, J.; Sánchez-Alarcos, V.; Müller, H.","Manganese(II) Butyrate-Based MOFs: Structures, Thermal and Magnetic Properties","Crystal Growth & Design","2011","11","9","4080","","10.1021/cg200649n","","","0.7514","Synchrotron","","0.0351","0.0343","","","0.09","0.0905","","","","","","1.026","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501031","40.58","0.005","40.58","0.005","40.58","0.005","90","","90","","90","","66825","14","298","2","298","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","Pentamanganese(II) decabutyrate dihydrate","Manganese(II) butyrate hydrate (0.4)","","- C40 H74 Mn5 O22 -","- C40 H74 Mn5 O22 -","- C1920 H3552 Mn240 O1056 -","48","1","","Martínez Casado, F. J.; Fabelo, O.; Rodríguez-Velamazán, J. A.; Ramos Riesco, M.; Rodríguez Cheda, J. A.; Labrador, A.; Rodríguez-Blanco, C.; Campo, J.; Sánchez-Alarcos, V.; Müller, H.","Manganese(II) Butyrate-Based MOFs: Structures, Thermal and Magnetic Properties","Crystal Growth & Design","2011","11","9","4080","","10.1021/cg200649n","","","0.7513","Synchrotron","","0.0424","0.0394","","","0.1109","0.1137","","","","","","1.006","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501032","9.9318","0.0012","10.998","0.0008","14.451","0.0004","99.617","0.005","107.067","0.007","103.331","0.007","1420.8","0.2","208","2","208","2","","","","","","","","8","P -1","-P 1","2","","","","- C27 H25 B Cl2 Cu F4 N4 P -","- C27 H25 B Cl2 Cu F4 N4 P -","- C54 H50 B2 Cl4 Cu2 F8 N8 P2 -","2","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.0478","0.0361","","0.0846","0.0785","0.0846","","","1.054","","","1.054","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501033","10.1515","0.0009","11.1543","0.0017","14.5731","0.0008","101.892","0.011","106.289","0.006","104.671","0.011","1462.5","0.3","208","2","208","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H31 B Cu F4 N4 O P -","- C30 H31 B Cu F4 N4 O P -","- C60 H62 B2 Cu2 F8 N8 O2 P2 -","2","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.0764","0.051","","0.1142","0.1036","0.1142","","","1.081","","","1.081","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501034","27.99","0.004","11.112","0.006","17.2816","0.0018","90","","102.175","0.011","90","","5254","3","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C23 H20 Cl4 Cu N2 O4 P -","- C23 H20 Cl4 Cu N2 O4 P -","- C184 H160 Cl32 Cu8 N16 O32 P8 -","8","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1301","0.0908","","0.259","0.2308","0.259","","","1.028","","","1.028","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501035","9.9525","0.0012","11.0093","0.0011","14.5265","0.0016","99.609","0.006","107.635","0.009","103.227","0.007","1428","0.3","208","2","208","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H25 Cl3 Cu N4 O4 P -","- C27 H25 Cl3 Cu N4 O4 P -","- C54 H50 Cl6 Cu2 N8 O8 P2 -","2","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.0732","0.0488","","0.0921","0.0841","0.0921","","","1.084","","","1.084","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501036","19.039","0.003","23.6793","0.0017","26.077","0.004","90","","94.572","0.011","90","","11719","3","208","2","208","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C119 H121 Cl3 Cu3 N9 O17 P3 -","- C119 H121 Cl3 Cu3 N9 O17 P3 -","- C476 H484 Cl12 Cu12 N36 O68 P12 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1015","0.0608","","0.1829","0.1617","0.1829","","","1.087","","","1.087","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501037","11.0417","0.0011","17.3398","0.0014","19.8809","0.0012","90","","102.275","0.006","90","","3719.4","0.5","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 Cl5 Cu N3 O4 P -","- C35 H31 Cl5 Cu N3 O4 P -","- C140 H124 Cl20 Cu4 N12 O16 P4 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1032","0.0649","","0.1531","0.1344","0.1531","","","1.051","","","1.051","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501038","12.882","0.0009","15.9637","0.0015","16.7495","0.0014","67.131","0.008","89.524","0.005","72.358","0.009","3000.8","0.5","208","2","208","2","","","","","","","","8","P -1","-P 1","2","","","","- C50 H42 B Cl12 Cu F4 N2 P2 -","- C50 H42 B Cl12 Cu F4 N2 P2 -","- C100 H84 B2 Cl24 Cu2 F8 N4 P4 -","2","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1522","0.1181","","0.3149","0.2964","0.3149","","","1.085","","","1.085","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501039","11.0271","0.0015","17.337","0.002","19.9735","0.0016","90","","102.459","0.008","90","","3728.5","0.7","208","2","208","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 B Cl4 Cu F4 N3 P -","- C35 H31 B Cl4 Cu F4 N3 P -","- C140 H124 B4 Cl16 Cu4 F16 N12 P4 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.0978","0.0606","","0.1434","0.1249","0.1434","","","1.06","","","1.06","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501040","19.044","0.002","23.6112","0.0008","26.174","0.004","90","","94.589","0.01","90","","11731","2","208","2","208","2","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C115 H113 B3 Cu3 F12 N9 O4 P3 -","- C115 H113 B3 Cu3 F12 N9 O4 P3 -","- C460 H452 B12 Cu12 F48 N36 O16 P12 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1538","0.1009","","0.3106","0.282","0.3106","","","1.047","","","1.047","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501041","19.0455","0.0015","19.2388","0.0012","24.4262","0.001","90","","90","","90","","8950.1","1","208","2","208","2","","","","","","","","7","P c a b","-P 2bc 2ac","61","","","","- C50 H46 Cu F6 N2 O P3 -","- C50 H46 Cu F6 N2 O P3 -","- C400 H368 Cu8 F48 N16 O8 P24 -","8","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1409","0.0762","","0.1614","0.1376","0.1614","","","1.083","","","1.083","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501042","11.133","0.0014","17.542","0.002","20.2848","0.0013","90","","103.652","0.006","90","","3849.6","0.7","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 Cl4 Cu F6 N3 P2 -","- C35 H31 Cl4 Cu F6 N3 P2 -","- C140 H124 Cl16 Cu4 F24 N12 P8 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71083","MoKα","","0.1461","0.0977","","0.2588","0.2284","0.2588","","","1.052","","","1.052","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501043","14.3","0.003","18.7302","0.0014","22.717","0.004","90","","119.867","0.011","90","","5276.4","1.6","208","2","208","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C58 H62 B Cu F4 N2 O3 P2 -","- C58 H62 B Cu F4 N2 O3 P2 -","- C232 H248 B4 Cu4 F16 N8 O12 P8 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.13","0.0715","","0.2074","0.1735","0.2074","","","1.047","","","1.047","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501044","19.034","0.004","16.284","0.002","17.279","0.002","90","","92.493","0.012","90","","5350.6","1.4","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49 H41 Cl10 Cu N2 O4 P2 -","- C49 H41 Cl10 Cu N2 O4 P2 -","- C196 H164 Cl40 Cu4 N8 O16 P8 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.2081","0.1211","","0.3394","0.288","0.3394","","","1.036","","","1.036","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501045","12.8791","0.0015","15.598","0.003","16.47","0.002","63.679","0.01","79.279","0.012","80.168","0.014","2899.2","0.8","208","2","208","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H42 Cl12 Cu F6 N2 P3 -","- C49.327 H41.327 Cl9.981 Cu F5.358 N2 P2.893 -","- C98.654 H82.654 Cl19.962 Cu2 F10.716 N4 P5.786 -","2","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1808","0.1009","","0.2729","0.233","0.2729","","","1.044","","","1.044","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501046","14.3365","0.001","18.757","0.003","22.7858","0.0019","90","","120.536","0.005","90","","5277.5","1.1","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H62 Cl Cu N2 O7 P2 -","- C58 H62 Cl Cu N2 O7 P2 -","- C232 H248 Cl4 Cu4 N8 O28 P8 -","4","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1134","0.0732","","0.1881","0.1677","0.1881","","","1.055","","","1.055","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501047","10.6227","0.0004","12.5763","0.0016","14.1396","0.0008","63.634","0.006","72.594","0.004","74.095","0.006","1592.8","0.2","208","2","208","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H31 Cu F6 N4 O P2 -","- C26 H23 Cu F6 N4 P2 -","- C52 H46 Cu2 F12 N8 P4 -","2","1","","Janssen, Femke F. B. J.; Veraart, Laurens P. J.; Smits, Jan M. M.; de Gelder, René; Rowan, Alan E.","1. Solvent, Linker, and Anion Effects on the Formation, Connectivity, and Topology of Cu(I)/PPh3/N-Donor Ligand Coordination Polymers","Crystal Growth & Design","2011","11","10","4313","","10.1021/cg2006502","","","0.71073","MoKα","","0.1704","0.0986","","0.2247","0.1951","0.2247","","","1.031","","","1.031","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501048","11.512","0.002","11.456","0.002","7.1028","0.0015","90","","90","","90","","936.7","0.3","291","2","291","2","","","","","","","see text","3","A b a 2","A 2 -2ab","41","","(1s,6s)-11,13-dioxatricyclo[4.4.3.0^1,6^]trideca-3,8-dien-12-one","","- C11 H12 O3 -","- C11 H12 O3 -","- C44 H48 O12 -","4","","","Mehta, Goverdhan; Sen, Saikat","Interesting Modes of Self-assembly of Achiral 12-Oxo-11,13-dioxa[4.4.3]propellanes in a Noncentrosymmetric Environment","Crystal Growth & Design","2011","11","9","3721","","10.1021/cg200665w","","","0.71073","MoKa","","0.0567","0.0495","","","0.1176","0.1216","","","","","","1.215","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501049","7.6793","0.0007","10.2749","0.001","12.4329","0.0012","90","","90","","90","","981.01","0.16","291","2","291","2","","","","","","","see text","3","C 2 2 21","C 2c 2","20","","(1s,6s)-11,13-dioxatricyclo[4.4.3.01,6]tridecan-12-one","","- C11 H16 O3 -","- C11 H16 O3 -","- C44 H64 O12 -","4","0.5","","Mehta, Goverdhan; Sen, Saikat","Interesting Modes of Self-assembly of Achiral 12-Oxo-11,13-dioxa[4.4.3]propellanes in a Noncentrosymmetric Environment","Crystal Growth & Design","2011","11","9","3721","","10.1021/cg200665w","","","0.71073","MoKa","","0.0366","0.0352","","","0.0866","0.0876","","","","","","1.097","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501050","8.047","0.002","14.343","0.004","7.804","0.002","90","","91.885","0.004","90","","900.2","0.4","291","2","291","2","","","","","","","see text","3","C 1 2/c 1","-C 2yc","15","","(1s,6s)-11,13-dioxatricyclo[4.4.3.0^1,6^]trideca-2,4,7,9-tetraen-12-one","","- C11 H8 O3 -","- C11 H8 O3 -","- C44 H32 O12 -","4","0.5","","Mehta, Goverdhan; Sen, Saikat","Interesting Modes of Self-assembly of Achiral 12-Oxo-11,13-dioxa[4.4.3]propellanes in a Noncentrosymmetric Environment","Crystal Growth & Design","2011","11","9","3721","","10.1021/cg200665w","","","0.71073","MoKa","","0.0577","0.0478","","","0.1121","0.1169","","","","","","1.082","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501051","5.5559","0.0011","10.321","0.002","19.819","0.004","82.82","0.03","88.63","0.03","82.49","0.03","1117.9","0.4","110","2","110","2","","","","","","","","4","P -1","-P 1","2","Metaxalone","5-[(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","2","","Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H.","Conformational Polymorphs of a Muscle Relaxant, Metaxalone","Crystal Growth & Design","2011","11","9","4101","","10.1021/cg200678e","","","0.71073","MoKα","","0.0755","0.0709","","","0.1939","0.1997","","","","","","1.098","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501052","10.101","0.002","15.505","0.003","7.1101","0.0014","90","","91.23","0.03","90","","1113.3","0.4","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Metaxalone","5-[(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","1","","Aitipamula, Srinivasulu; Chow, Pui Shan; Tan, Reginald B. H.","Conformational Polymorphs of a Muscle Relaxant, Metaxalone","Crystal Growth & Design","2011","11","9","4101","","10.1021/cg200678e","","","0.71073","MoKα","","0.0955","0.0843","","","0.2315","0.2421","","","","","","1.133","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501053","12.3254","0.0004","13.5063","0.0005","20.0938","0.0007","93.146","0.003","95.493","0.002","92.688","0.002","3320.1","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H25 Cl N10 O15 -","- C27 H25 Cl N10 O15 -","- C108 H100 Cl4 N40 O60 -","4","2","","Dey, Sandeep Kumar; Das, Gopal","Fluoride Selectivity Induced Transformation of Charged Anion Complexes into Unimolecular Capsule of a π-Acidic Triamide Receptor Stabilized by Strong N‒H···F‒and C‒H···F‒Hydrogen Bonds","Crystal Growth & Design","2011","11","10","4463","","10.1021/cg200679x","","","0.71073","MoKα","","0.1085","0.0565","","","0.136","0.1584","","","","","","0.951","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501054","15.1066","0.0006","20.5781","0.0008","22.96","0.0008","90","","102.365","0.002","90","","6971.9","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H26 Br N10 O16 -","- C27 H26 Br N10 O16 -","- C216 H208 Br8 N80 O128 -","8","2","","Dey, Sandeep Kumar; Das, Gopal","Fluoride Selectivity Induced Transformation of Charged Anion Complexes into Unimolecular Capsule of a π-Acidic Triamide Receptor Stabilized by Strong N‒H···F‒and C‒H···F‒Hydrogen Bonds","Crystal Growth & Design","2011","11","10","4463","","10.1021/cg200679x","","","0.71073","MoKα","","0.1445","0.0555","","","0.1456","0.1666","","","","","","0.901","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501055","11.2376","0.0009","11.5873","0.001","16.4312","0.0012","100.305","0.004","106.26","0.004","94.657","0.005","2001.2","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H33 Cl N10 O22 S -","- C29 H33 Cl N10 O22 S -","- C58 H66 Cl2 N20 O44 S2 -","2","1","","Dey, Sandeep Kumar; Das, Gopal","Fluoride Selectivity Induced Transformation of Charged Anion Complexes into Unimolecular Capsule of a π-Acidic Triamide Receptor Stabilized by Strong N‒H···F‒and C‒H···F‒Hydrogen Bonds","Crystal Growth & Design","2011","11","10","4463","","10.1021/cg200679x","","","0.71073","MoKα","","0.1163","0.0919","","","0.207","0.2428","","","","","","0.919","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501056","22.249","0.002","11.9035","0.0011","15.5067","0.0013","90","","112.327","0.005","90","","3798.9","0.6","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C29 H31 N10 O21 S2 -","- C29 H31 N10 O21 S2 -","- C116 H124 N40 O84 S8 -","4","1","","Dey, Sandeep Kumar; Das, Gopal","Fluoride Selectivity Induced Transformation of Charged Anion Complexes into Unimolecular Capsule of a π-Acidic Triamide Receptor Stabilized by Strong N‒H···F‒and C‒H···F‒Hydrogen Bonds","Crystal Growth & Design","2011","11","10","4463","","10.1021/cg200679x","","","0.71073","MoKα","","0.1015","0.0605","","","0.1432","0.1578","","","","","","0.998","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501057","9.8296","0.0006","19.1561","0.0013","19.1973","0.0013","61.201","0.003","83.109","0.004","89.652","0.004","3139.2","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H72 F N11 O21 S2 -","- C47 H72 F N11 O21 S2 -","- C94 H144 F2 N22 O42 S4 -","2","1","","Dey, Sandeep Kumar; Das, Gopal","Fluoride Selectivity Induced Transformation of Charged Anion Complexes into Unimolecular Capsule of a π-Acidic Triamide Receptor Stabilized by Strong N‒H···F‒and C‒H···F‒Hydrogen Bonds","Crystal Growth & Design","2011","11","10","4463","","10.1021/cg200679x","","","0.71073","MoKα","","0.1536","0.0914","","","0.1859","0.2449","","","","","","1.01","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501058","8.228","0.0012","13.663","0.002","11.852","0.003","90","","101.897","0.018","90","","1303.8","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-methylpyridinium picrate","","- C12 H10 N4 O7 -","- C12 H10 N4 O7 -","- C48 H40 N16 O28 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.1582","0.0646","","","0.1579","0.186","","","","","","0.897","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501059","8.2573","0.0014","24.472","0.003","8.1377","0.0013","90","","119.16","0.02","90","","1436","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-dimethylpyridinium picrate","","- C13 H12 N4 O7 -","- C13 H12 N4 O7 -","- C52 H48 N16 O28 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.1184","0.0966","","","0.2175","0.2263","","","","","","1.172","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501060","15.984","0.004","15.327","0.004","6.1356","0.0016","90","","90","","90","","1503.1","0.7","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3,5-dimethylpyridinium picrate","","- C13 H12 N4 O7 -","- C13 H12 N4 O7 -","- C52 H48 N16 O28 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.054","0.0364","","","0.0963","0.1027","","","","","","0.952","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501061","4.0152","0.0003","27.818","0.002","13.8747","0.001","90","","95.667","0.007","90","","1542.2","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-trimethylpyridinium picrate","","- C14 H14 N4 O7 -","- C14 H14 N4 O7 -","- C56 H56 N16 O28 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.1007","0.0407","","","0.0853","0.0957","","","","","","0.837","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501062","12.4255","0.0005","6.8019","0.0003","17.9141","0.0009","90","","95.388","0.004","90","","1507.36","0.12","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","quinolinium picrate","","- C15 H10 N4 O7 -","- C15 H10 N4 O7 -","- C60 H40 N16 O28 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0625","0.0412","","","0.1048","0.1118","","","","","","0.925","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501063","12.074","0.0009","29.58","0.002","3.9708","0.0004","90","","90","","90","","1418.2","0.2","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4-aminopyridinium picrate monohydrate","","- C11 H11 N5 O8 -","- C11 H11 N5 O8 -","- C44 H44 N20 O32 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.1336","0.0296","","","0.0187","0.0231","","","","","","0.608","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501064","8.2291","0.0004","13.59","0.0006","11.8469","0.0005","90","","102.013","0.004","90","","1295.87","0.1","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-aminopyridinium picrate","","- C11 H9 N5 O7 -","- C11 H9 N5 O7 -","- C44 H36 N20 O28 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0735","0.0462","","","0.1276","0.1358","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501065","31.4591","0.0016","29.417","0.0012","6.394","0.0003","90","","90","","90","","5917.2","0.5","295","2","295","2","","","","","","","","4","F d d 2","F 2 -2d","43","","2amino-3-nitropyridinium picrate","","- C11 H8 N6 O9 -","- C11 H8 N6 O9 -","- C176 H128 N96 O144 -","16","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0579","0.0335","","","0.0664","0.0704","","","","","","0.877","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501066","10.6595","0.0014","8.8","0.004","14.2786","0.0008","90","","96.352","0.01","90","","1331.2","0.6","295","2","295","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2amino-3-hydroxylpyridinium picrate","","- C11 H9 N5 O8 -","- C11 H9 N5 O8 -","- C44 H36 N20 O32 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0516","0.0408","","","0.1046","0.1077","","","","","","0.941","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501067","35.02","0.004","4.6148","0.0003","29.095","0.002","90","","142.052","0.003","90","","2891.5","0.5","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-pyridylmethylammonium picrate","","- C12 H11 N5 O7 -","- C12 H11 N5 O7 -","- C96 H88 N40 O56 -","8","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0632","0.0463","","","0.1329","0.1393","","","","","","1.027","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501068","4.0563","0.0002","11.071","0.0004","30.9908","0.0012","90","","90","","90","","1391.71","0.1","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-methoxypyrid-3-ylammonium picrate","","- C12 H11 N5 O8 -","- C12 H11 N5 O8 -","- C48 H44 N20 O32 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.052","0.0332","","","0.0702","0.095","","","","","","1.12","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501069","5.4207","0.0007","9.964","0.0015","27.53","0.004","90","","90.684","0.015","90","","1486.8","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-carboxylpyridinium picrate monohydrate","","- C12 H10 N4 O10 -","- C12 H10 N4 O10 -","- C48 H40 N16 O40 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0684","0.0484","","","0.121","0.1265","","","","","","1.037","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501070","15.8742","0.0013","6.7488","0.0003","15.7272","0.0011","90","","115.246","0.009","90","","1524","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-carboxylpyridinium picrate monohydrate","","- C12 H10 N4 O10 -","- C12 H10 N4 O10 -","- C48 H40 N16 O40 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.082","0.0381","","","0.0941","0.101","","","","","","0.805","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501071","9.6343","0.0004","11.6772","0.0005","17.4037","0.0008","88.539","0.004","84.668","0.004","85.152","0.003","1942.19","0.15","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","3-carboxylpyridinium picrate - nicotinic acid","","- C18 H13 N5 O11 -","- C18 H13 N5 O11 -","- C72 H52 N20 O44 -","4","2","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.06","0.036","","","0.0837","0.0884","","","","","","0.867","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501072","7.7574","0.0003","14.4873","0.0004","24.7349","0.0007","90","","90","","90","","2779.8","0.15","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-carbamoylpyridinium picrate","","- C12 H9 N5 O8 -","- C12 H9 N5 O8 -","- C96 H72 N40 O64 -","8","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0798","0.0469","","","0.1287","0.1397","","","","","","1.032","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501073","14.0787","0.0011","7.4927","0.0007","16.0945","0.0013","90","","116.394","0.008","90","","1520.8","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(methylcarboxyl)pyridinium picrate","","- C13 H10 N4 O9 -","- C13 H10 N4 O9 -","- C52 H40 N16 O36 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.1048","0.0583","","","0.1609","0.1762","","","","","","0.922","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501074","7.8229","0.0004","8.2179","0.0003","12.3931","0.0005","94.175","0.003","104.293","0.004","101.185","0.004","751.27","0.06","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","3-(methylcarboxyl)pyridinium picrate","","- C13 H10 N4 O9 -","- C13 H10 N4 O9 -","- C26 H20 N8 O18 -","2","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0407","0.0349","","","0.0902","0.0926","","","","","","1.067","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501075","8.0474","0.0004","8.9275","0.0003","13.1323","0.0006","93.371","0.003","100.517","0.004","94.688","0.003","921.89","0.07","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2-benzoylpyridinium picrate","","- C18 H12 N4 O8 -","- C18 H12 N4 O8 -","- C36 H24 N8 O16 -","2","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0464","0.0385","","","0.1118","0.1156","","","","","","1.176","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501076","7.5238","0.0013","10.989","0.002","22.047","0.004","90","","90.787","0.011","90","","1822.7","0.6","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-benzoylpyridinium picrate","","- C18 H12 N4 O8 -","- C18 H12 N4 O8 -","- C72 H48 N16 O32 -","4","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.0787","0.0518","","","0.1362","0.142","","","","","","1.142","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501077","7.2883","0.0006","8.2345","0.0008","12.1565","0.0012","97.118","0.008","106.61","0.008","91.114","0.007","692.59","0.12","293","2","295","2","","","","","","","","5","P -1","-P 1","2","","3-amino-2-chloropyridinium picrate","","- C11 H8 Cl N5 O7 -","- C11 H8 Cl N5 O7 -","- C22 H16 Cl2 N10 O14 -","2","1","","Stilinović, Vladimir; Kaitner, Branko","Hydrogen Bonding in Pyridinium Picrates: From Discrete Ion Pairs to 3D Networks","Crystal Growth & Design","2011","11","9","4110","","10.1021/cg200684x","","","0.71073","MoKα","","0.048","0.0413","","","0.1229","0.1269","","","","","","1.115","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501078","25.439","0.004","10.5693","0.0016","14.524","0.002","90","","90","","90","","3905.1","1","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C32 H44 Cd2 N6 O19 -","- C32 H40 Cd2 N6 O19 -","- C128 H160 Cd8 N24 O76 -","4","1","","Farnum, Gregory A.; Gandolfo, Chaun M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Aliphatic Tricarboxylate Dipyridylamine Coordination Polymers with New or Rare Binodal Topologies","Crystal Growth & Design","2011","11","11","4860","","10.1021/cg2006869","","","0.71073","MoKα","","0.0511","0.045","","","0.1033","0.1062","","","","","","1.115","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501079","7.726","0.003","8.87","0.003","14.216","0.005","84.897","0.004","79.723","0.004","73.883","0.004","920.1","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H36 Cd3 N6 O18 -","- C32 H36 Cd3 N6 O18 -","- C32 H36 Cd3 N6 O18 -","1","0.5","","Farnum, Gregory A.; Gandolfo, Chaun M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Aliphatic Tricarboxylate Dipyridylamine Coordination Polymers with New or Rare Binodal Topologies","Crystal Growth & Design","2011","11","11","4860","","10.1021/cg2006869","","","0.71073","MoKα","","0.0641","0.0486","","","0.1031","0.1099","","","","","","1.152","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501080","27.2048","0.0005","8.5966","0.0001","17.9747","0.0003","90","","122.954","0.001","90","","3527.37","0.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 N6 O14 Zn3 -","- C32 H32 N6 O14 Zn3 -","- C128 H128 N24 O56 Zn12 -","4","0.5","","Farnum, Gregory A.; Gandolfo, Chaun M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Aliphatic Tricarboxylate Dipyridylamine Coordination Polymers with New or Rare Binodal Topologies","Crystal Growth & Design","2011","11","11","4860","","10.1021/cg2006869","","","0.71073","MoKα","","0.0341","0.0279","","","0.0677","0.0705","","","","","","1.064","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501081","9.877","0.0006","10.7365","0.0006","15.2604","0.0009","90","","101.916","0.003","90","","1583.41","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 Cu N3 O6 -","- C16 H15 Cu N3 O6 -","- C64 H60 Cu4 N12 O24 -","4","1","","Farnum, Gregory A.; Gandolfo, Chaun M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Aliphatic Tricarboxylate Dipyridylamine Coordination Polymers with New or Rare Binodal Topologies","Crystal Growth & Design","2011","11","11","4860","","10.1021/cg2006869","","","0.71073","MoKα","","0.0683","0.0498","","","0.1075","0.1175","","","","","","1.034","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501082","8.15","0.004","12.611","0.006","13.746","0.007","110.023","0.014","105.456","0.015","98.199","0.015","1236","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H44 N2 O17 -","- C58 H40 N2 O16 -","- C58 H40 N2 O16 -","1","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1886","0.071","","","0.1395","0.1852","","","","","","0.785","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501083","8.154","0.003","13.877","0.005","22.904","0.009","82.541","0.011","87.688","0.012","73.624","0.012","2465.5","1.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H44 N2 O17 -","- C58 H39 N2 O16 -","- C116 H78 N4 O32 -","2","1","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1761","0.0801","","","0.2014","0.235","","","","","","1.06","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501084","8.0203","0.0011","12.7391","0.0018","14.0636","0.0019","114.499","0.004","100.823","0.004","98.386","0.004","1243.4","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H40 N2 O16 -","- C60 H40 N2 O16 -","- C60 H40 N2 O16 -","1","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1114","0.0568","","","0.1458","0.1698","","","","","","0.954","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501085","13.5901","0.0012","7.9936","0.0007","21.335","0.0019","90","","90.121","0.003","90","","2317.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C56 H38 N2 O16 -","- C56 H36 N2 O16 -","- C112 H72 N4 O32 -","2","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.0792","0.0546","","","0.1676","0.1809","","","","","","1.263","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501086","13.799","0.003","8.2058","0.0016","20.873","0.004","90","","90.402","0.006","90","","2363.4","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C58 H38 N2 O16 -","- C58 H38 N2 O16 -","- C116 H76 N4 O32 -","2","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1898","0.0758","","","0.1672","0.2153","","","","","","0.803","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501087","8.1441","0.0007","12.4229","0.0011","12.5539","0.0017","113.319","0.003","96.264","0.003","106.516","0.002","1082.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H36 N2 O18 -","- C42 H28 N2 O16 -","- C42 H28 N2 O16 -","1","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.0518","0.0441","","","0.1519","0.1584","","","","","","1.209","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501088","8.103","0.003","12.474","0.008","12.498","0.005","112.704","0.019","106.631","0.014","96.29","0.02","1081.5","0.9","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C49 H38 N2 O18 -","- C42 H28 N2 O16 -","- C42 H28 N2 O16 -","1","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.0609","0.0467","","","0.1435","0.155","","","","","","1.169","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501089","12.7869","0.001","14.4399","0.0012","14.8308","0.0012","116.417","0.002","96.957","0.002","109.554","0.002","2189.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C49 H38 N2 O18 -","- C49 H29 N2 O18 -","- C98 H58 N4 O36 -","2","1","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1331","0.0693","","","0.1665","0.1961","","","","","","0.907","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501090","12.872","0.003","14.222","0.004","14.895","0.006","115.035","0.01","96.909","0.01","110.169","0.007","2202.6","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C49 H38 N2 O18 -","- C42 H20 N2 O16 -","- C84 H40 N4 O32 -","2","1","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1194","0.0697","","","0.1747","0.1951","","","","","","0.985","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501091","8.0922","0.001","12.4611","0.0015","12.587","0.002","113.496","0.005","96.338","0.005","106.722","0.004","1077.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H33 Cl N2 O16 -","- C48 H28 Cl N2 O16 -","- C48 H28 Cl N2 O16 -","1","0.5","","Roy, Sandipan; Biradha, Kumar","Two-Component Supramolecular Organic Hosts as Colorimetric Indicators for Aromatic Guests: Visual Molecular Recognition via Cation−π Interactions","Crystal Growth & Design","2011","11","9","4120","","10.1021/cg200690c","","","0.71073","MoKα","","0.1418","0.0635","","","0.1455","0.1871","","","","","","0.958","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501092","9.82","0.007","15.382","0.004","17.779","0.008","90","","121.11","0.02","90","","2299","2","294","","294","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H15 Br2 Cl3 N2 S -","- C23 H15 Br2 Cl3 N2 S -","- C92 H60 Br8 Cl12 N8 S4 -","4","1","","Alshahateet, Solhe F.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Enhanced Guest Inclusion by a Sulfur-Containing Diquinoline Host","Crystal Growth & Design","2011","11","10","4474","","10.1021/cg2006937","","","0.71073","MoKα","","","0.036","","","","0.044","","","","","","1.3","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501093","9.969","0.006","23.061","0.006","10.47","0.007","90","","110.26","0.03","90","","2258","2","294","","294","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 Br2 Cl2 N2 S -","- C23 H16 Br2 Cl2 N2 S -","- C92 H64 Br8 Cl8 N8 S4 -","4","1","","Alshahateet, Solhe F.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Enhanced Guest Inclusion by a Sulfur-Containing Diquinoline Host","Crystal Growth & Design","2011","11","10","4474","","10.1021/cg2006937","","","0.71073","MoKα","","","0.053","","","","0.058","","","","","","1.68","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501094","9.487","0.004","12.439","0.003","18.869","0.008","90","","118.19","0.02","90","","1962.6","1.3","294","","294","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Br2 N2 O S -","- C22 H16 Br2 N2 O S -","- C88 H64 Br8 N8 O4 S4 -","4","1","","Alshahateet, Solhe F.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Enhanced Guest Inclusion by a Sulfur-Containing Diquinoline Host","Crystal Growth & Design","2011","11","10","4474","","10.1021/cg2006937","","","0.71073","MoKα","","","0.04","","","","0.047","","","","","","1.42","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501095","9.835","0.004","10.43","0.005","11.986","0.005","101.67","0.02","91.2","0.03","107.55","0.02","1143.6","0.9","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H18 Br2 N2 O S -","- C26 H18 Br2 N2 O S -","- C52 H36 Br4 N4 O2 S2 -","2","1","","Alshahateet, Solhe F.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Enhanced Guest Inclusion by a Sulfur-Containing Diquinoline Host","Crystal Growth & Design","2011","11","10","4474","","10.1021/cg2006937","","","0.71073","MoKα","","","0.045","","","","0.086","","","","","","1.79","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501096","10.05","0.004","23.143","0.008","10.601","0.005","90","","111.38","0.03","90","","2296","1.7","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 Br4 N2 S -","- C23 H16 Br4 N2 S -","- C92 H64 Br16 N8 S4 -","4","1","","Alshahateet, Solhe F.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Enhanced Guest Inclusion by a Sulfur-Containing Diquinoline Host","Crystal Growth & Design","2011","11","10","4474","","10.1021/cg2006937","","","0.71073","MoKα","","","0.06","","","","0.074","","","","","","1.7","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501097","18.882","0.008","7.719","0.003","13.205","0.005","90","","98.93","0.02","90","","1901.3","1.3","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 Br2 N2 S -","- C22 H14 Br2 N2 S -","- C88 H56 Br8 N8 S4 -","4","1","","Alshahateet, Solhe F.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Enhanced Guest Inclusion by a Sulfur-Containing Diquinoline Host","Crystal Growth & Design","2011","11","10","4474","","10.1021/cg2006937","","","0.71073","MoKα","","","0.038","","","","0.051","","","","","","1.69","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501098","19.323","0.005","84.57","0.02","5.0562","0.0013","90","","90","","90","","8263","4","173","2","173","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C18 H30 N2 O7 S -","- C18 H30 N2 O7 S -","- C288 H480 N32 O112 S16 -","16","1","","Sun, Di; Li, Yun-Hua; Hao, Hong-Jun; Liu, Fu-Jing; Wen, Yi-Mei; Huang, Rong-Bin; Zheng, Lan-Sun","Solvent-Controlled Rare Case of a Triple Helical Molecular Braid Assembled from Proton-Transferred Sebacic Acid","Crystal Growth & Design","2011","11","8","3323","","10.1021/cg2006953","","","0.71073","MoKα","","0.0546","0.0519","","","0.1261","0.1284","","","","","","1.043","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501099","7.283","0.003","10.528","0.004","10.592","0.004","108.699","0.006","103.443","0.006","107.806","0.005","681.5","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H34 N4 O6 S2 -","- C26 H34 N4 O6 S2 -","- C26 H34 N4 O6 S2 -","1","0.5","","Sun, Di; Li, Yun-Hua; Hao, Hong-Jun; Liu, Fu-Jing; Wen, Yi-Mei; Huang, Rong-Bin; Zheng, Lan-Sun","Solvent-Controlled Rare Case of a Triple Helical Molecular Braid Assembled from Proton-Transferred Sebacic Acid","Crystal Growth & Design","2011","11","8","3323","","10.1021/cg2006953","","","0.71073","MoKα","","0.0538","0.0453","","","0.1249","0.1299","","","","","","1.034","","","","has coordinates","179541","2020-10-21","18:00:00",""
"4501100","6.6247","0.0009","8.1841","0.001","31.834","0.004","87.327","0.004","87.833","0.003","89.486","0.004","1722.8","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H21 N O2 -","- C20 H21 N O2 -","- C80 H84 N4 O8 -","4","2","","Porada, Jan H.; Neudörfl, Jörg; Blunk, Dirk","Synthesis and Supramolecular Organization of 5-(4-Alkylphenyl)isatin","Crystal Growth & Design","2011","11","8","3648","","10.1021/cg200700r","","","0.71073","MoKα","","0.1449","0.053","","","0.1116","0.1473","","","","","","0.968","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501101","27.5139","0.0002","27.5139","0.0002","27.5139","0.0002","90","","90","","90","","20828.4","0.3","150","2","150","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C156 H204 Cl6 Co6 N42 O72 -","- C156 H132 Cl6 Co6 N42 O72 -","- C624 H528 Cl24 Co24 N168 O288 -","4","0.166667","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","1.54178","CuKα","","0.145","0.0888","","","0.2043","0.2282","","","","","","1.067","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501102","27.4578","0.0003","27.4578","0.0003","27.4578","0.0003","90","","90","","90","","20701.3","0.4","571","2","571","2","","","","","","","","8","P a -3","-P 2ac 2ab 3","205","","","","- C157 H151 B6 Cl3 Co6 F24 N42 O21 -","- C157 H133 B6 Cl3 Co6 F24 N42 O21 -","- C628 H532 B24 Cl12 Co24 F96 N168 O84 -","4","0.166667","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","0.71073","MoKα","","0.2071","0.1216","","","0.2637","0.3094","","","","","","1.056","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501103","27.689","0.005","27.689","0.005","27.689","0.005","90","0.005","90","0.005","90","0.005","21229","7","293","2","293","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C316 H328 Cl24 N84 O102 Zn12 -","- C316 H268 Cl24 N84 O102 Zn12 -","- C632 H536 Cl48 N168 O204 Zn24 -","2","0.0833333","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","0.71069","MoKα","","0.156","0.0589","","","0.1287","0.1411","","","","","","1.006","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501104","27.314","0.0001","27.314","0.0001","27.314","0.0001","90","","90","","90","","20377.7","0.13","150","2","150","2","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C156 H236 B6 F24 N42 O64 Zn6 -","- C156 H132 B6 F24 N42 O64 Zn6 -","- C624 H528 B24 F96 N168 O256 Zn24 -","4","0.166667","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","0.71073","MoKα","","0.1174","0.0678","","","0.1846","0.198","","","","","","0.968","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501105","12.976","0.003","18.312","0.004","12.976","0.004","90","","93.68","","90","","3077","1.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H60 Cl2 N14 Ni2 O18 -","- C54 H56 Cl2 N14 Ni2 O18 -","- C108 H112 Cl4 N28 Ni4 O36 -","2","0.5","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","0.71073","MoKα","","0.1205","0.0687","","","0.1726","0.2158","","","","","","1.036","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501106","12.7327","0.0002","18.3419","0.0003","13.1949","0.0003","90","","93.415","0.002","90","","3076.09","0.1","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H64 B2 F8 N14 Ni2 O10 -","- C56 H64 B2 F8 N14 Ni2 O10 -","- C112 H128 B4 F16 N28 Ni4 O20 -","2","0.5","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","0.71073","MoKα","","0.0585","0.0452","","","0.1025","0.109","","","","","","1.05","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501107","11.9528","0.0003","12.8507","0.0002","18.566","0.0004","90","","100.913","0.002","90","","2800.2","0.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Cl Mn N7 O8 -","- C27 H27 Cl Mn N7 O8 -","- C108 H108 Cl4 Mn4 N28 O32 -","4","1","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","1.54178","CuKα","","0.0673","0.0467","","","0.1299","0.1499","","","","","","0.985","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501108","11.9008","0.0007","12.8446","0.0005","18.4671","0.0009","90","","101.537","0.005","90","","2765.9","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 B F4 Mn N7 O4 -","- C27 H25 B F4 Mn N7 O4 -","- C108 H100 B4 F16 Mn4 N28 O16 -","4","1","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","0.71073","MoKα","","0.1434","0.0623","","","0.1164","0.1331","","","","","","0.918","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501109","11.9593","0.0003","13.0459","0.0002","18.4832","0.0003","90","","100.952","0.002","90","","2831.22","0.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Cd Cl N7 O8 -","- C27 H28 Cd Cl N7 O8 -","- C108 H112 Cd4 Cl4 N28 O32 -","4","1","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","1.54178","CuKα","","0.0636","0.0478","","","0.1087","0.1176","","","","","","1.095","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501110","11.8611","0.0005","13.0368","0.0003","18.4127","0.0005","90","","101.432","0.004","90","","2790.68","0.16","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 B Cd F4 N7 O4 -","- C27 H25 B Cd F4 N7 O4 -","- C108 H100 B4 Cd4 F16 N28 O16 -","4","1","","Liu, Yu; Pan, Mei; Li, Kang; Yan, Cheng; Shen, Yong; Zhao, Cun-Yuan; Wang, Wei; Su, Cheng-Yong","Metal-Directed Assembly of Hexameric Ring, Dimeric Ring and 1D Chain from a Branched Tripodal Ligand","Crystal Growth & Design","2011","11","11","4876","","10.1021/cg200701j","","","1.54178","CuKα","","0.0786","0.0495","","","0.1188","0.1365","","","","","","0.969","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501111","6.4339","0.0005","27.667","0.003","9.9155","0.001","90","","90.12","0.007","90","","1765","0.3","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Ca N2 O10 -","- C14 H22 Ca N2 O10 -","- C56 H88 Ca4 N8 O40 -","4","1","","Morrison, Christine N.; Powell, Annie K.; Kostakis, George E.","Influence of Metal Ion on Structural Motif in Coordination Polymers of the Pseudopeptidic Ligand Terephthaloyl-bis-beta-alaninate","Crystal Growth & Design","2011","11","8","3653","","10.1021/cg2007028","","","0.71073","MoKα","","0.0432","0.0288","","","0.0588","0.0609","","","","","","0.976","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501112","17.442","0.002","10.201","0.0014","9.7027","0.0011","90","","102.073","0.009","90","","1688.2","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 Mn N2 O9 -","- C14 H20 Mn N2 O9 -","- C56 H80 Mn4 N8 O36 -","4","1","","Morrison, Christine N.; Powell, Annie K.; Kostakis, George E.","Influence of Metal Ion on Structural Motif in Coordination Polymers of the Pseudopeptidic Ligand Terephthaloyl-bis-beta-alaninate","Crystal Growth & Design","2011","11","8","3653","","10.1021/cg2007028","","","0.71073","MoKα","","0.1809","0.0597","","","0.0869","0.1256","","","","","","0.95","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501113","11.082","0.0013","5.1509","0.0004","17.908","0.002","90","","109.81","0.009","90","","961.74","0.18","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H26 Co N2 O12 -","- C14 H26 Co N2 O12 -","- C28 H52 Co2 N4 O24 -","2","0.5","","Morrison, Christine N.; Powell, Annie K.; Kostakis, George E.","Influence of Metal Ion on Structural Motif in Coordination Polymers of the Pseudopeptidic Ligand Terephthaloyl-bis-beta-alaninate","Crystal Growth & Design","2011","11","8","3653","","10.1021/cg2007028","","","0.71073","MoKα","","0.0243","0.0227","","","0.0663","0.0671","","","","","","1","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501114","9.6718","0.0012","9.9337","0.0012","12.0896","0.0016","78.799","0.01","68.774","0.009","73.441","0.01","1032.4","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H28 N2 O13 Zn -","- C14 H28 N2 O13 Zn -","- C28 H56 N4 O26 Zn2 -","2","1","","Morrison, Christine N.; Powell, Annie K.; Kostakis, George E.","Influence of Metal Ion on Structural Motif in Coordination Polymers of the Pseudopeptidic Ligand Terephthaloyl-bis-beta-alaninate","Crystal Growth & Design","2011","11","8","3653","","10.1021/cg2007028","","","0.71073","MoKα","","0.0436","0.0274","","","0.0597","0.0625","","","","","","0.987","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501115","7.7321","0.0009","16.199","0.0019","19.558","0.003","90","","101.095","0.012","90","","2403.9","0.6","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H26 O8 -","- C27 H26 O8 -","- C108 H104 O32 -","4","1","","Sanphui, Palash; Goud, N. Rajesh; Khandavilli, U. B. Rao; Nangia, Ashwini","Fast Dissolving Curcumin Cocrystals","Crystal Growth & Design","2011","11","9","4135","","10.1021/cg200704s","","","0.71073","MoKα","","0.1308","0.0687","","","0.1801","0.2029","","","","","","0.983","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501116","7.3706","0.0006","15.8001","0.001","19.8972","0.0014","90","","92.933","0.007","90","","2314.1","0.3","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C27 H26 O9 -","- C27 H26 O9 -","- C108 H104 O36 -","4","1","","Sanphui, Palash; Goud, N. Rajesh; Khandavilli, U. B. Rao; Nangia, Ashwini","Fast Dissolving Curcumin Cocrystals","Crystal Growth & Design","2011","11","9","4135","","10.1021/cg200704s","","","0.71073","MoKα","","0.167","0.0923","","","0.2304","0.2867","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501117","20.6238","0.0006","16.4559","0.0003","21.8274","0.0006","90","","112.992","0.003","90","","6819.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H69 Cu2 N21 O19.5 S4 -","- C56 H64 Cu2 N21 O19.5 S4 -","- C224 H256 Cu8 N84 O78 S16 -","4","1","","Chen, Chun; Ma, Jian-Fang; Liu, Bo; Yang, Jin; Liu, Ying-Ying","Two Unusual 3D Copper(II) Coordination Polymers Constructed by p-Sulfonated Calixarenes and Bis(triazolyl) Ligands","Crystal Growth & Design","2011","11","10","4491","","10.1021/cg2007167","","","0.71073","MoKα","","0.076","0.0371","","","0.0781","0.0832","","","","","","0.823","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501118","13.6903","0.0012","13.2671","0.0012","37.029","0.003","90","","99.371","0.002","90","","6635.8","1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C96 H123 Cu5 N30 O47.5 S8 -","- C96 H72 Cu5 N30 O47.5 S8 -","- C192 H144 Cu10 N60 O95 S16 -","2","0.5","","Chen, Chun; Ma, Jian-Fang; Liu, Bo; Yang, Jin; Liu, Ying-Ying","Two Unusual 3D Copper(II) Coordination Polymers Constructed by p-Sulfonated Calixarenes and Bis(triazolyl) Ligands","Crystal Growth & Design","2011","11","10","4491","","10.1021/cg2007167","","","0.71073","MoKα","","0.1228","0.0721","","","0.1694","0.193","","","","","","1.174","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501119","7.0917","0.0013","12.28","0.003","11.4693","0.0018","90","","90","","90","","998.8","0.3","296","2","293","2","1013.25","","","","","","","4","C m c 21","C 2c -2","36","1,4-diazabicyclo[2.2.2]octane dihydrobromide, dabco dihydrobromide, dabco2HBr","1,4-diazabicyclo[2.2.2]octane dihydrobromide","","- C6 H14 Br2 N2 -","- C6 H14 Br2 N2 -","- C24 H56 Br8 N8 -","4","0.5","","Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej","Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate","Crystal Growth & Design","2011","11","11","4892","","10.1021/cg200743n","","","0.71073","MoKα","","0.186","0.1259","","","0.3407","0.3557","","","","","","1.175","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501120","14.3848","0.0018","12.4619","0.0012","11.3029","0.0011","90","","90","","90","","2026.2","0.4","296","2","296","2","","","","","","","","5","P b c 21","P 2c -2b","29","1,4-diazabicyclo[2.2.2]octane dihydrobromide semihydrate, dabco2HBr*0.5H2O","1,4-diazabicyclo[2.2.2]octane dihydrobromide semihydrate","","- C6 H15 Br2 N2 O0.5 -","- C6 H15 Br2 N2 O0.5 -","- C48 H120 Br16 N16 O4 -","8","2","","Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej","Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate","Crystal Growth & Design","2011","11","11","4892","","10.1021/cg200743n","","","0.71073","MoKα","","0.0645","0.0355","","","0.0572","0.0595","","","","","","0.972","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501121","15.015","0.003","12.486","0.002","11.2364","0.0016","90","","90","","90","","2106.6","0.6","293","2","296","2","","","","","","","","5","P b c 21","P 2c -2b","29","dabco dihydrobromide monohydrate, dabco2HBr*H2O","1,4-diazabicyclo[2.2.2]octane dihydrobromide monohydrate","","- C6 H16 Br2 N2 O -","- C6 H16 Br2 N2 O -","- C48 H128 Br16 N16 O8 -","8","2","","Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej","Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate","Crystal Growth & Design","2011","11","11","4892","","10.1021/cg200743n","","","0.71073","MoKα","","0.1705","0.1059","","","0.3029","0.3203","","","","","","0.99","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501122","7.185","0.003","12.382","0.006","11.119","0.003","90","","90","","90","","989.2","0.7","296","2","296","2","480000","","","","","","","5","C m c 21","C 2c -2","36","dabco dihydrobromide monohydrate, dabco2HBr*H2O","1,4-diazabicyclo[2.2.2]octane dihydrobromide monohydrate","","- C6 H16 Br2 N2 O -","- C6 H16 Br2 N2 O -","- C24 H64 Br8 N8 O4 -","4","0.5","","Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej","Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate","Crystal Growth & Design","2011","11","11","4892","","10.1021/cg200743n","","","0.71073","MoKα","","0.0845","0.064","","","0.1349","0.1446","","","","","","1.102","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501123","6.516","0.004","12.037","0.003","6.792","0.003","90","","113.06","0.05","90","","490.2","0.4","296","2","296","2","780000","","","","","","","5","P 1 21 1","P 2yb","4","dabco dihydrobromide monohydrate, dabco2HBr*H2O","1,4-diazabicyclo[2.2.2]octane dihydrobromide monohydrate","","- C6 H16 Br2 N2 O -","- C6 H16 Br2 N2 O -","- C12 H32 Br4 N4 O2 -","2","1","","Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej","Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate","Crystal Growth & Design","2011","11","11","4892","","10.1021/cg200743n","","","0.71073","MoKα","","0.049","0.0322","","","0.0577","0.0617","","","","","","1.009","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501124","7.2844","0.0019","10.918","0.004","5.663","0.004","90","","90","","90","","450.4","0.4","296","2","296","2","1500000","","","","","","","5","P m m n :2","-P 2ab 2a","59","dabco dihydrobromide monohydrate, dabco2HBr*H2O","1,4-diazabicyclo[2.2.2]octane dihydrobromide monohydrate","","- C6 H16 Br2 N2 O -","- C6 H16 Br2 N2 O -","- C12 H32 Br4 N4 O2 -","2","0.25","","Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej","Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate","Crystal Growth & Design","2011","11","11","4892","","10.1021/cg200743n","","","0.71073","MoKα","","0.0608","0.0532","","","0.1308","0.1396","","","","","","1.175","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501125","14.707","0.011","11.252","0.008","16.704","0.009","90","","117.08","0.05","90","","2461","3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 Cu2 N2 O9 -","- C26 H16 Cu2 N2 O8.999 -","- C104 H64 Cu8 N8 O35.996 -","4","0.5","","Tian, Hua; Wang, Kun; Jia, Qin-Xiang; Sun, Qian; Ma, Yu; Gao, En-Qing","Selective Incorporation of Auxiliary Organic Ligands in Metal‒Organic Frameworks Based on Twisted Π-Shaped Building Blocks","Crystal Growth & Design","2011","11","12","5167","","10.1021/cg200752v","","","0.71073","MoKα","","0.0441","0.0379","","","0.1137","0.1159","","","","","","1.236","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501126","14.8192","0.0005","11.0158","0.0004","16.5703","0.0007","90","","115.472","0.001","90","","2442.08","0.16","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H18 Cu2 N2 O9 -","- C28 H16 Cu2 N2 O9 -","- C112 H64 Cu8 N8 O36 -","4","0.5","","Tian, Hua; Wang, Kun; Jia, Qin-Xiang; Sun, Qian; Ma, Yu; Gao, En-Qing","Selective Incorporation of Auxiliary Organic Ligands in Metal‒Organic Frameworks Based on Twisted Π-Shaped Building Blocks","Crystal Growth & Design","2011","11","12","5167","","10.1021/cg200752v","","","0.71073","MoKα","","0.0405","0.0368","","","0.103","0.1067","","","","","","1.178","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501127","14.7964","0.0006","11.0068","0.0005","16.5455","0.001","90","","115.37","0.001","90","","2434.7","0.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 Cu2 N2 O9 -","- C28 H18 Cu2 N2 O9 -","- C112 H72 Cu8 N8 O36 -","4","0.5","","Tian, Hua; Wang, Kun; Jia, Qin-Xiang; Sun, Qian; Ma, Yu; Gao, En-Qing","Selective Incorporation of Auxiliary Organic Ligands in Metal‒Organic Frameworks Based on Twisted Π-Shaped Building Blocks","Crystal Growth & Design","2011","11","12","5167","","10.1021/cg200752v","","","0.71073","MoKα","","0.0795","0.0462","","","0.1182","0.1388","","","","","","1.034","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501128","14.5281","0.001","21.3432","0.0011","24.6908","0.0013","90","","118.168","0.003","90","","6749.3","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H64 N2 Ni2 O12 S20 -","- C50 H64 N2 Ni2 O12 S20 -","- C200 H256 N8 Ni8 O48 S80 -","4","1","","Ye, Qiong; Akutagawa, Tomoyuki; Hoshino, Norihisa; Kikuchi, Takemitsu; Noro, Shin-ichiro; Xiong, Ren-Gen; Nakamura, Takayoshi","Polymorphs and Structural Phase Transition of [Ni(dmit)2]−Crystals Induced by Flexible (trans-Cyclohexane-1,4-diammonium)(Benzo[18]crown-6)2Supramolecule","Crystal Growth & Design","2011","11","9","4175","","10.1021/cg2007556","","","0.71075","MoKα","","0.25","0.0832","","","0.1463","0.2075","","","","","","0.888","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501129","10.6","0.0008","12.8561","0.0011","12.9623","0.0011","82.258","0.003","79.614","0.003","89.305","0.003","1721.5","0.2","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H32 N Ni O6 S10 -","- C25 H32 N Ni O6 S10 -","- C50 H64 N2 Ni2 O12 S20 -","2","1","","Ye, Qiong; Akutagawa, Tomoyuki; Hoshino, Norihisa; Kikuchi, Takemitsu; Noro, Shin-ichiro; Xiong, Ren-Gen; Nakamura, Takayoshi","Polymorphs and Structural Phase Transition of [Ni(dmit)2]−Crystals Induced by Flexible (trans-Cyclohexane-1,4-diammonium)(Benzo[18]crown-6)2Supramolecule","Crystal Growth & Design","2011","11","9","4175","","10.1021/cg2007556","","","0.71075","MoKα","","","0.0403","","","","0.0616","","","","","","1.163","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501130","11.6603","0.0012","13.1917","0.0011","13.4851","0.0012","108.129","0.002","108.401","0.003","103.634","0.003","1737.5","0.3","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H32 N Ni O6 S10 -","- C25 H28 N Ni O6 S10 -","- C50 H56 N2 Ni2 O12 S20 -","2","1","","Ye, Qiong; Akutagawa, Tomoyuki; Hoshino, Norihisa; Kikuchi, Takemitsu; Noro, Shin-ichiro; Xiong, Ren-Gen; Nakamura, Takayoshi","Polymorphs and Structural Phase Transition of [Ni(dmit)2]−Crystals Induced by Flexible (trans-Cyclohexane-1,4-diammonium)(Benzo[18]crown-6)2Supramolecule","Crystal Growth & Design","2011","11","9","4175","","10.1021/cg2007556","","","0.71075","MoKα","","","0.0409","","","","0.1317","","","","","","1.083","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501131","11.5343","0.0008","13.4589","0.0008","23.1051","0.0011","95.3729","0.0017","91.0352","0.0019","108.93","0.0019","3373.4","0.3","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C50 H64 N2 Ni2 O12 S20 -","- C50 H64 N2 Ni2 O12 S20 -","- C100 H128 N4 Ni4 O24 S40 -","2","1","","Ye, Qiong; Akutagawa, Tomoyuki; Hoshino, Norihisa; Kikuchi, Takemitsu; Noro, Shin-ichiro; Xiong, Ren-Gen; Nakamura, Takayoshi","Polymorphs and Structural Phase Transition of [Ni(dmit)2]−Crystals Induced by Flexible (trans-Cyclohexane-1,4-diammonium)(Benzo[18]crown-6)2Supramolecule","Crystal Growth & Design","2011","11","9","4175","","10.1021/cg2007556","","","0.71075","MoKα","","","0.0398","","","","0.0967","","","","","","1.029","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501132","14.7264","0.0006","14.7264","0.0006","14.7264","0.0006","90","","90","","90","","3193.7","0.2","200","2","200","2","","","","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","","","","- K17.7 Si136 -","- K17.776 Si136 -","- K17.776 Si136 -","1","0.00520833","","Stefanoski, Stevce; Nolas, George S.","Synthesis and Structural Characterization of Single-Crystal K7.5Si46and K17.8Si136Clathrates","Crystal Growth & Design","2011","11","10","4533","","10.1021/cg200756r","","","0.71073","MoKα","","0.0294","0.022","","","0.0547","0.0563","","","","","","1.007","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501133","10.2639","0.0003","10.2639","0.0003","10.2639","0.0003","90","","90","","90","","1081.28","0.05","200","2","200","2","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- K7.46 Si46 -","- K7.464 Si46 -","- K7.464 Si46 -","1","0.0208333","","Stefanoski, Stevce; Nolas, George S.","Synthesis and Structural Characterization of Single-Crystal K7.5Si46and K17.8Si136Clathrates","Crystal Growth & Design","2011","11","10","4533","","10.1021/cg200756r","","","0.71073","MoKα","","0.0131","0.0129","","","0.0337","0.0338","","","","","","1.183","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501134","4.358","0.005","29.45","0.03","6.076","0.005","90","","110.62","0.08","90","","729.9","1.3","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C16 H14 N4 O2 -","- C16 H14 N4 O2 -","- C32 H28 N8 O4 -","2","1","","Prohens, Rafel; Portell, Anna; Puigjaner, Cristina; Tomàs, Salvador; Fujii, Kotaro; Harris, Kenneth D. M.; Alcobé, Xavier; Font-Bardia, Mercè; Barbas, Rafael","Cooperativity in Solid-State Squaramides","Crystal Growth & Design","2011","11","9","3725","","10.1021/cg200772e","","","0.71073","MoKα","","0.093","0.0699","","","0.2093","0.2223","","","","","","1.17","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501135","6.03426","0.00025","10.9211","0.0005","11.9179","0.0006","93.0202","0.0026","103.176","0.0026","92.4776","0.0034","762.43","0.06","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H7 N2 O -","- C8 H7 N2 O -","- C32 H28 N8 O4 -","4","2","","Prohens, Rafel; Portell, Anna; Puigjaner, Cristina; Tomàs, Salvador; Fujii, Kotaro; Harris, Kenneth D. M.; Alcobé, Xavier; Font-Bardia, Mercè; Barbas, Rafael","Cooperativity in Solid-State Squaramides","Crystal Growth & Design","2011","11","9","3725","","10.1021/cg200772e","powder diffraction","x-ray","1.5406","Kα~1~","","","","","","","","0.12563","","2.3","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501136","7.057","0.003","14.776","0.006","15.408","0.006","66.479","0.012","81.914","0.014","80.739","0.014","1448.8","1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","3,4,5-trichlorophenol_100K","","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C48 H24 Cl24 O8 -","8","4","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0444","0.0384","","","0.0859","0.0978","","","","","","1.092","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501137","7.086","0.003","14.79","0.006","15.432","0.006","66.489","0.008","81.896","0.013","80.674","0.014","1458.2","1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","3,4,5-trichlorophenol_150K","","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C48 H24 Cl24 O8 -","8","4","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0482","0.0404","","","0.0919","0.105","","","","","","1.09","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501138","7.123","0.004","14.809","0.007","15.437","0.007","66.514","0.017","81.938","0.019","80.525","0.018","1468.1","1.3","200","2","200","2","","","","","","","","4","P -1","-P 1","2","3,4,5-trichlorophenol_200K","","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C48 H24 Cl24 O8 -","8","4","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0538","0.0424","","","0.0929","0.1081","","","","","","1.086","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501139","7.168","0.003","14.836","0.007","15.473","0.008","66.562","0.01","81.888","0.016","80.459","0.017","1483.7","1.2","250","2","250","2","","","","","","","","4","P -1","-P 1","2","3,4,5-trichlorophenol_250K","","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C48 H24 Cl24 O8 -","8","4","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0621","0.0467","","","0.106","0.1201","","","","","","1.092","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501140","7.233","0.005","14.89","0.008","15.528","0.008","66.55","0.02","81.9","0.02","80.25","0.02","1507.1","1.5","300","2","300","2","","","","","","","","4","P -1","-P 1","2","3,4,5-trichlorophenol_300K","","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C48 H24 Cl24 O8 -","8","4","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0755","0.0524","","","0.1127","0.1349","","","","","","1.085","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501141","3.801","0.0006","12.7973","0.0017","14.816","0.003","90","","96.902","0.007","90","","715.5","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,3,4-Trichlorophenol","","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C24 H12 Cl12 O4 -","4","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0363","0.0326","","","0.0842","0.1027","","","","","","1.159","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501142","32.389","0.003","32.389","0.003","3.8113","0.0006","90","","90","","120","","3462.6","0.7","150","2","150","2","","","","","","","","4","R -3 :H","-R 3","148","2,3,4-trichlorophenol: MeOH","","","- C7 H3 Cl3 O1.33333 -","- C7 H3 Cl3 O1.33333 -","- C126 H54 Cl54 O24 -","18","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0507","0.0453","","","0.1173","0.1275","","","","","","1.162","","","","has coordinates","268283","2021-08-30","06:31:23",""
"4501143","13.483","0.0014","12.2021","0.0012","16.7125","0.0017","90","","90","","90","","2749.6","0.5","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","4-chlorophenol: 3,4,5-trichlorophenol","","","- C24 H14 Cl10 O4 -","- C24 H14 Cl10 O4 -","- C96 H56 Cl40 O16 -","4","1","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0395","0.0382","","","0.1121","0.113","","","","","","1.18","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501144","7.53","0.0009","14.203","0.0017","14.574","0.0017","81.459","0.006","80.154","0.006","78.092","0.006","1492.3","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","2,3,4-trichlorophenol: 3,4,5-trichlorophenol","","","- C12 H6 Cl6 O2 -","- C12 H6 Cl6 O2 -","- C48 H24 Cl24 O8 -","4","2","","Mukherjee, Arijit; Desiraju, Gautam R.","Halogen Bonding and Structural Modularity in 2,3,4- and 3,4,5-Trichlorophenol","Crystal Growth & Design","2011","11","9","3735","","10.1021/cg2007815","","","0.71073","MoKα","","0.0767","0.0566","","","0.1278","0.1376","","","","","","1.061","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501145","13.005","0.002","16.031","0.003","8.1275","0.0014","90","","98.51","0.002","90","","1675.8","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 Cl4 O6 Pb -","- C10 H8 Cl4 O6 Pb -","- C40 H32 Cl16 O24 Pb4 -","4","0.5","","Chen, Sheng-Chun; Zhang, Zhi-Hui; Zhou, Yong-Sheng; Zhou, Wei-You; Li, Yi-Zhi; He, Ming-Yang; Chen, Qun; Du, Miao","Alkali-Metal-Templated Assemblies of New 3D Lead(II) Tetrachloroterephthalate Coordination Frameworks","Crystal Growth & Design","2011","11","9","4190","","10.1021/cg200785g","","","0.71073","MoKα","","0.0264","0.0226","","","0.0489","0.0501","","","","","","1.037","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501146","15.936","0.0014","12.7172","0.0019","8.2753","0.0013","90","","91.752","0.002","90","","1676.3","0.4","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H4 Cl4 Li2 O7 Pb -","- C8 H4 Cl4 Li2 O7 Pb -","- C32 H16 Cl16 Li8 O28 Pb4 -","4","0.5","","Chen, Sheng-Chun; Zhang, Zhi-Hui; Zhou, Yong-Sheng; Zhou, Wei-You; Li, Yi-Zhi; He, Ming-Yang; Chen, Qun; Du, Miao","Alkali-Metal-Templated Assemblies of New 3D Lead(II) Tetrachloroterephthalate Coordination Frameworks","Crystal Growth & Design","2011","11","9","4190","","10.1021/cg200785g","","","0.71073","MoKα","","0.0457","0.0372","","","0.0702","0.0722","","","","","","1.058","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501147","15.898","0.002","12.678","0.003","8.264","0.003","90","","90.136","0.003","90","","1665.6","0.8","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H2 Cl4 Na2 O6 Pb -","- C8 H2 Cl4 Na2 O6 Pb -","- C32 H8 Cl16 Na8 O24 Pb4 -","4","0.5","","Chen, Sheng-Chun; Zhang, Zhi-Hui; Zhou, Yong-Sheng; Zhou, Wei-You; Li, Yi-Zhi; He, Ming-Yang; Chen, Qun; Du, Miao","Alkali-Metal-Templated Assemblies of New 3D Lead(II) Tetrachloroterephthalate Coordination Frameworks","Crystal Growth & Design","2011","11","9","4190","","10.1021/cg200785g","","","0.71073","MoKα","","0.0402","0.0309","","","0.0548","0.0562","","","","","","0.943","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501148","10.4348","0.0007","19.3313","0.0012","18.8959","0.0014","90","","105.998","0.001","90","","3664","0.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H21 Cl8 N3 O11 Pb2 -","- C25 H21 Cl8 N3 O11 Pb2 -","- C100 H84 Cl32 N12 O44 Pb8 -","4","1","","Chen, Sheng-Chun; Zhang, Zhi-Hui; Zhou, Yong-Sheng; Zhou, Wei-You; Li, Yi-Zhi; He, Ming-Yang; Chen, Qun; Du, Miao","Alkali-Metal-Templated Assemblies of New 3D Lead(II) Tetrachloroterephthalate Coordination Frameworks","Crystal Growth & Design","2011","11","9","4190","","10.1021/cg200785g","","","0.71073","MoKα","","0.0679","0.0358","","","0.0712","0.0804","","","","","","1.018","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501149","8.0111","0.0006","30.61","0.003","18.4518","0.0018","90","","97.264","0.004","90","","4488.4","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32.5 H20 N4 O0.5 -","- C32.5 H20 N4 O0.5 -","- C260 H160 N32 O4 -","8","2","","Roy, Xavier; Chong, Jonathan H.; Patrick, Brian O.; MacLachlan, Mark J.","Molecular Scaffolding of Prussian Blue Analogues Using a Phenanthroline-Extended Triptycene Ligand","Crystal Growth & Design","2011","11","10","4551","","10.1021/cg200788f","","","0.71073","MoKα","","0.1438","0.0531","","","0.0915","0.1182","","","","","","0.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501150","88.779","0.012","8.234","0.0011","27.418","0.004","90","","102.617","0.001","90","","19559","5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C128 H72 Cl4 Cu4 N16 O -","- C128 H72 Cl4 Cu4 N16 O0.5 -","- C1024 H576 Cl32 Cu32 N128 O4 -","8","1","","Roy, Xavier; Chong, Jonathan H.; Patrick, Brian O.; MacLachlan, Mark J.","Molecular Scaffolding of Prussian Blue Analogues Using a Phenanthroline-Extended Triptycene Ligand","Crystal Growth & Design","2011","11","10","4551","","10.1021/cg200788f","","","0.7749","","","0.0902","0.0526","","","0.1192","0.139","","","","","","0.994","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501151","15.5766","0.0014","27.39","0.003","13.5697","0.0012","90","","96.227","0.003","90","","5755.3","1","90","0.1","90","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C69.5 H49 Cu2.5 N9.5 O1.5 -","- C69.526 H48.104 Cu2.5 N10.5 O3.526 -","- C278.104 H192.416 Cu10 N42 O14.104 -","4","1","","Roy, Xavier; Chong, Jonathan H.; Patrick, Brian O.; MacLachlan, Mark J.","Molecular Scaffolding of Prussian Blue Analogues Using a Phenanthroline-Extended Triptycene Ligand","Crystal Growth & Design","2011","11","10","4551","","10.1021/cg200788f","","","1.54178","CuKα","","0.0816","0.0733","","","0.1944","0.2011","","","","","","1.126","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501152","8.392","0.004","12.451","0.006","29.364","0.014","90","","93.075","0.009","90","","3064","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H56 Cu4 Mo6 N16 O22 -","- C40 H56 Cu4 Mo6 N16 O22 -","- C80 H112 Cu8 Mo12 N32 O44 -","2","0.5","","Xie, Yi-Ming; Yu, Rong-Ming; Wu, Xiao-Yuan; Wang, Fei; Zhang, Jian; Lu, Can-Zhong","Synthesis, Structure, and Magnetic Properties of a Novel Polyoxometalate‒Organic Framework with Unusual (5,6)-Connected Topology","Crystal Growth & Design","2011","11","11","4739","","10.1021/cg200791k","","","0.71073","MoKα","","0.0983","0.0758","","","0.1885","0.2078","","","","","","1.04","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501153","5.1842","0.0005","8.5087","0.0009","19.5787","0.0019","89.508","0.006","85.077","0.007","80.522","0.006","848.69","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H38 N4 O10 Zn -","- C36 H38 N4 O10 Zn -","- C36 H38 N4 O10 Zn -","1","0.5","","Hogan, Greg A.; Rath, Nigam P.; Beatty, Alicia M.","A Stable Hydrogen-Bonded Coordination Network with Removable Guests","Crystal Growth & Design","2011","11","9","3740","","10.1021/cg200793f","","","0.71073","MoKα","","0.051","0.0407","","","0.0981","0.1039","","","","","","1.031","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501154","5.2035","0.0002","8.3292","0.0003","19.7543","0.0007","90.091","0.001","94.646","0.001","100.087","0.001","840.06","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H33 N5 O12 Zn -","- C34 H33 N5 O12 Zn -","- C34 H33 N5 O12 Zn -","1","0.5","","Hogan, Greg A.; Rath, Nigam P.; Beatty, Alicia M.","A Stable Hydrogen-Bonded Coordination Network with Removable Guests","Crystal Growth & Design","2011","11","9","3740","","10.1021/cg200793f","","","0.71073","MoKα","","0.0393","0.0362","","","0.0939","0.0962","","","","","","1.05","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501155","5.2571","0.0008","8.2727","0.0013","19.632","0.004","91.072","0.009","96.028","0.009","99.886","0.008","835.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H42 N4 O11 Zn -","- C34 H42 N4 O11 Zn -","- C34 H42 N4 O11 Zn -","1","0.5","","Hogan, Greg A.; Rath, Nigam P.; Beatty, Alicia M.","A Stable Hydrogen-Bonded Coordination Network with Removable Guests","Crystal Growth & Design","2011","11","9","3740","","10.1021/cg200793f","","","0.71073","MoKα","","0.1002","0.0834","","","0.2107","0.2266","","","","","","1.016","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501156","5.175","0.0009","8.3571","0.0013","19.712","0.004","90.174","0.007","95.13","0.007","100.135","0.007","835.7","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H34 N4 O11 Zn -","- C31 H34 N4 O11 Zn -","- C31 H34 N4 O11 Zn -","1","0.5","","Hogan, Greg A.; Rath, Nigam P.; Beatty, Alicia M.","A Stable Hydrogen-Bonded Coordination Network with Removable Guests","Crystal Growth & Design","2011","11","9","3740","","10.1021/cg200793f","","","0.71073","MoKα","","0.0828","0.0733","","","0.1957","0.206","","","","","","1.042","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501157","11.402","0.005","13.866","0.005","21.902","0.009","75.871","0.013","77.874","0.012","72.202","0.012","3163","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C132 H98 Cd6 N12 O35 -","- C132 H98 Cd6 N12 O35 -","- C132 H98 Cd6 N12 O35 -","1","0.5","","Li, Lina; Luo, Junhua; Wang, Shuyun; Sun, Zhihua; Chen, Tianliang; Hong, Maochun","A Unique Independent One-Dimensional Green Luminescent Coordination Polymer Nanotube Based on an Unsymmetric Tricarboxylate Linker","Crystal Growth & Design","2011","11","9","3744","","10.1021/cg200796h","","","0.71073","MoKα","","0.1132","0.0701","","","0.1645","0.1965","","","","","","1.044","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501158","8.654","0.0004","20.971","0.0009","8.85","0.0004","90","","110.397","0.002","90","","1505.42","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4,5,6,7-Tetrafluorobenzimidazol-2-yl)-4,4,5,5-tetramethyl- 4,5-dihydro-1H-imidazole-3-oxide-1-oxyl","","- C14 H13 F4 N4 O2 -","- C14 H13 F4 N4 O2 -","- C56 H52 F16 N16 O8 -","4","1","","Seber, Gonca; Halder, Gregory J.; Schlueter, John A.; Lahti, Paul M.","Pressure Effects on the Quasi-1-D Molecular Ferromagnet 2-(4,5,6,7-Tetrafluorobenzimidazol-2-yl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazole-3-oxide-1-oxyl","Crystal Growth & Design","2011","11","10","4261","","10.1021/cg200802c","","","0.71073","MoKα","","0.0863","0.0517","","","0.1613","0.1932","","","","","","1.158","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501159","30.767","0.006","27.684","0.006","11.233","0.002","90","","90.06","0.03","90","","9568","3","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(4-(4-(tert-butyl)phenyl)-5-iodo-3-methyl-1- n-octyl-1H-1,2,3-triazol-3-ium) chloride tetrafluoroborate","","- C42 H66 B Cl F4 I2 N6 -","- C42 H66 B Cl F4 I2 N6 -","- C336 H528 B8 Cl8 F32 I16 N48 -","8","2","","Kilah, Nathan L.; Wise, Matthew D.; Beer, Paul D.","Crystallographic Implications for the Design of Halogen Bonding Anion Receptors","Crystal Growth & Design","2011","11","10","4565","","10.1021/cg200811a","","","0.71073","MoKα","","0.0763","0.0587","","0.0767","0.0699","0.0766","","","","","","0.9543","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501160","12.8238","0.0002","14.1646","0.0002","17.0277","0.0003","90.7462","0.0006","108.134","0.0007","114.279","0.0008","2643.64","0.08","150","","150","","","","","","","","","4","P -1","-P 1","2","","Bis(4-(4-(tert-butyl)phenyl)-5-iodo-3-methyl-1- n-octyl-1H-1,2,3-triazol-3-ium) iodide triiodide","","- C42 H66 I6 N6 -","- C42 H66 I6 N6 -","- C84 H132 I12 N12 -","2","1","","Kilah, Nathan L.; Wise, Matthew D.; Beer, Paul D.","Crystallographic Implications for the Design of Halogen Bonding Anion Receptors","Crystal Growth & Design","2011","11","10","4565","","10.1021/cg200811a","","","0.71073","MoKα","","0.0723","0.0458","","0.0902","0.0716","0.0902","","","","","","0.9881","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501161","15.3999","0.0008","16.441","0.0009","23.9879","0.0015","95.308","0.003","99.302","0.003","107.478","0.004","5652.4","0.6","150","","150","","","","","","","","","8","P -1","-P 1","2","","","","- C114.94 H130 Br Cl3.98 D7.14 I N6 O13.29 -","- C114.94 H130 Br Cl3.975 D7.135 I N6 O13.29 -","- C229.88 H260 Br2 Cl7.95 D14.27 I2 N12 O26.58 -","2","1","","Kilah, Nathan L.; Wise, Matthew D.; Beer, Paul D.","Crystallographic Implications for the Design of Halogen Bonding Anion Receptors","Crystal Growth & Design","2011","11","10","4565","","10.1021/cg200811a","","","0.71073","MoKα","","0.1551","0.1143","","0.2955","0.2602","0.2954","","","","","","0.9557","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501162","36.64","0.02","19.01","0.012","22.836","0.014","90","","95.386","0.012","90","","15836","16","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H52 N6 O17 Pr -","- C54 H52 N6 O17 Pr -","- C432 H416 N48 O136 Pr8 -","8","1","","Yan, Xuhuan; Li, Yafei; Wang, Qiong; Huang, Xiaoguang; Zhang, Ye; Gao, Cunji; Liu, Weisheng; Tang, Yu; Zhang, Hongrui; Shao, Yongliang","Two- to One-Dimensional: Radii-Dependent Self-Assembly Crystal Structures and Luminescent Properties of Lanthanide Coordination Polymers with an Amide Type Semirigid Bridging Ligand","Crystal Growth & Design","2011","11","9","4205","","10.1021/cg200816f","","","0.71073","MoKα","","0.3065","0.0816","","","0.1777","0.2298","","","","","","0.705","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501163","36.7013","0.0013","19.0487","0.0006","22.8374","0.0007","90","","95.746","0.003","90","","15885.7","0.9","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H55 N6 Nd O18.5 -","- C54 H55 N6 Nd O18.5 -","- C432 H440 N48 Nd8 O148 -","8","1","","Yan, Xuhuan; Li, Yafei; Wang, Qiong; Huang, Xiaoguang; Zhang, Ye; Gao, Cunji; Liu, Weisheng; Tang, Yu; Zhang, Hongrui; Shao, Yongliang","Two- to One-Dimensional: Radii-Dependent Self-Assembly Crystal Structures and Luminescent Properties of Lanthanide Coordination Polymers with an Amide Type Semirigid Bridging Ligand","Crystal Growth & Design","2011","11","9","4205","","10.1021/cg200816f","","","0.71073","MoKα","","0.1814","0.0563","","","0.1131","0.1501","","","","","","0.804","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501164","12.3793","0.0013","20.387","0.002","20.86","0.002","90","","99.227","0.001","90","","5196.5","0.9","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H48 N6 O15 Sm -","- C54 H48 N6 O15 Sm -","- C216 H192 N24 O60 Sm4 -","4","1","","Yan, Xuhuan; Li, Yafei; Wang, Qiong; Huang, Xiaoguang; Zhang, Ye; Gao, Cunji; Liu, Weisheng; Tang, Yu; Zhang, Hongrui; Shao, Yongliang","Two- to One-Dimensional: Radii-Dependent Self-Assembly Crystal Structures and Luminescent Properties of Lanthanide Coordination Polymers with an Amide Type Semirigid Bridging Ligand","Crystal Growth & Design","2011","11","9","4205","","10.1021/cg200816f","","","0.71073","MoKα","","0.0912","0.0471","","","0.0841","0.098","","","","","","1.042","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501165","12.3915","0.0009","20.3621","0.0015","20.8378","0.0015","90","","99.494","0.004","90","","5185.7","0.7","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H46 N6 O15 Tb -","- C54 H46 N6 O15 Tb -","- C216 H184 N24 O60 Tb4 -","4","1","","Yan, Xuhuan; Li, Yafei; Wang, Qiong; Huang, Xiaoguang; Zhang, Ye; Gao, Cunji; Liu, Weisheng; Tang, Yu; Zhang, Hongrui; Shao, Yongliang","Two- to One-Dimensional: Radii-Dependent Self-Assembly Crystal Structures and Luminescent Properties of Lanthanide Coordination Polymers with an Amide Type Semirigid Bridging Ligand","Crystal Growth & Design","2011","11","9","4205","","10.1021/cg200816f","","","0.71073","MoKα","","0.095","0.0463","","","0.1067","0.1284","","","","","","0.987","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501166","12.409","0.003","20.477","0.006","20.847","0.006","90","","99.813","0.003","90","","5220","2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H45.5 Er N6 O15 -","- C54 H45.5 Er N6 O15 -","- C216 H182 Er4 N24 O60 -","4","1","","Yan, Xuhuan; Li, Yafei; Wang, Qiong; Huang, Xiaoguang; Zhang, Ye; Gao, Cunji; Liu, Weisheng; Tang, Yu; Zhang, Hongrui; Shao, Yongliang","Two- to One-Dimensional: Radii-Dependent Self-Assembly Crystal Structures and Luminescent Properties of Lanthanide Coordination Polymers with an Amide Type Semirigid Bridging Ligand","Crystal Growth & Design","2011","11","9","4205","","10.1021/cg200816f","","","0.71073","MoKα","","0.1158","0.0561","","","0.1064","0.1333","","","","","","0.942","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501167","25.8402","0.0013","11.6244","0.0006","18.1993","0.0016","90","","133.514","0.001","90","","3964.4","0.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H42 N10 O11 Zn -","- C36 H36 N10 O11.02 Zn -","- C144 H144 N40 O44.08 Zn4 -","4","0.5","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.037","0.0334","","","0.0978","0.101","","","","","","1.086","","","","has coordinates,has disorder","179542","2020-10-21","18:00:00",""
"4501168","11.948","0.002","9.1229","0.0016","21.96","0.004","90","","93.121","0.003","90","","2390.1","0.7","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 Co N4 O7 -","- C24 H28 Co N4 O7 -","- C96 H112 Co4 N16 O28 -","4","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.045","0.0329","","","0.0758","0.0815","","","","","","1.037","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501169","20.1433","0.0018","18.5739","0.0016","18.3522","0.0016","90","","100.51","0.001","90","","6751.1","1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C65 H74 N11 O15.5 Zn2 -","- C65 H73 N11 O15.5 Zn2 -","- C260 H292 N44 O62 Zn8 -","4","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.0537","0.0413","","","0.1047","0.1141","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501170","10.697","0.012","11.057","0.012","11.274","0.012","107.706","0.018","91.898","0.019","112.709","0.017","1154","2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H46 Cu2 N8 O13 S2 -","- C40 H44 Cu2 N8 O13 S2 -","- C40 H44 Cu2 N8 O13 S2 -","1","0.5","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.1513","0.0775","","","0.2027","0.2375","","","","","","1.008","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501171","24.1627","0.0009","10.0093","0.0004","18.2995","0.0007","90","","119.895","0.001","90","","3836.9","0.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H18 Cl2 Co N4 O -","- C18 H18 Cl2 Co N4 O -","- C144 H144 Cl16 Co8 N32 O8 -","8","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.0334","0.0265","","","0.0661","0.0707","","","","","","1.045","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501172","9.8741","0.0014","25.089","0.004","17.889","0.003","90","","90.582","0.003","90","","4431.4","1.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 Co0.5 N3 O4.5 -","- C18 H21 Co0.5 N3 O4.5 -","- C144 H168 Co4 N24 O36 -","8","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.1072","0.0814","","","0.2564","0.2795","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501173","10.0385","0.0007","12.6413","0.0009","19.0514","0.0013","90","","100.067","0.001","90","","2380.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 N6 O8 Zn -","- C20 H22 N6 O8 Zn -","- C80 H88 N24 O32 Zn4 -","4","1","","Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Yao, Zhao-Quan; Li, Shu-Juan; Wang, Xiu-Guang","Zinc(II), Cobalt(II), and Copper(II) Complexes Based on Dibenzimidazolyl Bidentate Ligands with Oligoether Linkers: Crystal Structure and Weak Interactions","Crystal Growth & Design","2011","11","11","4933","","10.1021/cg2008182","","","0.71073","MoKα","","0.0434","0.0314","","","0.0737","0.0799","","","","","","1.021","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501174","6.7486","0.0017","7.1572","0.0018","8.687","0.002","69.818","0.003","80.019","0.003","85.524","0.003","387.79","0.16","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H16 N2 O10 Te2 V2 -","- C6 H16 N2 O10 Te2 V2 -","- C6 H16 N2 O10 Te2 V2 -","1","0.5","","Smith, Matthew D.; Blau, Samuel M.; Chang, Kelvin B.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","Beyond Charge Density Matching: The Role of C‒H···O Interactions in the Formation of Templated Vanadium Tellurites","Crystal Growth & Design","2011","11","9","4213","","10.1021/cg2008232","","","0.71073","MoKα","","0.0229","0.0202","","0.0455","0.0441","0.0429","","","","","","1.0047","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501175","19.356","0.003","7.0591","0.0012","13.582","0.002","90","","125.485","0.0017","90","","1511.1","0.4","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C5 H14 N2 O10 Te2 V2 -","- C5 H14 N2 O10 Te2 V2 -","- C20 H56 N8 O40 Te8 V8 -","4","0.5","","Smith, Matthew D.; Blau, Samuel M.; Chang, Kelvin B.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","Beyond Charge Density Matching: The Role of C‒H···O Interactions in the Formation of Templated Vanadium Tellurites","Crystal Growth & Design","2011","11","9","4213","","10.1021/cg2008232","","","0.71073","MoKα","","0.0171","0.0165","","0.0416","0.0412","0.0407","","","","","","1.0927","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501176","5.606","0.0004","20.251","0.007","8.274","0.0006","90","","108.522","0.011","90","","890.7","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H5 O6 P2 Pr -","- C6 H5 O6 P2 Pr -","- C24 H20 O24 P8 Pr4 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","","","0.71073","MoKα","","0.112","0.0541","","","0.1222","0.1507","","","","","","1.053","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501177","5.6184","0.0004","20.1488","0.0012","8.3824","0.0005","90","","108.674","0.003","90","","898.97","0.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 La O6 P2 -","- C6 H4 La O6 P2 -","- C24 H16 La4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","2.6197","32.2","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501178","5.5897","0.0009","20.073","0.003","8.3249","0.0013","90","","108.573","0.007","90","","885.4","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Ce O6 P2 -","- C6 H4 Ce O6 P2 -","- C24 H16 Ce4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","4.4052","59.6","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501179","5.5746","0.0006","20.056","0.002","8.2868","0.0008","90","","108.588","0.004","90","","878.17","0.16","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 O6 P2 Pr -","- C6 H4 O6 P2 Pr -","- C24 H16 O24 P8 Pr4 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","3.4835","35.8","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501180","5.5549","0.0011","20.05","0.004","8.2437","0.0015","90","","108.496","0.008","90","","870.7","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Nd O6 P2 -","- C6 H4 Nd O6 P2 -","- C24 H16 Nd4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","4.9142","47.1","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501181","5.5196","0.0009","19.973","0.003","8.1794","0.0013","90","","108.469","0.007","90","","855.3","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 O6 P2 Sm -","- C6 H4 O6 P2 Sm -","- C24 H16 O24 P8 Sm4 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","3.9245","32.9","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501182","5.4997","0.0007","19.955","0.003","8.1579","0.001","90","","108.353","0.005","90","","849.8","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Eu O6 P2 -","- C6 H4 Eu O6 P2 -","- C24 H16 Eu4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","3.1271","27.5","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501183","5.4805","0.0012","19.943","0.004","8.1317","0.0015","90","","108.367","0.008","90","","843.5","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Gd O6 P2 -","- C6 H4 Gd O6 P2 -","- C24 H16 Gd4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","6.0287","41.6","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501184","5.4735","0.0007","19.894","0.002","8.1157","0.001","90","","108.323","0.005","90","","838.91","0.17","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 O6 P2 Tb -","- C6 H4 O6 P2 Tb -","- C24 H16 O24 P8 Tb4 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","4.5607","50.8","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501185","5.4462","0.0009","19.869","0.003","8.0864","0.0011","90","","108.237","0.006","90","","831.1","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Dy O6 P2 -","- C6 H4 Dy O6 P2 -","- C24 H16 Dy4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","6.695","125","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501186","5.4309","0.0005","19.8439","0.0015","8.0629","0.0006","90","","108.208","0.003","90","","825.43","0.12","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Ho O6 P2 -","- C6 H4 Ho O6 P2 -","- C24 H16 Ho4 O24 P8 -","4","0.5","","Amghouz, Zakariae; García-Granda, Santiago; García, José R.; Clearfield, Abraham; Valiente, Rafael","Organic‒Inorganic Hybrids Assembled from Lanthanide and 1,4-Phenylenebis(phosphonate)","Crystal Growth & Design","2011","11","12","5289","","10.1021/cg2008254","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","8.1375","264","","","","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501187","12.098","0.002","16.807","0.003","34.29","0.007","90","","90","","90","","6972","2","293","2","293","2","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C64 H28 Br F6 I4 S8 -","- C64 H28 Br F6 I4 S8 -","- C256 H112 Br4 F24 I16 S32 -","4","0.25","","Lieffrig, Julien; Yamamoto, Hiroshi M.; Kusamoto, Tetsuro; Cui, Henbo; Jeannin, Olivier; Fourmigué, Marc; Kato, Reizo","Halogen-Bonded, Eight-fold PtS-Type Interpenetrated Supramolecular Network. A Study toward Redundant and Cross-Bar Supramolecular Nanowire Crystal","Crystal Growth & Design","2011","11","10","4267","","10.1021/cg200843w","","","0.71073","MoKα","","0.1289","0.075","","","0.1899","0.2163","","","","","","1.126","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501188","11.81","0.002","16.572","0.003","33.961","0.007","90","","90","","90","","6647","2","293","2","293","2","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C64 H28 Cl F6 I4 S8 -","- C64 H28 Cl F6 I4 S8 -","- C256 H112 Cl4 F24 I16 S32 -","4","0.25","","Lieffrig, Julien; Yamamoto, Hiroshi M.; Kusamoto, Tetsuro; Cui, Henbo; Jeannin, Olivier; Fourmigué, Marc; Kato, Reizo","Halogen-Bonded, Eight-fold PtS-Type Interpenetrated Supramolecular Network. A Study toward Redundant and Cross-Bar Supramolecular Nanowire Crystal","Crystal Growth & Design","2011","11","10","4267","","10.1021/cg200843w","","","0.71073","MoKα","","0.1846","0.0787","","","0.2064","0.2674","","","","","","0.893","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501189","11.038","0.01","9.067","0.008","11.392","0.01","90","","101.86","0.014","90","","1115.8","1.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C52 H48 N8 O8 -","4","1","","Nath, Naba K.; Kumar, S. Sudalai; Nangia, Ashwini","Neutral and Zwitterionic Polymorphs of 2-(p-Tolylamino)nicotinic Acid","Crystal Growth & Design","2011","11","10","4594","","10.1021/cg200853u","","","0.71073","MoKα","","0.0648","0.0598","","","0.1827","0.185","","","","","","1.188","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501190","14.2565","0.0016","10.7542","0.0015","14.769","0.003","90","","90","","90","","2264.3","0.6","100","","100","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C104 H96 N16 O16 -","8","1","","Nath, Naba K.; Kumar, S. Sudalai; Nangia, Ashwini","Neutral and Zwitterionic Polymorphs of 2-(p-Tolylamino)nicotinic Acid","Crystal Growth & Design","2011","11","10","4594","","10.1021/cg200853u","","","0.7107","MoKα","","0.1081","0.0497","","","0.1026","0.1144","","","","","","0.872","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501191","9.0787","0.0011","14.2261","0.0017","17.154","0.002","90","","90","","90","","2215.5","0.5","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C104 H96 N16 O16 -","8","1","","Nath, Naba K.; Kumar, S. Sudalai; Nangia, Ashwini","Neutral and Zwitterionic Polymorphs of 2-(p-Tolylamino)nicotinic Acid","Crystal Growth & Design","2011","11","10","4594","","10.1021/cg200853u","","","0.71073","MoKα","","0.0546","0.0521","","","0.1475","0.1488","","","","","","1.185","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501192","9.25","0.004","14.207","0.004","17.509","0.01","90","","90","","90","","2300.9","1.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C104 H96 N16 O16 -","8","1","","Nath, Naba K.; Kumar, S. Sudalai; Nangia, Ashwini","Neutral and Zwitterionic Polymorphs of 2-(p-Tolylamino)nicotinic Acid","Crystal Growth & Design","2011","11","10","4594","","10.1021/cg200853u","","","0.7107","MoKα","","0.1578","0.0646","","","0.135","0.1537","","","","","","0.929","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501193","6.8022","0.0008","10.412","0.0012","23.206","0.003","90","","90","","90","","1643.6","0.3","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 N4 O2 -","- C18 H18 N4 O2 -","- C72 H72 N16 O8 -","4","1","","Nath, Naba K.; Kumar, S. Sudalai; Nangia, Ashwini","Neutral and Zwitterionic Polymorphs of 2-(p-Tolylamino)nicotinic Acid","Crystal Growth & Design","2011","11","10","4594","","10.1021/cg200853u","","","0.71073","MoKα","","0.0442","0.042","","","0.0928","0.094","","","","","","1.162","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501194","7.8","0.0008","13.0415","0.0016","14.0098","0.0015","64.87","0.011","86.132","0.009","85.992","0.009","1286","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H22 N4 O10 -","- C27 H22 N4 O10 -","- C54 H44 N8 O20 -","2","1","","Nath, Naba K.; Kumar, S. Sudalai; Nangia, Ashwini","Neutral and Zwitterionic Polymorphs of 2-(p-Tolylamino)nicotinic Acid","Crystal Growth & Design","2011","11","10","4594","","10.1021/cg200853u","","","0.7107","MoKα","","0.0616","0.0399","","","0.1033","0.1099","","","","","","1.039","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501195","18.704","0.002","11.6908","0.0013","9.4873","0.001","90","","90","","90","","2074.5","0.4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C24 H18 Mn N2 O4 -","- C24 H18 Mn N2 O4 -","- C96 H72 Mn4 N8 O16 -","4","0.5","","Kar, Paramita; Biswas, Rituparna; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh","A Unique Example of Structural Diversity Tuned by Apparently Innocento-,m-, andp-Nitro Substituents of Benzoate in Their Complexes of Mn(II) with 4,4′-Bipyridine: 1D Ladder, 2D Sheet, and 3D Framework","Crystal Growth & Design","2011","11","12","5305","","10.1021/cg2008649","","","0.71073","MoKα","","0.0784","0.0521","","","0.1875","0.2034","","","","","","1.19","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501196","11.1137","0.0008","22.3436","0.0017","19.1449","0.0015","90","","96.888","0.001","90","","4719.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 Mn2 N8 O16 -","- C48 H32 Mn2 N8 O16 -","- C192 H128 Mn8 N32 O64 -","4","1","","Kar, Paramita; Biswas, Rituparna; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh","A Unique Example of Structural Diversity Tuned by Apparently Innocento-,m-, andp-Nitro Substituents of Benzoate in Their Complexes of Mn(II) with 4,4′-Bipyridine: 1D Ladder, 2D Sheet, and 3D Framework","Crystal Growth & Design","2011","11","12","5305","","10.1021/cg2008649","","","0.71073","MoKα","","0.0755","0.0385","","","0.0801","0.0963","","","","","","1.019","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501197","20.088","0.013","11.676","0.007","9.961","0.006","90","","95.776","0.008","90","","2324","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Mn N4 O8 -","- C24 H16 Mn N4 O8 -","- C96 H64 Mn4 N16 O32 -","4","0.5","","Kar, Paramita; Biswas, Rituparna; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh","A Unique Example of Structural Diversity Tuned by Apparently Innocento-,m-, andp-Nitro Substituents of Benzoate in Their Complexes of Mn(II) with 4,4′-Bipyridine: 1D Ladder, 2D Sheet, and 3D Framework","Crystal Growth & Design","2011","11","12","5305","","10.1021/cg2008649","","","0.71073","MoKα","","0.1049","0.0698","","","0.1697","0.1924","","","","","","1.051","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501198","13.359","0.003","23.502","0.005","7.3675","0.0015","90","","97.269","0.002","90","","2294.5","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Mn N4 O8 -","- C24 H16 Mn N4 O8 -","- C96 H64 Mn4 N16 O32 -","4","0.5","","Kar, Paramita; Biswas, Rituparna; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh","A Unique Example of Structural Diversity Tuned by Apparently Innocento-,m-, andp-Nitro Substituents of Benzoate in Their Complexes of Mn(II) with 4,4′-Bipyridine: 1D Ladder, 2D Sheet, and 3D Framework","Crystal Growth & Design","2011","11","12","5305","","10.1021/cg2008649","","","0.71073","MoKα","","0.0495","0.0388","","","0.0971","0.1022","","","","","","1.094","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501199","9.7762","0.0008","9.8409","0.0008","10.3044","0.0009","92.625","0.001","114.899","0.001","110.628","0.001","819.26","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 O21 P4 U2 -","- C20 H24 O21 P4 U2 -","- C20 H24 O21 P4 U2 -","1","0.5","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Syntheses of Uranyl Diphosphonate Compounds Using Encapsulated Cations as Structure Directing Agents","Crystal Growth & Design","2011","11","9","4227","","10.1021/cg200872a","","","0.71073","MoKα","","0.0297","0.0244","","","0.0527","0.0548","","","","","","1.03","","","","has coordinates","179542","2020-10-21","18:00:00",""
"4501200","10.089","0.003","11.712","0.004","11.803","0.004","111.964","0.004","107.146","0.004","105.977","0.004","1112.9","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H12 O27 P6 U3 -","- C22 H12 O27 P6 U3 -","- C22 H12 O27 P6 U3 -","1","0.5","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Syntheses of Uranyl Diphosphonate Compounds Using Encapsulated Cations as Structure Directing Agents","Crystal Growth & Design","2011","11","9","4227","","10.1021/cg200872a","","","0.71073","MoKα","","0.0805","0.0583","","","0.1594","0.1761","","","","","","1.297","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501201","10.1004","0.0016","10.6811","0.0017","19.156","0.003","74.492","0.002","84.033","0.002","87.646","0.002","1980.4","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H28 F O26 P4 U2 -","- C22 H28 F O26 P4 U2 -","- C44 H56 F2 O52 P8 U4 -","2","1","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Syntheses of Uranyl Diphosphonate Compounds Using Encapsulated Cations as Structure Directing Agents","Crystal Growth & Design","2011","11","9","4227","","10.1021/cg200872a","","","0.71073","MoKα","","0.1234","0.0552","","","0.0861","0.1063","","","","","","0.959","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501202","16.7893","0.0018","10.2105","0.0011","22.087","0.002","90","","92.012","0.001","90","","3784","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 F O25 P4 U2 -","- C24 H32 F O25 P4 U2 -","- C96 H128 F4 O100 P16 U8 -","4","1","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Syntheses of Uranyl Diphosphonate Compounds Using Encapsulated Cations as Structure Directing Agents","Crystal Growth & Design","2011","11","9","4227","","10.1021/cg200872a","","","0.71073","MoKα","","0.0486","0.032","","","0.0635","0.0695","","","","","","1.049","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501203","10.2545","0.0016","19.608","0.003","20.52","0.003","90","","93.156","0.002","90","","4119.7","1.1","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 F K O26 P4 U2 -","- C24 H32 F K O26 P4 U2 -","- C96 H128 F4 K4 O104 P16 U8 -","4","1","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Syntheses of Uranyl Diphosphonate Compounds Using Encapsulated Cations as Structure Directing Agents","Crystal Growth & Design","2011","11","9","4227","","10.1021/cg200872a","","","0.71073","MoKα","","0.0762","0.0396","","","0.075","0.0872","","","","","","0.996","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501204","3.8896","0.0019","9.384","0.005","14.852","0.007","101.784","0.007","95.457","0.007","90.22","0.007","528.1","0.5","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H10 O2 -","- C15 H10 O2 -","- C30 H20 O4 -","2","1","","Zhu, Lingyan; Al-Kaysi, Rabih O.; Dillon, Robert J.; Tham, Fook S.; Bardeen, Christopher J.","Crystal Structures and Photophysical Properties of 9-Anthracene Carboxylic Acid Derivatives for Photomechanical Applications","Crystal Growth & Design","2011","11","11","4975","","10.1021/cg200883b","","","0.71073","MoKα","","0.1109","0.0882","","","0.2265","0.2399","","","","","","1.095","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501205","9.2885","0.0014","3.765","0.0006","30.373","0.005","90","","97.517","0.003","90","","1053.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H9 Br0.05 F0.95 O2 -","- C15 H9 Br0.0505 F0.9495 O2 -","- C60 H36 Br0.202 F3.798 O8 -","4","1","","Zhu, Lingyan; Al-Kaysi, Rabih O.; Dillon, Robert J.; Tham, Fook S.; Bardeen, Christopher J.","Crystal Structures and Photophysical Properties of 9-Anthracene Carboxylic Acid Derivatives for Photomechanical Applications","Crystal Growth & Design","2011","11","11","4975","","10.1021/cg200883b","","","0.71073","MoKα","","0.092","0.0703","","","0.191","0.2078","","","","","","1.083","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501206","8.5743","0.0003","8.2539","0.0003","16.4805","0.0006","90","","94.9243","0.0005","90","","1162.04","0.07","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 O2 -","- C16 H12 O2 -","- C64 H48 O8 -","4","1","","Zhu, Lingyan; Al-Kaysi, Rabih O.; Dillon, Robert J.; Tham, Fook S.; Bardeen, Christopher J.","Crystal Structures and Photophysical Properties of 9-Anthracene Carboxylic Acid Derivatives for Photomechanical Applications","Crystal Growth & Design","2011","11","11","4975","","10.1021/cg200883b","","","0.71073","MoKα","","0.0532","0.0467","","","0.1405","0.1497","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501207","7.1691","0.0005","13.5819","0.001","30.767","0.002","90","","90","","90","","2995.8","0.4","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C21 H14 O2 -","- C21 H14 O2 -","- C168 H112 O16 -","8","1","","Zhu, Lingyan; Al-Kaysi, Rabih O.; Dillon, Robert J.; Tham, Fook S.; Bardeen, Christopher J.","Crystal Structures and Photophysical Properties of 9-Anthracene Carboxylic Acid Derivatives for Photomechanical Applications","Crystal Growth & Design","2011","11","11","4975","","10.1021/cg200883b","","","0.71073","MoKα","","0.0731","0.0518","","","0.1243","0.1383","","","","","","1.106","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501208","12.2784","0.0003","9.0581","0.0003","23.5345","0.0006","90","","94.268","0.002","90","","2610.22","0.13","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H12 F8 I4 N2 S -","- C17 H12 F8 I4 N2 S -","- C68 H48 F32 I16 N8 S4 -","4","0.5","","Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L.","Multinuclear Solid-State Magnetic Resonance and X-ray Diffraction Study of Some Thiocyanate and Selenocyanate Complexes Exhibiting Halogen Bonding","Crystal Growth & Design","2011","11","11","4984","","10.1021/cg200889y","","","0.71073","MoKα","","0.0394","0.0289","","","0.076","0.0826","","","","","","1.022","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501209","9.4954","0.0003","24.6517","0.0008","11.4085","0.0004","90","","103.24","0.001","90","","2599.49","0.15","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H12 F8 I4 N2 Se -","- C17 H12 F8 I4 N2 Se -","- C68 H48 F32 I16 N8 Se4 -","4","1","","Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L.","Multinuclear Solid-State Magnetic Resonance and X-ray Diffraction Study of Some Thiocyanate and Selenocyanate Complexes Exhibiting Halogen Bonding","Crystal Growth & Design","2011","11","11","4984","","10.1021/cg200889y","","","0.71073","MoKα","","0.0379","0.0276","","","0.0621","0.0656","","","","","","1.018","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501210","8.7214","0.0007","11.0795","0.0009","13.4793","0.0011","93.753","0.004","90.429","0.004","97.315","0.004","1288.95","0.18","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H12 F8 I4 N2 Se -","- C17 H12 F8 I4 N2 Se -","- C34 H24 F16 I8 N4 Se2 -","2","1","","Viger-Gravel, Jasmine; Korobkov, Ilia; Bryce, David L.","Multinuclear Solid-State Magnetic Resonance and X-ray Diffraction Study of Some Thiocyanate and Selenocyanate Complexes Exhibiting Halogen Bonding","Crystal Growth & Design","2011","11","11","4984","","10.1021/cg200889y","","","0.71073","MoKα","","0.0255","0.0228","","","0.0573","0.0588","","","","","","1.073","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501211","3.9041","0.0005","13.8156","0.0016","12.1585","0.0014","90","","90.521","0.002","90","","655.77","0.14","86","2","86","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(3-ClPy)2CuBr2","","","- C10 H8 Br2 Cl2 Cu N2 -","- C10 H8 Br2 Cl2 Cu N2 -","- C20 H16 Br4 Cl4 Cu2 N4 -","2","0.5","","Awwadi, Firas; Willett, Roger D.; Twamley, Brendan","Tuning Molecular Structures Using Weak Noncovalent Interactions: Theoretical Study and Structure oftrans-Bis(2-chloropyridine)dihalocopper(II) andtrans-Bis(3-chloropyridine)dibromocopper(II)","Crystal Growth & Design","2011","11","12","5316","","10.1021/cg200893n","","","0.71073","MoKα","","0.0478","0.0364","","","0.0783","0.0817","","","","","","1.03","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501212","8.4359","0.0012","8.4865","0.0009","10.5674","0.0014","76.876","0.011","70.044","0.011","70.532","0.01","664.95","0.16","295","2","295","2","","","","","","","","5","P -1","-P 1","2","(2-ClPy)2CuCl2","","","- C10 H8 Cl4 Cu N2 -","- C10 H8 Cl4 Cu N2 -","- C20 H16 Cl8 Cu2 N4 -","2","1","","Awwadi, Firas; Willett, Roger D.; Twamley, Brendan","Tuning Molecular Structures Using Weak Noncovalent Interactions: Theoretical Study and Structure oftrans-Bis(2-chloropyridine)dihalocopper(II) andtrans-Bis(3-chloropyridine)dibromocopper(II)","Crystal Growth & Design","2011","11","12","5316","","10.1021/cg200893n","","","0.71073","MoKα","","0.051","0.0338","","","0.0765","0.0835","","","","","","1.058","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501213","8.4354","0.0013","8.8167","0.0013","11.402","0.003","70.088","0.016","74.565","0.015","62.103","0.012","698.8","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","(2-ClPy)2CuBr2","","","- C10 H8 Br2 Cl2 Cu N2 -","- C10 H8 Br2 Cl2 Cu N2 -","- C20 H16 Br4 Cl4 Cu2 N4 -","2","1","","Awwadi, Firas; Willett, Roger D.; Twamley, Brendan","Tuning Molecular Structures Using Weak Noncovalent Interactions: Theoretical Study and Structure oftrans-Bis(2-chloropyridine)dihalocopper(II) andtrans-Bis(3-chloropyridine)dibromocopper(II)","Crystal Growth & Design","2011","11","12","5316","","10.1021/cg200893n","","","0.71073","MoKα","","0.0918","0.0515","","","0.1079","0.1249","","","","","","1.006","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501214","16.8704","0.0007","21.2935","0.0009","9.5632","0.0004","90","","120.011","0.001","90","","2974.8","0.2","296","2","296","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C24 H53 Fe4 Na7 O58 Sb6 -","- C24 H12 Fe4 Na7 O58 Sb6 -","- C48 H24 Fe8 Na14 O116 Sb12 -","2","0.5","","Gao, Qiang; Wang, Xiqu; Conato, Marlon T.; Makarenko, Tatyana; Jacobson, Allan J.","Microporous, Homochiral Structures Containing Iron Oxo-Clusters Supported by Antimony(III) Tartrate Scaffolds","Crystal Growth & Design","2011","11","10","4632","","10.1021/cg200899w","","","0.71073","MoKα","","0.0303","0.0301","","","0.0836","0.0838","","","","","","1.02","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501215","19.0892","0.0009","19.0892","0.0009","24.5573","0.0012","90","","90","","120","","7749.7","0.6","298","2","298","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C54 H101 Fe14 K3 N2 O116 Sb12 -","- C48 H24 Fe14 K3 O92.8 Sb12 -","- C96 H48 Fe28 K6 O185.6 Sb24 -","2","0.166667","","Gao, Qiang; Wang, Xiqu; Conato, Marlon T.; Makarenko, Tatyana; Jacobson, Allan J.","Microporous, Homochiral Structures Containing Iron Oxo-Clusters Supported by Antimony(III) Tartrate Scaffolds","Crystal Growth & Design","2011","11","10","4632","","10.1021/cg200899w","","","0.71073","MoKα","","0.0457","0.0356","","","0.1298","0.1371","","","","","","1.215","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501216","18.3733","0.0005","18.3733","0.0005","73.386","0.002","90","","90","","120","","21454.5","1","296","2","296","2","","","","","","","","8","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C54 H116 Fe12 K5 N4 Na3 O118 Sb12 -","- C48 Fe11.774 K5 Na3 O169.33 Sb12 -","- C288 Fe70.644 K30 Na18 O1015.98 Sb72 -","6","0.5","","Gao, Qiang; Wang, Xiqu; Conato, Marlon T.; Makarenko, Tatyana; Jacobson, Allan J.","Microporous, Homochiral Structures Containing Iron Oxo-Clusters Supported by Antimony(III) Tartrate Scaffolds","Crystal Growth & Design","2011","11","10","4632","","10.1021/cg200899w","","","0.71073","MoKα","","0.1196","0.1082","","","0.275","0.2839","","","","","","1.117","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501217","7.9013","0.0006","5.6116","0.0004","20.1258","0.0016","90","","101.26","0.004","90","","875.18","0.12","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","PC-4-10e (2-aminopyrazine)2, 1,4-diiodotetrafluorobenzene","","- C14 H10 F4 I2 N6 -","- C14 H10 F4 I2 N6 -","- C28 H20 F8 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Chopade, Prashant D.; Desper, John","Avoiding “Synthon Crossover” in Crystal Engineering with Halogen Bonds and Hydrogen Bonds","Crystal Growth & Design","2011","11","12","5333","","10.1021/cg2009013","","","0.71073","MoKα","","0.0413","0.0336","","","0.0749","0.0808","","","","","","0.739","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501218","5.6316","0.0006","8.1219","0.0009","21.226","0.002","90","","93.035","0.004","90","","969.5","0.17","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-11e 2-amino-5-bromopyrazine, 1,4-diiodotetrafluorobenzene","","- C14 H8 Br2 F4 I2 N6 -","- C14 H8 Br2 F4 I2 N6 -","- C28 H16 Br4 F8 I4 N12 -","2","0.5","","Aakeröy, Christer B.; Chopade, Prashant D.; Desper, John","Avoiding “Synthon Crossover” in Crystal Engineering with Halogen Bonds and Hydrogen Bonds","Crystal Growth & Design","2011","11","12","5333","","10.1021/cg2009013","","","0.71073","MoKα","","0.0347","0.0296","","","0.0647","0.0668","","","","","","1.056","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501219","5.6428","0.0004","9.7705","0.0007","10.4014","0.0007","100.821","0.003","103.743","0.003","93.752","0.003","543.49","0.07","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","4-12e (3-amino-2,6-dibromopyrazine)2, 1,4-diiodotetrafluorobenzene","","- C14 H6 Br4 F4 I2 N6 -","- C14 H6 Br4 F4 I2 N6 -","- C14 H6 Br4 F4 I2 N6 -","1","0.5","","Aakeröy, Christer B.; Chopade, Prashant D.; Desper, John","Avoiding “Synthon Crossover” in Crystal Engineering with Halogen Bonds and Hydrogen Bonds","Crystal Growth & Design","2011","11","12","5333","","10.1021/cg2009013","","","0.71073","MoKα","","0.0285","0.0259","","","0.0635","0.0646","","","","","","1.064","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501220","12.299","0.002","15.006","0.003","15.438","0.003","90","","90","","90","","2849.2","0.9","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 F4 N4 O12 Zn2 -","- C24 H22 F4 N4 O12 Zn2 -","- C96 H88 F16 N16 O48 Zn8 -","4","1","","Zhang, Zhi-Hui; Chen, Sheng-Chun; He, Ming-Yang; Li, Chao; Chen, Qun; Du, Miao","Fluorine-Induced Chiral Coordination Arrays Containing Helical Hydrogen-Bonding Chains of Water or Fluorinated Ligand","Crystal Growth & Design","2011","11","12","5171","","10.1021/cg200902g","","","0.71073","MoKα","","0.025","0.0219","","","0.0585","0.0599","","","","","","1.045","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501221","13.0654","0.0006","13.0654","0.0006","12.3392","0.001","90","","90","","120","","1824.16","0.19","295","2","295","2","","","","","","","","7","P 31 2 1","P 31 2""","152","","","","- C11 H7 Cd Cl F2 N2 O2 -","- C11 H7 Cd Cl F2 N2 O2 -","- C66 H42 Cd6 Cl6 F12 N12 O12 -","6","1","","Zhang, Zhi-Hui; Chen, Sheng-Chun; He, Ming-Yang; Li, Chao; Chen, Qun; Du, Miao","Fluorine-Induced Chiral Coordination Arrays Containing Helical Hydrogen-Bonding Chains of Water or Fluorinated Ligand","Crystal Growth & Design","2011","11","12","5171","","10.1021/cg200902g","","","0.71073","MoKα","","0.0158","0.0149","","","0.0367","0.0371","","","","","","1.031","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501222","13.294","0.003","16.269","0.004","11.18","0.003","90","","99.609","0.004","90","","2384.1","1","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 N4 O9 Zn2 -","- C24 H20 N4 O9 Zn2 -","- C96 H80 N16 O36 Zn8 -","4","0.5","","Zhang, Zhi-Hui; Chen, Sheng-Chun; He, Ming-Yang; Li, Chao; Chen, Qun; Du, Miao","Fluorine-Induced Chiral Coordination Arrays Containing Helical Hydrogen-Bonding Chains of Water or Fluorinated Ligand","Crystal Growth & Design","2011","11","12","5171","","10.1021/cg200902g","","","0.71073","MoKα","","0.1449","0.0517","","","0.0942","0.1287","","","","","","0.971","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501223","12.297","0.0005","26.057","0.0012","26.084","0.0012","90","","90","","90","","8357.9","0.6","293","2","293","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C37 H20 Cu4 O24 -","- C37 H20 Cu4 O24 -","- C148 H80 Cu16 O96 -","4","0.5","","Lin, Zu-Jin; Liu, Tian-Fu; Zhao, Xiu-Ling; Lü, Jian; Cao, Rong","Designed 4,8-Connected Metal‒Organic Frameworks Based on Tetrapodal Octacarboxylate Ligands","Crystal Growth & Design","2011","11","10","4284","","10.1021/cg200919m","","","0.71073","MoKα","","0.0873","0.0839","","","0.2668","0.2715","","","","","","1.081","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501224","12.4105","0.0005","26.2172","0.0012","26.2215","0.0012","90","","90","","90","","8531.7","0.7","293","2","293","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C37 H20 O24 Zn4 -","- C37 H20 O24 Zn4 -","- C148 H80 O96 Zn16 -","4","0.5","","Lin, Zu-Jin; Liu, Tian-Fu; Zhao, Xiu-Ling; Lü, Jian; Cao, Rong","Designed 4,8-Connected Metal‒Organic Frameworks Based on Tetrapodal Octacarboxylate Ligands","Crystal Growth & Design","2011","11","10","4284","","10.1021/cg200919m","","","0.71073","MoKα","","0.0829","0.0761","","","0.2367","0.2488","","","","","","1.144","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501225","18.326","0.004","19.033","0.004","12.529","0.003","90","","90","","90","","4370.1","1.7","113","2","113","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C55 H62 Cd4 N6 O26 -","- C55 H62 Cd4 N6 O26 -","- C110 H124 Cd8 N12 O52 -","2","0.5","","Lin, Zu-Jin; Liu, Tian-Fu; Zhao, Xiu-Ling; Lü, Jian; Cao, Rong","Designed 4,8-Connected Metal‒Organic Frameworks Based on Tetrapodal Octacarboxylate Ligands","Crystal Growth & Design","2011","11","10","4284","","10.1021/cg200919m","","","0.71073","MoKα","","0.0441","0.0428","","","0.1165","0.1179","","","","","","1.068","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501226","7.6417","0.0004","23.3523","0.0009","9.7987","0.0006","90","","108.017","0.007","90","","1662.85","0.16","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","EDT-TTFI2,ClO4","","","- C8 H4 Cl I2 O4 S6 -","- C8 H4 Cl I2 O4 S6 -","- C32 H16 Cl4 I8 O16 S24 -","4","1","","Shin, Kyung-Soon; Brezgunova, Mariya; Jeannin, Olivier; Roisnel, Thierry; Camerel, Franck; Auban-Senzier, Pascale; Fourmigué, Marc","Strong Iodine···Oxygen Interactions in Molecular Conductors Incorporating Sulfonate Anions","Crystal Growth & Design","2011","11","12","5337","","10.1021/cg200934r","","","0.71073","MoKα","","0.0321","0.0272","","","0.0592","0.0609","","","","","","1.166","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501227","7.755","0.0003","17.4439","0.0005","18.3384","0.0006","67.622","0.002","85.438","0.002","77.408","0.001","2238.76","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTFI2)2 (rac)camphorsulfonate","","","- C26 H23 I4 O4 S13 -","- C26 H23 I4 O4 S13 -","- C52 H46 I8 O8 S26 -","2","1","","Shin, Kyung-Soon; Brezgunova, Mariya; Jeannin, Olivier; Roisnel, Thierry; Camerel, Franck; Auban-Senzier, Pascale; Fourmigué, Marc","Strong Iodine···Oxygen Interactions in Molecular Conductors Incorporating Sulfonate Anions","Crystal Growth & Design","2011","11","12","5337","","10.1021/cg200934r","","","0.71073","MoKα","","0.0321","0.03","","","0.0896","0.0904","","","","","","1.317","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501228","7.7713","0.0002","14.1238","0.0004","17.1337","0.0005","112.569","0.001","94.867","0.001","105.053","0.001","1640.7","0.08","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","(EDT-TTFI2)4,1,5-naphtalene bis(sulfonate)","","","- C42 H22 I8 O6 S26 -","- C42 H22 I8 O6 S26 -","- C42 H22 I8 O6 S26 -","1","0.5","","Shin, Kyung-Soon; Brezgunova, Mariya; Jeannin, Olivier; Roisnel, Thierry; Camerel, Franck; Auban-Senzier, Pascale; Fourmigué, Marc","Strong Iodine···Oxygen Interactions in Molecular Conductors Incorporating Sulfonate Anions","Crystal Growth & Design","2011","11","12","5337","","10.1021/cg200934r","","x-ray","0.71073","MoKα","","0.031","0.0273","","","0.0643","0.0664","","","","","","1.06","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501229","7.984","0.0007","10.7355","0.0009","11.4398","0.001","101.32","0.003","96.26","0.003","99.933","0.003","936.62","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTFI2)2,2,6-naphtalene bis(sulfonate)","","","- C26 H14 I4 O6 S14 -","- C26 H14 I4 O6 S14 -","- C26 H14 I4 O6 S14 -","1","0.5","","Shin, Kyung-Soon; Brezgunova, Mariya; Jeannin, Olivier; Roisnel, Thierry; Camerel, Franck; Auban-Senzier, Pascale; Fourmigué, Marc","Strong Iodine···Oxygen Interactions in Molecular Conductors Incorporating Sulfonate Anions","Crystal Growth & Design","2011","11","12","5337","","10.1021/cg200934r","","","0.71073","MoKα","","0.0211","0.0189","","","0.0421","0.0458","","","","","","1.086","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501230","8.2897","0.0005","16.5934","0.001","17.3822","0.0009","69.717","0.002","87.867","0.002","79.992","0.002","2207.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTFI2)4,2,6-anthracene bis(sulfonate)","","","- C54 H28 I10 O6 S32 -","- C54.016 H28.032 I9.984 O6 S32.016 -","- C54.016 H28.032 I9.984 O6 S32.016 -","1","0.5","","Shin, Kyung-Soon; Brezgunova, Mariya; Jeannin, Olivier; Roisnel, Thierry; Camerel, Franck; Auban-Senzier, Pascale; Fourmigué, Marc","Strong Iodine···Oxygen Interactions in Molecular Conductors Incorporating Sulfonate Anions","Crystal Growth & Design","2011","11","12","5337","","10.1021/cg200934r","","","0.71073","MoKα","","0.0698","0.05","","","0.1356","0.145","","","","","","1.104","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4501231","7.11422","0.00013","13.5618","0.0003","25.7091","0.0005","90","","90","","90","","2480.46","0.09","213","","213","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H43 N O4 -","- C26 H43 N O4 -","- C104 H172 N4 O16 -","4","1","","Hisaki, Ichiro; Murai, Taketoshi; Yabuguchi, Hirohide; Shigemitsu, Hajime; Tohnai, Norimitsu; Miyata, Mikiji","Deoxycholamide Crystalline Frameworks as a Platform of Highly-Efficient Fluorescence Materials","Crystal Growth & Design","2011","11","10","4652","","10.1021/cg200935j","","","1.54187","CuKα","","","0.0719","","","","0.2482","","","","","","1.154","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501232","7.2948","0.0003","26.2511","0.0009","13.5197","0.0006","90","","91.019","0.0019","90","","2588.57","0.18","213","","213","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C58 H88 O8 -","- C58 H88 O8 -","- C116 H176 O16 -","2","1","","Hisaki, Ichiro; Murai, Taketoshi; Yabuguchi, Hirohide; Shigemitsu, Hajime; Tohnai, Norimitsu; Miyata, Mikiji","Deoxycholamide Crystalline Frameworks as a Platform of Highly-Efficient Fluorescence Materials","Crystal Growth & Design","2011","11","10","4652","","10.1021/cg200935j","","","1.54187","CuKα","","","0.0722","","","","0.202","","","","","","1.05","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501233","7.27171","0.00013","13.271","0.0003","25.7839","0.0005","90","","90","","90","","2488.22","0.09","213","","213","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 N2 O3 -","- C26 H44 N2 O3 -","- C104 H176 N8 O12 -","4","1","","Hisaki, Ichiro; Murai, Taketoshi; Yabuguchi, Hirohide; Shigemitsu, Hajime; Tohnai, Norimitsu; Miyata, Mikiji","Deoxycholamide Crystalline Frameworks as a Platform of Highly-Efficient Fluorescence Materials","Crystal Growth & Design","2011","11","10","4652","","10.1021/cg200935j","","","1.54187","CuKα","","","0.0396","","","","0.1077","","","","","","1.067","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501234","7.3377","0.0003","26.4525","0.0009","13.2866","0.0005","90","","91.334","0.002","90","","2578.24","0.17","213.1","","213.1","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C58 H90 N2 O6 -","- C58 H90 N2 O6 -","- C116 H180 N4 O12 -","2","1","","Hisaki, Ichiro; Murai, Taketoshi; Yabuguchi, Hirohide; Shigemitsu, Hajime; Tohnai, Norimitsu; Miyata, Mikiji","Deoxycholamide Crystalline Frameworks as a Platform of Highly-Efficient Fluorescence Materials","Crystal Growth & Design","2011","11","10","4652","","10.1021/cg200935j","","","1.54187","CuKα","","","0.1176","","","","0.3462","","","","","","1.048","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501235","7.745","0.003","9.175","0.004","14.9","0.007","88.982","0.004","77.227","0.005","70.695","0.004","972.8","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H21 Cl2 N O2 Ru -","- C17 H21 Cl2 N O2 Ru -","- C34 H42 Cl4 N2 O4 Ru2 -","2","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0641","0.0438","","","0.0933","0.1012","","","","","","0.991","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501236","9.967","0.004","21.173","0.009","43.9","0.02","90","","90","","90","","9264","7","293","2","293","2","","","","","","","","6","F 2 d d","F -2d 2","43","","","","- C19 H25 Cl2 N O3 Ru -","- C19 H25 Cl2 N O3 Ru -","- C304 H400 Cl32 N16 O48 Ru16 -","16","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0682","0.065","","","0.1718","0.1739","","","","","","1.18","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501237","9.99","0.01","21.22","0.03","11.34","0.02","90","","107.72","0.02","90","","2290","6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 Cl2 N O3 Ru -","- C21 H29 Cl2 N O3 Ru -","- C84 H116 Cl8 N4 O12 Ru4 -","4","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0997","0.0738","","","0.1993","0.2206","","","","","","1.05","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501238","7.723","0.005","9.125","0.005","18.896","0.005","99.575","0.005","98.117","0.005","110.92","0.005","1197.1","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H29 Cl2 N O3 Ru -","- C22 H29 Cl2 N O3 Ru -","- C44 H58 Cl4 N2 O6 Ru2 -","2","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0993","0.0786","","","0.2074","0.2269","","","","","","1.102","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501239","7.712","0.005","8.864","0.005","14.729","0.005","88.487","0.005","82.809","0.005","68.192","0.005","927.2","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H17 Cl2 N O2 Ru -","- C16 H17 Cl2 N O2 Ru -","- C32 H34 Cl4 N2 O4 Ru2 -","2","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0359","0.0285","","","0.0647","0.0681","","","","","","1.001","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501240","7.626","0.008","8.595","0.009","13.219","0.014","99.134","0.015","99.263","0.014","103.57","0.014","813.7","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H17 Cl2 N O2 Ru -","- C16 H17 Cl2 N O2 Ru -","- C32 H34 Cl4 N2 O4 Ru2 -","2","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0774","0.0623","","","0.1488","0.1571","","","","","","1.039","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501241","8.056","0.006","8.634","0.006","11.505","0.008","86.602","0.01","80.733","0.009","76.736","0.009","768.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H15 Cl2 N O3 Ru -","- C13 H15 Cl2 N O3 Ru -","- C26 H30 Cl4 N2 O6 Ru2 -","2","1","","Bacchi, Alessia; Cantoni, Giulia; Granelli, Matteo; Mazza, Simona; Pelagatti, Paolo; Rispoli, Gabriele","Hydrogen Bond Optimization via Molecular Design for the Fabrication of Crystalline Organometallic Wheel-and-Axle Compounds Based on Half-Sandwich Ru(II) Units","Crystal Growth & Design","2011","11","11","5039","","10.1021/cg200940j","","","0.71073","MoKα","","0.0941","0.0806","","","0.2121","0.2232","","","","","","1.089","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501242","21.421","0.004","11.107","0.002","15.888","0.003","90","","126.51","0.03","90","","3038.3","1.5","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C34 H30 Cd N4 O5 -","- C34 H30 Cd N4 O5 -","- C136 H120 Cd4 N16 O20 -","4","1","","Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting","Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties","Crystal Growth & Design","2011","11","10","4667","","10.1021/cg200961a","","","0.71073","MoKα","","0.0705","0.0648","","","0.162","0.1688","","","","","","1.062","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501243","10.938","0.002","20.601","0.004","8.6455","0.0017","90","","99.75","0.03","90","","1920","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 Cd N2 O4 -","- C22 H19 Cd N2 O4 -","- C88 H76 Cd4 N8 O16 -","4","1","","Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting","Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties","Crystal Growth & Design","2011","11","10","4667","","10.1021/cg200961a","","","0.71073","MoKα","","0.0452","0.0378","","","0.0813","0.0854","","","","","","1.074","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501244","9.9","0.002","10.868","0.002","15.037","0.003","90","0.03","102.16","0.03","109.35","0.03","1488","0.6","293.15","","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H30 Cd N4 O4 -","- C34 H30 Cd N4 O4 -","- C68 H60 Cd2 N8 O8 -","2","1","","Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting","Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties","Crystal Growth & Design","2011","11","10","4667","","10.1021/cg200961a","","","0.71073","MoKα","","0.045","0.039","","","0.0901","0.0942","","","","","","1.05","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501245","11.941","0.002","13.8","0.003","14.351","0.003","90","","97.81","0.03","90","","2342.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H19 Cd N2 O5 -","- C26 H19 Cd N2 O5 -","- C104 H76 Cd4 N8 O20 -","4","1","","Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting","Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties","Crystal Growth & Design","2011","11","10","4667","","10.1021/cg200961a","","","0.71073","MoKα","","0.0637","0.0499","","","0.0864","0.0935","","","","","","1.076","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501246","22.289","0.004","9.918","0.002","17.866","0.004","90","","123.07","0.03","90","","3309.7","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H30 Cd N4 O4 -","- C38 H30 Cd N4 O4 -","- C152 H120 Cd4 N16 O16 -","4","0.5","","Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting","Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties","Crystal Growth & Design","2011","11","10","4667","","10.1021/cg200961a","","","0.71073","MoKα","","0.0402","0.0393","","","0.0947","0.0954","","","","","","1.078","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501247","13.967","0.003","15.1","0.003","17.078","0.003","90","","105.38","0.03","90","","3472.8","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C76 H55 Cd4 N8 O18 -","- C76 H55 Cd4 N8 O18 -","- C152 H110 Cd8 N16 O36 -","2","0.5","","Xu, Chunying; Li, Linke; Wang, Yinping; Guo, Qianqian; Wang, Xianjuan; Hou, Hongwei; Fan, Yaoting","Three-Dimensional Cd(II) Coordination Polymers Based on Semirigid Bis(Methylbenzimidazole) and Aromatic Polycarboxylates: Syntheses, Topological Structures and Photoluminescent Properties","Crystal Growth & Design","2011","11","10","4667","","10.1021/cg200961a","","","0.71073","MoKα","","0.0563","0.0512","","","0.1066","0.11","","","","","","1.064","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501248","13.1497","0.001","14.2074","0.0011","18.4957","0.0014","90","","97.294","0.002","90","","3427.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H42 Cl2 Hg N2 O4 S2 -","- C30 H42 Cl2 Hg N2 O4 S2 -","- C120 H168 Cl8 Hg4 N8 O16 S8 -","4","1","","Casas, José S.; Collazo, Ricardo; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez-López, Ezequiel M.","Mercury(II) Complexes Containing the [Hg(L)2]2‒, [Hg(L)(HL)]−, and [Hg(HL)2] Units [H2L = 3-(2-Chlorophenyl)-2-sulfanylpropenoic Acid]. Structural and Spectroscopic Effects of the Different Degrees of Ligand Protonation","Crystal Growth & Design","2011","11","12","5370","","10.1021/cg200963g","","","0.71073","MoKα","","0.1866","0.0469","","","0.0608","0.0799","","","","","","0.74","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501249","15.2002","0.0013","10.5386","0.0009","18.6041","0.0015","90","","113.418","0.002","90","","2734.7","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H27 Cl2 Hg N O4 S2 -","- C24 H27 Cl2 Hg N O4 S2 -","- C96 H108 Cl8 Hg4 N4 O16 S8 -","4","1","","Casas, José S.; Collazo, Ricardo; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez-López, Ezequiel M.","Mercury(II) Complexes Containing the [Hg(L)2]2‒, [Hg(L)(HL)]−, and [Hg(HL)2] Units [H2L = 3-(2-Chlorophenyl)-2-sulfanylpropenoic Acid]. Structural and Spectroscopic Effects of the Different Degrees of Ligand Protonation","Crystal Growth & Design","2011","11","12","5370","","10.1021/cg200963g","","","0.71073","MoKα","","0.0812","0.0381","","","0.0721","0.0878","","","","","","1.038","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501250","4.0068","0.0001","13.5443","0.0004","24.6328","0.0007","90","","90.326","0.001","90","","1336.78","0.06","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 Cl2 Hg O8 S2 -","- C18 H12 Cl2 Hg O8 S2 -","- C36 H24 Cl4 Hg2 O16 S4 -","2","0.5","","Casas, José S.; Collazo, Ricardo; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez-López, Ezequiel M.","Mercury(II) Complexes Containing the [Hg(L)2]2‒, [Hg(L)(HL)]−, and [Hg(HL)2] Units [H2L = 3-(2-Chlorophenyl)-2-sulfanylpropenoic Acid]. Structural and Spectroscopic Effects of the Different Degrees of Ligand Protonation","Crystal Growth & Design","2011","11","12","5370","","10.1021/cg200963g","","","0.71073","MoKα","","0.0701","0.0501","","","0.1243","0.1369","","","","","","1.143","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501251","3.7181","0.0011","6.76","0.002","10.202","0.003","106.78","0.02","92.74","0.02","92.82","0.03","244.69","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 F2 O2 Tl -","- C4 F2 O2 Tl -","- C8 F4 O4 Tl2 -","2","1","","Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe","Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand","Crystal Growth & Design","2011","11","11","5053","","10.1021/cg200974h","","","0.71073","MoKα","","0.0513","0.0417","","","0.1061","0.113","","","","","","1.053","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501252","7.3534","0.0011","8.8387","0.0013","10.4471","0.0016","76.527","0.012","73.958","0.012","68.095","0.011","598.99","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H14 F8 O15 Pb2 -","- C16 H12 F8 O15 Pb2 -","- C16 H12 F8 O15 Pb2 -","1","0.5","","Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe","Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand","Crystal Growth & Design","2011","11","11","5053","","10.1021/cg200974h","","","0.71073","MoKα","","0.0319","0.0245","","","0.0488","0.0513","","","","","","1.041","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501253","5.1941","0.001","6.4197","0.0013","9.3841","0.0018","73.02","0.02","88.35","0.02","76.35","0.02","290.54","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H8 F4 O8 Zn -","- C8 H8 F4 O8 Zn -","- C8 H8 F4 O8 Zn -","1","0.5","","Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe","Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand","Crystal Growth & Design","2011","11","11","5053","","10.1021/cg200974h","","","0.71073","MoKα","","0.0428","0.0339","","","0.0756","0.0783","","","","","","1.045","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501254","5.1691","0.0013","6.4094","0.0016","9.396","0.003","72.66","0.03","88.67","0.03","76.9","0.03","289.09","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H8 Co F4 O8 -","- C8 H8 Co F4 O8 -","- C8 H8 Co F4 O8 -","1","0.5","","Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe","Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand","Crystal Growth & Design","2011","11","11","5053","","10.1021/cg200974h","","","0.71073","MoKα","","0.0871","0.0759","","","0.1934","0.2084","","","","","","1.042","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501255","8.2336","0.0011","19.402","0.002","9.697","0.0012","90","","101.727","0.015","90","","1516.7","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H20 F8 N2 O11 Zn2 -","- C24 H20 F8 N2 O11 Zn2 -","- C48 H40 F16 N4 O22 Zn4 -","2","1","","Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe","Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand","Crystal Growth & Design","2011","11","11","5053","","10.1021/cg200974h","","","0.71073","MoKα","","0.0686","0.0466","","","0.1017","0.1108","","","","","","0.933","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501256","8.4375","0.001","19.512","0.002","9.7423","0.001","90","","101.824","0.013","90","","1569.9","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H20 F8 Mn2 N2 O11 -","- C24 H20 F8 Mn2 N2 O11 -","- C48 H40 F16 Mn4 N4 O22 -","2","1","","Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe","Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand","Crystal Growth & Design","2011","11","11","5053","","10.1021/cg200974h","","","0.71073","MoKα","","0.0955","0.0558","","","0.1172","0.1322","","","","","","0.904","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501257","10.113","0.0011","10.7154","0.0012","10.7332","0.0012","60.861","0.001","80.486","0.001","76.604","0.001","986.37","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H16 Cu3 O28 P4 U2 -","- C28 H16 Cu3 O28 P4 U2 -","- C28 H16 Cu3 O28 P4 U2 -","1","0.5","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Heterobimetallic Copper(II) Uranyl Carboxyphenylphosphonates","Crystal Growth & Design","2011","11","10","4676","","10.1021/cg200978y","","","0.71073","MoKα","","0.0403","0.0322","","","0.1029","0.1123","","","","","","0.861","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501258","9.595","0.003","10.33","0.003","13.67","0.004","75.702","0.003","88.854","0.004","65.345","0.003","1187.9","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H16 Cu2 O33 P4 U3 -","- C28 H16 Cu2 O33 P4 U3 -","- C28 H16 Cu2 O33 P4 U3 -","1","0.5","","Adelani, Pius O.; Albrecht-Schmitt, Thomas E.","Heterobimetallic Copper(II) Uranyl Carboxyphenylphosphonates","Crystal Growth & Design","2011","11","10","4676","","10.1021/cg200978y","","","0.71073","MoKα","","0.0631","0.0435","","","0.1043","0.1114","","","","","","1.243","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501259","18.621","0.003","18.621","0.003","69.793","0.014","90","","90","","120","","20958","6","99","2","99","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C14 H10 Cu N2 O4 -","- C14 H10 Cu N2 O4 -","- C504 H360 Cu36 N72 O144 -","36","1","","Liu, Xinfang; Oh, Minhak; Lah, Myoung Soo","Adsorbate Selectivity of Isoreticular Microporous Metal‒Organic Frameworks with Similar Static Pore Dimensions","Crystal Growth & Design","2011","11","11","5064","","10.1021/cg200983y","","","0.8","synchrotron","","0.0785","0.0734","","","0.2157","0.2209","","","","","","1.072","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4501260","8.4166","0.0004","8.8831","0.0004","10.5541","0.0005","112.742","0.001","90.845","0.001","107.401","0.001","686.77","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H32 Br6 Ce2 O8 -","- C8 H32 Br6 Ce2 O8 -","- C8 H32 Br6 Ce2 O8 -","1","0.5","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.0311","0.0253","","","0.0586","0.0606","","","","","","1.024","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501261","9.6245","0.0005","14.2124","0.0007","12.7436","0.0006","90","","90.199","0.001","90","","1743.15","0.15","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H48 Br6 Ce2 O8 -","- C16 H48 Br6 Ce2 O8 -","- C32 H96 Br12 Ce4 O16 -","2","0.5","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.0318","0.0245","","","0.0555","0.0583","","","","","","1.024","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501262","6.9877","0.0005","8.7234","0.0006","8.7851","0.0006","66.055","0.001","74.133","0.001","89.17","0.001","467.93","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H10 Ce Cl3 O3 -","- C2 H10 Ce Cl3 O3 -","- C4 H20 Ce2 Cl6 O6 -","2","1","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.0215","0.0198","","","0.0467","0.0476","","","","","","1.039","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501263","6.7897","0.0006","8.5362","0.0007","9.1909","0.0008","106.227","0.001","110.362","0.001","99.697","0.001","458.15","0.07","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H10 Ce Cl3 O3 -","- C2 H10 Ce Cl3 O3 -","- C4 H20 Ce2 Cl6 O6 -","2","1","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.0164","0.0155","","","0.0375","0.038","","","","","","1.042","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501264","22.321","0.0017","9.2553","0.0007","14.2247","0.0011","90","","96.847","0.001","90","","2917.7","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H18 Br3 Ce O3 -","- C6 H18 Br3 Ce O3 -","- C48 H144 Br24 Ce8 O24 -","8","1","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.0298","0.0259","","","0.0606","0.0623","","","","","","1.042","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501265","10.9064","0.0007","11.6119","0.0008","14.151","0.001","108.177","0.001","111.473","0.001","95.749","0.001","1537.25","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H86 Br10 Ce4 O14 -","- C30 H86 Br10 Ce4 O14 -","- C30 H86 Br10 Ce4 O14 -","1","0.5","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.026","0.0208","","","0.0451","0.0465","","","","","","1.027","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501266","22.383","0.002","8.9005","0.0008","13.7495","0.0012","90","","97.001","0.001","90","","2718.8","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H18 Ce Cl3 O3 -","- C6 H18 Ce Cl3 O3 -","- C48 H144 Ce8 Cl24 O24 -","8","1","","Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad","Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials","Crystal Growth & Design","2011","11","11","5072","","10.1021/cg200985m","","","0.71073","MoKα","","0.0204","0.0183","","","0.0437","0.0445","","","","","","1.057","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501267","7.31","0.002","11.83","0.003","13.276","0.004","83.311","0.004","77.624","0.004","76.431","0.004","1087.4","0.5","100","","100","","","","","","","","","4","P -1","-P 1","2","","1,3-adamantanedicarboxylic acid 1,3-di(pyridin-4-yl)propane complex","","- C25 H30 N2 O4 -","- C25 H30 N2 O4 -","- C50 H60 N4 O8 -","2","1","","Manjare, Yogesh; Pedireddi, V. R.","Co-Crystals of 1,3-Adamantanedicarboxylic Acid with N-Oxide and Aza Compounds","Crystal Growth & Design","2011","11","11","5079","","10.1021/cg200987z","","","0.71073","MoKα","","0.0451","0.0396","","","0.1003","0.1036","","","","","","1.06","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501268","6.3778","0.0013","25.714","0.005","6.5647","0.0013","90","","110.23","0.03","90","","1010.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","1,3-adamantanedicarboxylic acid E-1,2-di(pyridine-4yl)diazene","","- C22 H23 N4 O4 -","- C22 H23 N4 O4 -","- C44 H46 N8 O8 -","2","0.5","","Manjare, Yogesh; Pedireddi, V. R.","Co-Crystals of 1,3-Adamantanedicarboxylic Acid with N-Oxide and Aza Compounds","Crystal Growth & Design","2011","11","11","5079","","10.1021/cg200987z","","","0.71073","MoKα","","0.1563","0.0766","","","0.1857","0.2143","","","","","","1.022","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501269","23.332","0.007","13.044","0.004","13.742","0.004","90","","95.881","0.005","90","","4160","2","297","","297","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-adamantanedicarboxylic acid (E)-2,2'-(ethene-1,2-diyl)dipyridine 1-oxide","","- C24 H26 N2 O6 -","- C24 H26 N2 O6 -","- C192 H208 N16 O48 -","8","1","","Manjare, Yogesh; Pedireddi, V. R.","Co-Crystals of 1,3-Adamantanedicarboxylic Acid with N-Oxide and Aza Compounds","Crystal Growth & Design","2011","11","11","5079","","10.1021/cg200987z","","","0.71073","MoKα","","0.0873","0.067","","","0.1595","0.172","","","","","","1.112","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501270","6.8121","0.0011","13.329","0.002","32.622","0.005","90","","90","","90","","2962","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,3-adamantanedicarboxylic acid and 1,7-phenanthroline complex","","- C36 H32 N4 O4 -","- C36 H32 N4 O4 -","- C144 H128 N16 O16 -","4","1","","Manjare, Yogesh; Pedireddi, V. R.","Co-Crystals of 1,3-Adamantanedicarboxylic Acid with N-Oxide and Aza Compounds","Crystal Growth & Design","2011","11","11","5079","","10.1021/cg200987z","","","0.71073","MoKα","","0.068","0.0484","","","0.1057","0.1249","","","","","","1.145","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501271","8.59","0.03","14.65","0.04","24.1","0.07","90","","97.88","0.05","90","","3004","16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-adamantanedicarboxylic acid 1,7-phenanthroline complex","","- C36 H32 N4 O4 -","- C36 H32 N4 O4 -","- C144 H128 N16 O16 -","4","1","","Manjare, Yogesh; Pedireddi, V. R.","Co-Crystals of 1,3-Adamantanedicarboxylic Acid with N-Oxide and Aza Compounds","Crystal Growth & Design","2011","11","11","5079","","10.1021/cg200987z","","","0.71073","MoKα","","0.08","0.0655","","","0.1712","0.1836","","","","","","1.238","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501272","9.5177","0.0017","17.235","0.003","10.9094","0.0019","90","","93.011","0.003","90","","1787.1","0.5","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 N2 O5 -","- C19 H20 N2 O5 -","- C76 H80 N8 O20 -","4","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","0.71073","MoKα","","0.0555","0.0377","","","0.0907","0.1004","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501273","9.4088","0.0012","18.474","0.002","10.9396","0.0013","90","","95.535","0.001","90","","1892.6","0.4","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N2 O5 -","- C21 H20 N2 O5 -","- C84 H80 N8 O20 -","4","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","0.71073","MoKα","","0.048","0.0375","","","0.0867","0.0926","","","","","","1.045","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501274","9.9661","0.0001","18.3254","0.0002","14.3623","0.0002","90","","101.586","0.001","90","","2569.58","0.05","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H26 N2 O6 -","- C29 H26 N2 O6 -","- C116 H104 N8 O24 -","4","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","1.54178","CuKα","","0.0387","0.0362","","","0.0963","0.0991","","","","","","1.046","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501275","8.3904","0.0001","15.005","0.0002","22.5231","0.0003","90","","96.43","0.001","90","","2817.77","0.06","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H24 N6 O5 S2 -","- C31 H24 N6 O5 S2 -","- C124 H96 N24 O20 S8 -","4","0.5","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","0.71073","MoKα","","0.0733","0.0456","","","0.1137","0.1263","","","","","","1.048","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501276","11.842","0.003","16.252","0.003","14.325","0.004","90","","109.151","0.002","90","","2604.4","1.1","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H28 N4 O5 -","- C29 H28 N4 O5 -","- C116 H112 N16 O20 -","4","0.5","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","0.71073","MoKα","","0.0759","0.0469","","","0.1062","0.1191","","","","","","1.127","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501277","22.746","0.003","31.072","0.004","25.14","0.004","90","","115.475","0.001","90","","16041","4","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C71 H97 N16 O26.5 -","- C71 H77 N16 O26.5 -","- C568 H616 N128 O212 -","8","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","0.71073","MoKα","","0.096","0.0624","","","0.1729","0.1953","","","","","","1.024","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501278","25.698","0.0004","19.7165","0.0004","30.1786","0.0006","90","","90","","90","","15290.7","0.5","173","","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C73 H91 N16 O21.5 -","- C73 H80 N16 O21.5 -","- C584 H640 N128 O172 -","8","1","","Hisamatsu, Shugo; Masu, Hyuma; Azumaya, Isao; Takahashi, Masahiro; Kishikawa, Keiki; Kohmoto, Shigeo","U-Shaped Aromatic Ureadicarboxylic Acids as Versatile Building Blocks: Construction of Ladder and Zigzag Networks and Channels","Crystal Growth & Design","2011","11","12","5387","","10.1021/cg200988w","","","1.54178","CuKα","","0.0746","0.063","","","0.1801","0.1898","","","","","","1.057","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501279","15.417","0.005","25.356","0.005","14.384","0.005","90","0.005","108.842","0.005","90","0.005","5322","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H52 N4 O12 Zn -","- C56 H52 N4 O12 Zn -","- C224 H208 N16 O48 Zn4 -","4","0.5","","Bhuyan, Jagannath; Sarkar, Sabyasachi","Self-Assembly of Magnesium and Zinc Trimethoxyphenylporphyrin Polymer as Nanospheres and Nanorods","Crystal Growth & Design","2011","11","12","5410","","10.1021/cg2010002","","","0.71069","MoKα","","0.0672","0.0532","","","0.1402","0.151","","","","","","1.069","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501280","15.491","0.005","25.283","0.005","14.293","0.005","90","0.005","108.877","0.005","90","0.005","5297","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H52 Mg N4 O12 -","- C56 H52 Mg N4 O12 -","- C224 H208 Mg4 N16 O48 -","4","0.5","","Bhuyan, Jagannath; Sarkar, Sabyasachi","Self-Assembly of Magnesium and Zinc Trimethoxyphenylporphyrin Polymer as Nanospheres and Nanorods","Crystal Growth & Design","2011","11","12","5410","","10.1021/cg2010002","","","0.71069","MoKα","","0.1193","0.0743","","","0.2048","0.2369","","","","","","0.984","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501281","8.5224","0.0007","10.6036","0.0009","18.3452","0.0014","103.901","0.007","92.165","0.006","111.942","0.007","1477.6","0.2","453","2","453","2","","","","","","","","6","P -1","-P 1","2","Cu-Sulphoisophthalate","","","- C20 H12 Cu6 N0 O22 S2 -","- C20 H12 Cu6 O22 S2 -","- C40 H24 Cu12 O44 S4 -","2","1","","Sarma, Debajit; Natarajan, Srinivasan","Usefulness of in Situ Single Crystal to Single Crystal Transformation (SCSC) Studies in Understanding the Temperature-Dependent Dimensionality Cross-over and Structural Reorganization in Copper-Containing Metal‒Organic Frameworks (MOFs)","Crystal Growth & Design","2011","11","12","5415","","10.1021/cg201003d","","","0.71073","MoKα","","0.1845","0.0955","","","0.2266","0.2634","","","","","","0.957","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501282","9.855","0.001","10.2262","0.0012","11.2271","0.0012","87.016","0.009","64.142","0.01","68.121","0.01","936.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Cu-Nitroisophthalate","","","- C32 H12 Cu5 N4 O26 -","- C32 H12 Cu5 N4 O26 -","- C32 H12 Cu5 N4 O26 -","1","0.5","","Sarma, Debajit; Natarajan, Srinivasan","Usefulness of in Situ Single Crystal to Single Crystal Transformation (SCSC) Studies in Understanding the Temperature-Dependent Dimensionality Cross-over and Structural Reorganization in Copper-Containing Metal‒Organic Frameworks (MOFs)","Crystal Growth & Design","2011","11","12","5415","","10.1021/cg201003d","","","0.71073","MoKα","","0.0717","0.044","","","0.1061","0.1172","","","","","","1.005","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501283","9.0215","0.0011","5.1904","0.0005","33.712","0.003","90","","95.613","0.012","90","","1571","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 N5 O4 -","- C16 H15 N5 O4 -","- C64 H60 N20 O16 -","4","1","","McHugh, Charlene; Erxleben, Andrea","Supramolecular Structures and Tautomerism of Carboxylate Salts of Adenine and Pharmaceutically RelevantN6-Substituted Adenine","Crystal Growth & Design","2011","11","11","5096","","10.1021/cg201007m","","","0.71073","MoKα","","0.1237","0.0742","","","0.1288","0.1519","","","","","","1.142","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501284","8.4126","0.0004","11.7538","0.0004","13.5103","0.0006","90","","103.951","0.005","90","","1296.49","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N5 O2 -","- C13 H12 N5 O2 -","- C52 H48 N20 O8 -","4","1","","McHugh, Charlene; Erxleben, Andrea","Supramolecular Structures and Tautomerism of Carboxylate Salts of Adenine and Pharmaceutically RelevantN6-Substituted Adenine","Crystal Growth & Design","2011","11","11","5096","","10.1021/cg201007m","","","0.71073","MoKα","","0.0571","0.0408","","","0.0967","0.1059","","","","","","1.041","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501285","13.8273","0.0009","16.7538","0.0009","13.0832","0.0009","90","","100.822","0.006","90","","2976.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 N15 O10 -","- C23 H27 N15 O10 -","- C92 H108 N60 O40 -","4","1","","McHugh, Charlene; Erxleben, Andrea","Supramolecular Structures and Tautomerism of Carboxylate Salts of Adenine and Pharmaceutically RelevantN6-Substituted Adenine","Crystal Growth & Design","2011","11","11","5096","","10.1021/cg201007m","","","0.71073","MoKα","","0.1457","0.0544","","","0.0787","0.1105","","","","","","0.901","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501286","11.0271","0.0003","16.9334","0.0005","9.6188","0.0003","90","","90","","90","","1796.08","0.09","180","","180","","","","","","","","","5","P n c 2","P 2 -2bc","30","","","","- C32 H27 N8 O17.5 Zr -","- C32 H26 N8 O17.5 Zr -","- C64 H52 N16 O35 Zr2 -","2","0.5","","Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal","Self-Assembly of Zr(C2O4)44‒Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity","Crystal Growth & Design","2011","11","12","5424","","10.1021/cg201008v","","","0.71073","MoKα","","0.036","0.0302","","0.0396","0.0339","0.033","","","","","","1.1286","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501287","10.699","0.003","16.784","0.006","10.022","0.003","90","","90","","90","","1799.7","1","373","2","373","2","","","","","","","","5","P n c 2","P 2 -2bc","30","","","","- C16 H12 N4 O8 Zr0.5 -","- C16 H12 N4 O8 Zr0.5 -","- C64 H48 N16 O32 Zr2 -","4","1","","Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal","Self-Assembly of Zr(C2O4)44‒Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity","Crystal Growth & Design","2011","11","12","5424","","10.1021/cg201008v","","","0.71073","MoKα","","0.074","0.0551","","","0.1359","0.151","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501288","19.896","0.005","10.154","0.005","21.312","0.005","90","0.005","96.116","0.005","90","0.005","4281","3","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 N8 O22 Zr -","- C36 H40 N8 O22 Zr -","- C144 H160 N32 O88 Zr4 -","4","0.5","","Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal","Self-Assembly of Zr(C2O4)44‒Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity","Crystal Growth & Design","2011","11","12","5424","","10.1021/cg201008v","","","0.71073","MoKα","","0.0353","0.0324","","","0.0945","0.0961","","","","","","1.082","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501289","21.313","0.005","10.974","0.005","18.5","0.005","90","0.005","97.862","0.005","90","0.005","4286","2","180","","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H32 N8 O20 Zr -","- C36 H32 N8 O20 Zr -","- C144 H128 N32 O80 Zr4 -","4","0.5","","Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal","Self-Assembly of Zr(C2O4)44‒Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity","Crystal Growth & Design","2011","11","12","5424","","10.1021/cg201008v","","","0.71073","MoKα","","0.0501","0.0444","","","0.1479","0.1517","","","","","","1.094","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501290","15.8577","0.0004","21.8722","0.0007","22.3681","0.0007","90","","90","","90","","7758.2","0.4","100","","100","","","","","","","","","5","I b c a","-I 2b 2c","73","","","","- C36 H33 N8 O16.5 Zr -","- C36 H32 N8 O16.5 Zr -","- C288 H256 N64 O132 Zr8 -","8","0.5","","Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal","Self-Assembly of Zr(C2O4)44–Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity","Crystal Growth & Design","2011","11","12","5424","","10.1021/cg201008v","","","0.71073","MoKα","","0.0557","0.0422","","0.0724","0.0407","0.0366","","","","","","1.0717","","","","has coordinates","288252","2023-12-12","14:26:24",""
"4501291","13.8592","0.0004","13.0033","0.0004","22.7481","0.0007","90","","104.311","0.001","90","","3972.3","0.2","300","","300","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 N8 O19 Zr -","- C32 H24 N8 O19 Zr -","- C128 H96 N32 O76 Zr4 -","4","1","","Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal","Self-Assembly of Zr(C2O4)44‒Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity","Crystal Growth & Design","2011","11","12","5424","","10.1021/cg201008v","","","0.71073","MoKα","","0.1139","0.0569","","0.1026","0.06","0.0569","","","","","","0.9823","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501292","16.55518","0.0002","5.52088","0.00007","8.88587","0.00008","90","","90","","90","","812.161","0.016","298","","298","","","","","","","","","3","P m 21 n","P -2ab -2","31","","","","- La6 O18 W3 -","- La6 O18 W3 -","- La12 O36 W6 -","2","0.5","","Allix, Mathieu; Chambrier, Marie-Hélène; Véron, Emmanuel; Porcher, Florence; Suchomel, Matthew; Goutenoire, François","Synthesis and Structure Determination of the High Temperature Form of La2WO6","Crystal Growth & Design","2011","11","11","5105","","10.1021/cg201010y","powder diffraction","neutron","1.2254","ConstantWavelengthNeutronDiffraction","","","","","","","","","3.7302","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501293","9.571","0.001","11.412","0.001","15.354","0.001","100.112","0.002","104.855","0.002","107.673","0.002","1484.9","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H38 N2 Ni O5 -","- C32 H32 N2 Ni O5 -","- C64 H64 N4 Ni2 O10 -","2","1","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.1429","0.1345","","","0.2842","0.2893","","","","","","1.174","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501294","7.991","0.001","9.525","0.001","11.412","0.001","73.263","0.002","69.952","0.002","89.353","0.002","777.72","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H44 N2 Ni O4 -","- C36 H44 N2 Ni O4 -","- C36 H44 N2 Ni O4 -","1","0.5","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.0849","0.0821","","","0.1995","0.2015","","","","","","1.112","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501295","14.479","0.001","7.486","0.001","18.681","0.001","90","","117.004","0.002","90","","1804.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 N2 Ni O4 -","- C40 H52 N2 Ni O4 -","- C80 H104 N4 Ni2 O8 -","2","0.5","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.109","0.0888","","","0.2071","0.2237","","","","","","1.091","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501296","9.377","0.001","9.594","0.001","11.204","0.001","103.73","0.001","93.568","0.002","108.922","0.002","915.54","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H56 N2 Ni O4 -","- C42 H56 N2 Ni O4 -","- C42 H56 N2 Ni O4 -","1","0.5","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.0561","0.0543","","","0.151","0.1526","","","","","","1.059","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501297","30.098","0.002","7.534","0.001","18.595","0.001","90","","94.259","0.003","90","","4204.9","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H64 N2 Ni O4 -","- C46 H64 N2 Ni O4 -","- C184 H256 N8 Ni4 O16 -","4","1","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.3764","0.3146","","","0.699","0.7293","","","","","","2.699","","","","has coordinates","179543","2020-10-21","18:00:00",""
"4501298","9.437","0.001","11.538","0.001","11.999","0.001","105.351","0.001","104.803","0.002","93.052","0.002","1207.79","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H78 N2 Ni O5 -","- C53 H78 N2 Ni O5 -","- C53 H78 N2 Ni O5 -","1","0.5","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.0658","0.0622","","","0.1508","0.153","","","","","","1.124","","","","has coordinates,has disorder","179543","2020-10-21","18:00:00",""
"4501299","42.384","0.001","42.384","","5.095","0.001","90","","90","","120","","7926.4","1.6","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C40 H52 N2 Ni O2.5 -","- C38 H48 N2 Ni O2 -","- C342 H432 N18 Ni9 O18 -","9","0.5","","Hara, Satomi; Houjou, Hirohiko; Yoshikawa, Isao; Araki, Koji","Relation between Crystal Packing and Optical Anisotropy for Schiff Base-Nickel Complexes that Form Various Ladder-like Hydrogen-Bonding Networks","Crystal Growth & Design","2011","11","11","5113","","10.1021/cg201013v","","","1.54184","CuKα","","0.0665","0.0564","","","0.1449","0.152","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501300","12.637","0.002","13.23","0.005","8.256","0.006","90","","102.01","0.005","90","","1350.1","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 N2 O2 -","- C15 H18 N2 O2 -","- C60 H72 N8 O8 -","4","1","","Lama, Prem; Bharadwaj, Parimal K.","Three New Isostructural Coordination Polymers with Cd(II) Clusters as the SBU: Synthesis, Structural Characterization, and Luminescence Properties","Crystal Growth & Design","2011","11","12","5434","","10.1021/cg201028e","","","0.71073","MoKα","","0.0892","0.0596","","","0.1422","0.1708","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501301","16.499","0.005","16.499","0.005","16.499","0.005","90","","90","","90","","4491","2","298","2","298","2","","","","","","","","6","P 41 3 2","P 4bd 2ab 3","213","","","","- C13 H13.67 Cd1.33 Cl0.67 N5 O2.67 -","- C13 H13.66 Cd1.33333 Cl0.666667 N5 O2.66667 -","- C156 H163.92 Cd16 Cl8 N60 O32 -","12","0.5","","Lama, Prem; Bharadwaj, Parimal K.","Three New Isostructural Coordination Polymers with Cd(II) Clusters as the SBU: Synthesis, Structural Characterization, and Luminescence Properties","Crystal Growth & Design","2011","11","12","5434","","10.1021/cg201028e","","","0.71073","MoKα","","0.1561","0.075","","","0.1723","0.2222","","","","","","1.003","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501302","16.635","0.003","16.635","0.003","16.635","0.003","90","","90","","90","","4603.3","1.4","298","2","298","2","","","","","","","","6","P 41 3 2","P 4bd 2ab 3","213","","","","- C13 H13.67 Br0.67 Cd1.33 N5 O2.67 -","- C14 H13.66 Br0.666667 Cd1.33333 N5 O2.66667 -","- C168 H163.92 Br8 Cd16 N60 O32 -","12","0.5","","Lama, Prem; Bharadwaj, Parimal K.","Three New Isostructural Coordination Polymers with Cd(II) Clusters as the SBU: Synthesis, Structural Characterization, and Luminescence Properties","Crystal Growth & Design","2011","11","12","5434","","10.1021/cg201028e","","","0.71073","MoKα","","0.1488","0.0849","","","0.2088","0.2538","","","","","","1.01","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501303","16.614","0.005","16.614","0.005","16.614","0.005","90","","90","","90","","4586","2","298","2","298","2","","","","","","","","6","P 41 3 2","P 4bd 2ab 3","213","","","","- C13 H13.67 Cd1.33 I0.67 N5 O2.67 -","- C13 H13.26 Cd1.33333 I0.666667 N5 O2.66667 -","- C156 H159.12 Cd16 I8 N60 O32 -","12","0.5","","Lama, Prem; Bharadwaj, Parimal K.","Three New Isostructural Coordination Polymers with Cd(II) Clusters as the SBU: Synthesis, Structural Characterization, and Luminescence Properties","Crystal Growth & Design","2011","11","12","5434","","10.1021/cg201028e","","","0.71073","MoKα","","0.1236","0.0969","","","0.2144","0.2341","","","","","","1.086","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501304","19.641","0.017","19.641","0.017","45.07","0.03","90","","90","","120","","15057","2","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C48 H33.33 Er3 O30.5 -","- C48 H27 Er3 O30.46 -","- C288 H162 Er18 O182.76 -","6","0.333333","","Yang, Jin; Song, Shu-Yan; Ma, Jian-Fang; Liu, Ying-Ying; Yu, Zhen-Tao","Syntheses, Structures, Photoluminescence, and Gas Adsorption of Rare Earth‒Organic Frameworks Based on a Flexible Tricarboxylate","Crystal Growth & Design","2011","11","12","5469","","10.1021/cg2010425","","","0.71073","MoKα","","0.0536","0.0409","","","0.1566","0.1634","","","","","","1.094","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501305","19.7921","0.0009","19.7921","0.0009","45.383","0.0017","90","","90","","120","","15396","1.1","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C48 H31 Dy3 O27 -","- C48 H27 Dy3 O26.99 -","- C288 H162 Dy18 O161.94 -","6","0.333333","","Yang, Jin; Song, Shu-Yan; Ma, Jian-Fang; Liu, Ying-Ying; Yu, Zhen-Tao","Syntheses, Structures, Photoluminescence, and Gas Adsorption of Rare Earth‒Organic Frameworks Based on a Flexible Tricarboxylate","Crystal Growth & Design","2011","11","12","5469","","10.1021/cg2010425","","","0.71073","MoKα","","0.0823","0.0437","","","0.1445","0.1514","","","","","","0.966","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501306","19.8558","0.0007","19.8558","0.0007","45.5011","0.0014","90","","90","","120","","15535.6","0.9","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C48 H31 O27 Tb3 -","- C48 H27 O26.95 Tb3 -","- C288 H162 O161.7 Tb18 -","6","0.333333","","Yang, Jin; Song, Shu-Yan; Ma, Jian-Fang; Liu, Ying-Ying; Yu, Zhen-Tao","Syntheses, Structures, Photoluminescence, and Gas Adsorption of Rare Earth‒Organic Frameworks Based on a Flexible Tricarboxylate","Crystal Growth & Design","2011","11","12","5469","","10.1021/cg2010425","","","0.71073","MoKα","","0.0722","0.0499","","","0.178","0.1868","","","","","","1.059","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501307","8.1448","0.001","17.478","0.003","11.1576","0.0015","90","","94.266","0.004","90","","1583.9","0.4","123","2","123","2","","","101.3","","","","","4","C 1 2/c 1","-C 2yc","15","5-aminoisophthalic acid hemihydrate","","","- C8 H8 N O4.5 -","- C8 H8 N O4.5 -","- C64 H64 N8 O36 -","8","1","","Fujii, Kotaro; Sakon, Aya; Sekine, Akiko; Uekusa, Hidehiro","Reversible Color Switching of an Organic Crystal Induced by Organic Solvent Vapors","Crystal Growth & Design","2011","11","10","4305","","10.1021/cg2010437","","x-ray","0.71075","MoKα","","0.0452","0.0403","","","0.1078","0.1118","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501308","3.6585","0.0003","14.7575","0.0012","14.6863","0.0011","90","","90","","90","","792.92","0.11","123","2","123","2","","","101.3","","","","","4","P b c n","-P 2n 2ab","60","5-aminoisophthalic acid","","","- C8 H7 N O4 -","- C8 H7 N O4 -","- C32 H28 N4 O16 -","4","0.5","","Fujii, Kotaro; Sakon, Aya; Sekine, Akiko; Uekusa, Hidehiro","Reversible Color Switching of an Organic Crystal Induced by Organic Solvent Vapors","Crystal Growth & Design","2011","11","10","4305","","10.1021/cg2010437","","x-ray","0.71075","MoKα","","0.0519","0.039","","","0.1008","0.1107","","","","","","1.067","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501309","29.31","0.014","7.026","0.003","9.173","0.004","90","","106.564","0.018","90","","1810.6","1.4","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 N4 O2 -","- C22 H22 N4 O2 -","- C88 H88 N16 O8 -","4","0.5","","Kalita, Dipjyoti; Baruah, Jubaraj B.","Acid Inclusion Properties of Helical Self-Assembly of a 5,5′-Biquinoline Derivative","Crystal Growth & Design","2011","11","11","5131","","10.1021/cg201052k","","","0.71073","MoKα","","0.0763","0.0445","","","0.1113","0.1246","","","","","","0.902","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501310","51.844","0.011","8.1994","0.0019","24.616","0.006","90","","90","","90","","10464","4","296","2","296","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C22 H24 Cl2 N4 O10 -","- C22 H24 Cl2 N4 O10 -","- C352 H384 Cl32 N64 O160 -","16","0.5","","Kalita, Dipjyoti; Baruah, Jubaraj B.","Acid Inclusion Properties of Helical Self-Assembly of a 5,5′-Biquinoline Derivative","Crystal Growth & Design","2011","11","11","5131","","10.1021/cg201052k","","","0.71073","MoKα","","0.2256","0.1216","","","0.26","0.2872","","","","","","1.972","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501311","14.64","0.005","20.521","0.005","8.322","0.002","90","","90","","90","","2500.2","1.2","296","2","296","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C22 H24 N6 O10 -","- C22 H24 N6 O10 -","- C88 H96 N24 O40 -","4","0.5","","Kalita, Dipjyoti; Baruah, Jubaraj B.","Acid Inclusion Properties of Helical Self-Assembly of a 5,5′-Biquinoline Derivative","Crystal Growth & Design","2011","11","11","5131","","10.1021/cg201052k","","","0.71073","MoKα","","0.2274","0.1038","","","0.2092","0.245","","","","","","1.274","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501312","34.3111","0.001","40.5399","0.0011","20.3265","0.0007","90","","90","","90","","28273.5","1.5","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C138 H92 Cd12 N115 -","- C138 H92 Cd12 N115 -","- C552 H368 Cd48 N460 -","4","0.5","","Pachfule, Pradip; Banerjee, Rahul","Porous Nitrogen Rich Cadmium-Tetrazolate Based Metal Organic Framework (MOF) for H2and CO2Uptake","Crystal Growth & Design","2011","11","12","5176","","10.1021/cg201054f","","","0.71073","MoKα","","0.0687","0.0531","","","0.1478","0.1583","","","","","","1.035","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501313","9.3287","0.0003","17.3921","0.0006","12.0743","0.0003","90","","104.795","0.0009","90","","1894.05","0.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H24 N4 O8 Zn -","- C13 H24 N4 O8 Zn -","- C52 H96 N16 O32 Zn4 -","4","1","","Hao, Hong-Jun; Sun, Di; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Discrete Octamer Water Cluster and 1D T5(2) Water Tape Trapped in Two Luminescent Zn(II)/1,2-Bis(imidazol-1′-yl)ethane/Dicarboxylate Hosts: From 2D (4,4) Net to 3D 5-Fold Interpenetrated Diamond Network","Crystal Growth & Design","2011","11","12","5475","","10.1021/cg201067q","","","0.71073","MoKα","","0.0881","0.0764","","","0.223","0.2355","","","","","","0.943","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501314","6.5568","0.0011","15.078","0.003","20.543","0.003","90","","90","","90","","2031","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 N4 O7 Zn -","- C16 H28 N4 O7 Zn -","- C64 H112 N16 O28 Zn4 -","4","1","","Hao, Hong-Jun; Sun, Di; Liu, Fu-Jing; Huang, Rong-Bin; Zheng, Lan-Sun","Discrete Octamer Water Cluster and 1D T5(2) Water Tape Trapped in Two Luminescent Zn(II)/1,2-Bis(imidazol-1′-yl)ethane/Dicarboxylate Hosts: From 2D (4,4) Net to 3D 5-Fold Interpenetrated Diamond Network","Crystal Growth & Design","2011","11","12","5475","","10.1021/cg201067q","","","0.71073","MoKα","","0.0331","0.0322","","","0.082","0.0826","","","","","","1.049","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501315","5.5635","0.0012","5.5635","0.0012","13.835","0.004","90","","90","","120","","370.86","0.16","296.1","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","","","- Bi Fe O3 -","- Bi Fe O3 -","- Bi6 Fe6 O18 -","6","0.333333","","Ito, Toshimitsu; Ushiyama, Tomoharu; Yanagisawa, Yuji; Kumai, Reiji; Tomioka, Yasuhide","Growth of Highly Insulating Bulk Single Crystals of Multiferroic BiFeO3and Their Inherent Internal Strains in the Domain-Switching Process","Crystal Growth & Design","2011","11","11","5139","","10.1021/cg201068m","","","0.93868","synchrotron","","","0.0286","","","","0.0852","","","","","","1.249","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501316","11.3439","0.0004","8.9239","0.0003","21.8087","0.0008","90","","102.874","0.002","90","","2152.24","0.13","296.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H16 O4 -","- C30 H16 O4 -","- C120 H64 O16 -","4","1","","Hisaki, Ichiro; Kometani, Eriko; Shigemitsu, Hajime; Saeki, Akinori; Seki, Shu; Tohnai, Norimitsu; Miyata, Mikiji","Polymorphism of Dehydrobenzo[14]annulene Possessing Two Methyl Ester Groups in Noncentrosymmetric Positions","Crystal Growth & Design","2011","11","12","5488","5497","10.1021/cg201075z","","","0.7","synchrotron","","","0.0718","","","","0.2028","","","","","","1.133","","","","has coordinates","211133","2020-10-21","18:00:00",""
"4501317","11.5094","0.0002","8.92224","0.00016","21.9131","0.0004","90","","102.471","0.0009","90","","2197.15","0.07","213","","213","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H16 O4 -","- C30 H16 O4 -","- C120 H64 O16 -","4","1","","Hisaki, Ichiro; Kometani, Eriko; Shigemitsu, Hajime; Saeki, Akinori; Seki, Shu; Tohnai, Norimitsu; Miyata, Mikiji","Polymorphism of Dehydrobenzo[14]annulene Possessing Two Methyl Ester Groups in Noncentrosymmetric Positions","Crystal Growth & Design","2011","11","12","5488","5497","10.1021/cg201075z","","","1.54187","CuKα","","","0.0521","","","","0.1484","","","","","","1.087","","","","has coordinates","211133","2020-10-21","18:00:00",""
"4501318","10.13","0.0001","13.8586","0.0002","16.1692","0.0003","90","","107.154","0.0006","90","","2168.98","0.06","296.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H16 O4 -","- C30 H16 O4 -","- C120 H64 O16 -","4","1","","Hisaki, Ichiro; Kometani, Eriko; Shigemitsu, Hajime; Saeki, Akinori; Seki, Shu; Tohnai, Norimitsu; Miyata, Mikiji","Polymorphism of Dehydrobenzo[14]annulene Possessing Two Methyl Ester Groups in Noncentrosymmetric Positions","Crystal Growth & Design","2011","11","12","5488","5497","10.1021/cg201075z","","","0.7","synchrotron","","","0.0621","","","","0.1776","","","","","","1.104","","","","has coordinates","211133","2020-10-21","18:00:00",""
"4501319","9.88125","0.00018","10.12115","0.00018","22.1855","0.0004","95.305","0.0009","93.75","0.0009","91.771","0.001","2203","0.07","213.1","","213","","","","","","","","","3","P -1","-P 1","2","","","","- C30 H16 O4 -","- C30 H16 O4 -","- C120 H64 O16 -","4","2","","Hisaki, Ichiro; Kometani, Eriko; Shigemitsu, Hajime; Saeki, Akinori; Seki, Shu; Tohnai, Norimitsu; Miyata, Mikiji","Polymorphism of Dehydrobenzo[14]annulene Possessing Two Methyl Ester Groups in Noncentrosymmetric Positions","Crystal Growth & Design","2011","11","12","5488","5497","10.1021/cg201075z","","","1.54187","CuKα","","","0.0654","","","","0.1578","","","","","","0.848","","","","has coordinates","211133","2020-10-21","18:00:00",""
"4501320","25.991","0.004","3.871","0.0003","21.352","0.004","90","","100.522","0.007","90","","2112.1","0.5","93.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H16 O4 -","- C30 H16 O4 -","- C120 H64 O16 -","4","1","","Hisaki, Ichiro; Kometani, Eriko; Shigemitsu, Hajime; Saeki, Akinori; Seki, Shu; Tohnai, Norimitsu; Miyata, Mikiji","Polymorphism of Dehydrobenzo[14]annulene Possessing Two Methyl Ester Groups in Noncentrosymmetric Positions","Crystal Growth & Design","2011","11","12","5488","5497","10.1021/cg201075z","","","0.7","synchrotron","","","0.1683","","","","0.454","","","","","","2.028","","","","has coordinates","211133","2020-10-21","18:00:00",""
"4501321","46.139","0.0008","3.8558","0.0001","28.7157","0.0007","90","","123.614","0.0009","90","","4254.38","0.17","296.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 O4 -","- C30 H16 O4 -","- C240 H128 O32 -","8","1","","Hisaki, Ichiro; Kometani, Eriko; Shigemitsu, Hajime; Saeki, Akinori; Seki, Shu; Tohnai, Norimitsu; Miyata, Mikiji","Polymorphism of Dehydrobenzo[14]annulene Possessing Two Methyl Ester Groups in Noncentrosymmetric Positions","Crystal Growth & Design","2011","11","12","5488","5497","10.1021/cg201075z","","","0.7","synchrotron","","","0.0697","","","","0.2038","","","","","","1.034","","","","has coordinates","211133","2020-10-21","18:00:00",""
"4501322","8.0151","0.0003","8.2236","0.0003","10.1892","0.0004","97.859","0.002","111.1","0.003","90.847","0.003","619.2","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H11 N3 O5 -","- C13 H11 N3 O5 -","- C26 H22 N6 O10 -","2","1","","Das, Babulal; Baruah, Jubaraj B.","Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids","Crystal Growth & Design","2011","11","12","5522","","10.1021/cg201096c","","","0.71073","MoKα","","0.0556","0.0388","","","0.1009","0.1113","","","","","","1.144","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501323","13.5546","0.0007","5.0299","0.0002","20.115","0.0009","90","","101.635","0.003","90","","1343.23","0.11","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 N3 O6 -","- C13 H13 N3 O6 -","- C52 H52 N12 O24 -","4","1","","Das, Babulal; Baruah, Jubaraj B.","Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids","Crystal Growth & Design","2011","11","12","5522","","10.1021/cg201096c","","","0.71073","MoKα","","0.0766","0.0458","","","0.1261","0.1494","","","","","","0.924","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501324","13.8752","0.0005","7.1838","0.0003","17.8301","0.0008","90","","99.906","0.003","90","","1750.75","0.13","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 N6 O6 -","- C17 H16 N6 O6 -","- C68 H64 N24 O24 -","4","1","","Das, Babulal; Baruah, Jubaraj B.","Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids","Crystal Growth & Design","2011","11","12","5522","","10.1021/cg201096c","","","0.71073","MoKα","","0.06","0.0436","","","0.1264","0.1388","","","","","","1.009","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501325","13.111","0.003","3.7622","0.0008","27.767","0.006","90","","92.905","0.015","90","","1367.9","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 N3 O6 -","- C13 H11 N3 O6 -","- C52 H44 N12 O24 -","4","1","","Das, Babulal; Baruah, Jubaraj B.","Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids","Crystal Growth & Design","2011","11","12","5522","","10.1021/cg201096c","","","0.71073","MoKα","","0.146","0.079","","","0.1899","0.2526","","","","","","0.941","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501326","3.6888","0.0005","11.9356","0.0013","14.3954","0.0015","77.356","0.007","87.328","0.007","87.862","0.008","617.52","0.13","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 N4 O6 -","- C11 H10 N4 O6 -","- C22 H20 N8 O12 -","2","1","","Das, Babulal; Baruah, Jubaraj B.","Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids","Crystal Growth & Design","2011","11","12","5522","","10.1021/cg201096c","","","0.71073","MoKα","","0.077","0.0661","","","0.1728","0.1852","","","","","","1.021","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501327","3.7184","0.0003","13.3383","0.0009","25.3647","0.0018","90","","93.4","0.005","90","","1255.8","0.16","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 N3 O6 -","- C13 H11 N3 O6 -","- C52 H44 N12 O24 -","4","1","","Das, Babulal; Baruah, Jubaraj B.","Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids","Crystal Growth & Design","2011","11","12","5522","","10.1021/cg201096c","","","0.71073","MoKα","","0.0956","0.063","","","0.2191","0.235","","","","","","1.081","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501328","11.2517","0.0004","13.7154","0.0004","16.8141","0.0006","90","","106.623","0.004","90","","2486.34","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 N4 O7 Zn2 -","- C24 H20 N4 O7 Zn2 -","- C96 H80 N16 O28 Zn8 -","4","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0612","0.0308","","","0.0521","0.0544","","","","","","0.776","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501329","19.6978","0.0009","14.2703","0.0004","18.4545","0.0007","90","","105.249","0.004","90","","5004.8","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H24 Cd N4 O6 -","- C24 H18 Cd N4 O6 -","- C192 H144 Cd8 N32 O48 -","8","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0669","0.0325","","","0.0688","0.074","","","","","","0.803","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501330","8.6045","0.0003","29.8829","0.001","11.1362","0.0004","90","","112.399","0.004","90","","2647.38","0.18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 Cd N4 O6 -","- C26 H28 Cd N4 O6 -","- C104 H112 Cd4 N16 O24 -","4","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0524","0.0396","","","0.078","0.0834","","","","","","1.058","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501331","21.3725","0.0006","6.6892","0.0002","18.316","0.0005","90","","99.885","0.003","90","","2579.67","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 Cd N4 O6 -","- C26 H16 Cd N4 O6 -","- C104 H64 Cd4 N16 O24 -","4","0.5","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0384","0.0325","","","0.0844","0.0858","","","","","","0.983","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501332","11.4557","0.0005","13.6034","0.0004","17.3626","0.0007","90","","101.6","0.004","90","","2650.46","0.18","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 Cl2 N4 O7 Zn2 -","- C24 H22 Cl2 N4 O7 Zn2 -","- C96 H88 Cl8 N16 O28 Zn8 -","4","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0854","0.0343","","","0.0481","0.052","","","","","","0.696","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501333","21.8584","0.0011","6.6597","0.0003","18.0788","0.0009","90","","103.031","0.005","90","","2564","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Cd Cl2 N4 O6 -","- C24 H22 Cd Cl2 N4 O6 -","- C96 H88 Cd4 Cl8 N16 O24 -","4","0.5","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0289","0.0246","","","0.0651","0.0662","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501334","22.8165","0.0007","13.3509","0.0003","17.3654","0.0005","90","","102.878","0.003","90","","5156.8","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Cl2 N4 O7 Zn2 -","- C24 H18 Cl2 N4 O7 Zn2 -","- C192 H144 Cl16 N32 O56 Zn16 -","8","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0506","0.03","","","0.0605","0.0627","","","","","","0.87","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501335","8.8008","0.0004","13.2055","0.0007","14.7201","0.0008","75.022","0.005","84.608","0.004","81.718","0.004","1632.51","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H31 Cd Cl2 N6 O7 -","- C29 H25 Cd Cl2 N6 O7 -","- C58 H50 Cd2 Cl4 N12 O14 -","2","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.038","0.0308","","","0.0791","0.0806","","","","","","0.98","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501336","23.4341","0.0009","13.3311","0.0005","17.2856","0.0008","90","","103.112","0.004","90","","5259.3","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Br2 N4 O7 Zn2 -","- C24 H18 Br2 N4 O7 Zn2 -","- C192 H144 Br16 N32 O56 Zn16 -","8","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0713","0.0321","","","0.0546","0.0576","","","","","","0.738","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501337","11.423","0.0005","11.6505","0.0004","12.0593","0.0006","88.882","0.004","65.94","0.004","67.746","0.004","1338.92","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H22 Br2 Cd N4 O6 -","- C24 H22 Br2 Cd N4 O6 -","- C48 H44 Br4 Cd2 N8 O12 -","2","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0464","0.0348","","","0.0858","0.0881","","","","","","0.989","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501338","12.5216","0.0005","16.6325","0.0005","18.2844","0.0007","90","","106.623","0.004","90","","3648.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H36 N10 O11 Zn2 -","- C34 H34 N10 O11 Zn2 -","- C136 H136 N40 O44 Zn8 -","4","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0423","0.0267","","","0.0563","0.0578","","","","","","0.879","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501339","24.4367","0.0009","15.4726","0.0005","23.1895","0.0009","90","","118.59","0.005","90","","7698.8","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H38 Cd2 N10 O12 -","- C34 H36 Cd2 N10 O12 -","- C272 H288 Cd16 N80 O96 -","8","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0422","0.0248","","","0.0523","0.0541","","","","","","0.869","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501340","14.9735","0.0006","9.3372","0.0003","14.3187","0.0006","90","","90","","90","","2001.91","0.13","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C17 H19 N4 O6.5 S Zn -","- C17 H18 N4 O6.5 S Zn -","- C68 H72 N16 O26 S4 Zn4 -","4","1","","Yang, Yan; Du, Peng; Ma, Jian-Fang; Kan, Wei-Qiu; Liu, Bo; Yang, Jin","A Series of Metal‒Organic Frameworks Based on Different Salicylic Derivatives and 1,1′-(1,4-Butanediyl)bis(imidazole) Ligand: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2011","11","12","5540","","10.1021/cg201118x","","","0.71073","MoKα","","0.0356","0.0301","","","0.0751","0.0796","","","","","","1.075","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501341","22.1486","0.0011","22.1486","0.0011","23.6629","0.0013","90","","90","","120","","10052.9","0.9","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","[Ni(aepa)2]3Sb6S12","","","- C30 H90 N18 Ni3 S12 Sb6 -","- C30 H90 N18 Ni3 S12 Sb6 -","- C180 H540 N108 Ni18 S72 Sb36 -","6","0.333333","","Seidlhofer, Beatrix; Djamil, John; Näther, Christian; Bensch, Wolfgang","From Zero- to Three-Dimensional Thioantimonates: [Ni(aepa)2]3Sb6S12(aepa = C5H15N3=N-(aminoethyl)-1,3-propandiamine), Containing the Unique [Sb6S12]6‒Cyclic Anion, [Ni(aepa)2]6(Sb3S6)2(SO4)3·2H2O, with Isolated [Sb3S6]3‒anions and [Ni(aepa)2]Sb4S7, Characterized by a Three-Dimensional Network Structure","Crystal Growth & Design","2011","11","12","5554","","10.1021/cg201122e","","","0.71073","MoKα","","0.0481","0.038","","","0.0974","0.1028","","","","","","1.067","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501342","13.3436","0.0008","14.1266","0.0009","18.3991","0.0012","73.635","0.007","85.432","0.007","63.2","0.007","2965.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[Ni(aepa)2]6(Sb3S6)2(SO4)3*2H2O","","","- C60 H180 N36 Ni6 O14 S15 Sb6 -","- C60 H180 N36 Ni6 O14 S15 Sb6 -","- C60 H180 N36 Ni6 O14 S15 Sb6 -","1","0.5","","Seidlhofer, Beatrix; Djamil, John; Näther, Christian; Bensch, Wolfgang","From Zero- to Three-Dimensional Thioantimonates: [Ni(aepa)2]3Sb6S12(aepa = C5H15N3=N-(aminoethyl)-1,3-propandiamine), Containing the Unique [Sb6S12]6‒Cyclic Anion, [Ni(aepa)2]6(Sb3S6)2(SO4)3·2H2O, with Isolated [Sb3S6]3‒anions and [Ni(aepa)2]Sb4S7, Characterized by a Three-Dimensional Network Structure","Crystal Growth & Design","2011","11","12","5554","","10.1021/cg201122e","","","0.71073","MoKα","","0.0766","0.0406","","","0.0753","0.085","","","","","","0.935","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501343","14.3884","0.001","12.1193","0.0006","16.1524","0.0011","90","","94.175","0.008","90","","2809.1","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Ni(aepa)2]Sb4S7","","","- C10 H30 N6 Ni S7 Sb4 -","- C10 H30 N6 Ni S7 Sb4 -","- C40 H120 N24 Ni4 S28 Sb16 -","4","0.5","","Seidlhofer, Beatrix; Djamil, John; Näther, Christian; Bensch, Wolfgang","From Zero- to Three-Dimensional Thioantimonates: [Ni(aepa)2]3Sb6S12(aepa = C5H15N3=N-(aminoethyl)-1,3-propandiamine), Containing the Unique [Sb6S12]6‒Cyclic Anion, [Ni(aepa)2]6(Sb3S6)2(SO4)3·2H2O, with Isolated [Sb3S6]3‒anions and [Ni(aepa)2]Sb4S7, Characterized by a Three-Dimensional Network Structure","Crystal Growth & Design","2011","11","12","5554","","10.1021/cg201122e","","","0.71073","MoKα","","0.025","0.0221","","","0.0545","0.0557","","","","","","1.067","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501344","10.1924","0.0003","11.706","0.0003","16.9698","0.0004","80.3176","0.0008","82.9188","0.0008","64.7791","0.0007","1802.57","0.08","294","1","294","1","","","","","","","","6","P -1","-P 1","2","","","","- C56 H32 Cu3 I8 N24 W2 -","- C56 H32 Cu3 I8 N24 W2 -","- C56 H32 Cu3 I8 N24 W2 -","1","0.5","","Tsunobuchi, Yoshihide; Kaneko, Souhei; Nakabayashi, Koji; Ohkoshi, Shin-ichi","High Thermal Durability of Water-Free Copper-Octacyanotungsten-Based Magnets Containing Halogen Bonds","Crystal Growth & Design","2011","11","12","5561","","10.1021/cg2011265","","","0.71075","MoKα","","","0.0401","","","","0.1134","","","","","","1.101","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501345","10.1695","0.0003","11.7943","0.0003","16.2736","0.0004","81.66","0.0007","82.604","0.0008","64.616","0.0007","1739.95","0.08","296","1","296","1","","","","","","","","6","P -1","-P 1","2","","","","- C56 H32 Br8 Cu3 N24 W2 -","- C56 H32 Br8 Cu3 N24 W2 -","- C56 H32 Br8 Cu3 N24 W2 -","1","0.5","","Tsunobuchi, Yoshihide; Kaneko, Souhei; Nakabayashi, Koji; Ohkoshi, Shin-ichi","High Thermal Durability of Water-Free Copper-Octacyanotungsten-Based Magnets Containing Halogen Bonds","Crystal Growth & Design","2011","11","12","5561","","10.1021/cg2011265","","","0.71075","MoKα","","","0.0419","","","","0.1047","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501346","10.017","0.0002","20.5075","0.0004","15.8952","0.0004","90","","95.677","0.001","90","","3249.23","0.12","295","","295","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H22 Cl6 Cu3 N22 O6 W2 -","- C46 H22 Cl6 Cu3 N22 O6 W2 -","- C92 H44 Cl12 Cu6 N44 O12 W4 -","2","0.5","","Tsunobuchi, Yoshihide; Kaneko, Souhei; Nakabayashi, Koji; Ohkoshi, Shin-ichi","High Thermal Durability of Water-Free Copper-Octacyanotungsten-Based Magnets Containing Halogen Bonds","Crystal Growth & Design","2011","11","12","5561","","10.1021/cg2011265","","","0.71075","MoKα","","","0.0312","","","","0.0744","","","","","","1.114","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501347","30.0742","0.0007","44.9301","0.0009","18.4571","0.0005","90","","107.961","0.001","90","","23724.5","1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C57 H44 Cu3 N6 O15 -","- C57 H44 Cu3 N6 O15 -","- C456 H352 Cu24 N48 O120 -","8","1","","Roberts, John M.; Farha, Omar K.; Sarjeant, Amy A.; Hupp, Joseph T.; Scheidt, Karl A.","Two Azolium Rings Are Better Than One: A Strategy for Controlling Catenation and Morphology in Zn and Cu Metal‒Organic Frameworks","Crystal Growth & Design","2011","11","11","4747","","10.1021/cg2011309","","","1.54178","CuKα","","0.108","0.0802","","","0.2253","0.2471","","","","","","0.939","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501348","42.6542","0.0008","42.6542","0.0008","12.8454","0.0003","90","","90","","120","","20239.6","0.7","100","2","100","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C24 H20 Cu N4 O5 -","- C23.5 H20 Cu N4 O5 -","- C423 H360 Cu18 N72 O90 -","18","0.5","","Roberts, John M.; Farha, Omar K.; Sarjeant, Amy A.; Hupp, Joseph T.; Scheidt, Karl A.","Two Azolium Rings Are Better Than One: A Strategy for Controlling Catenation and Morphology in Zn and Cu Metal‒Organic Frameworks","Crystal Growth & Design","2011","11","11","4747","","10.1021/cg2011309","","","0.71073","MoKα","","0.0986","0.0821","","","0.2594","0.2727","","","","","","1.101","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501349","24.3627","0.0007","23.9175","0.0007","17.0679","0.0005","90","","91.52","0.001","90","","9941.9","0.5","100","2","100","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C54 H36 N6 O13 Zn4 -","- C54 H36 N6 O13 Zn4 -","- C216 H144 N24 O52 Zn16 -","4","0.5","","Roberts, John M.; Farha, Omar K.; Sarjeant, Amy A.; Hupp, Joseph T.; Scheidt, Karl A.","Two Azolium Rings Are Better Than One: A Strategy for Controlling Catenation and Morphology in Zn and Cu Metal‒Organic Frameworks","Crystal Growth & Design","2011","11","11","4747","","10.1021/cg2011309","","","1.54178","CuKα","","0.1416","0.1166","","","0.273","0.2965","","","","","","1.023","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501350","7.967","0.003","10.714","0.004","25.047","0.007","90.457","0.012","47.347","0.015","104.474","0.013","1482.9","1","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H22 Br N4 Ni O4 S2 -","- C32 H22 Br N4 Ni O4 S2 -","- C64 H44 Br2 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1329","0.0577","","","0.1056","0.1269","","","","","","0.937","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501351","7.9949","0.0005","10.5604","0.0006","25.1285","0.001","90.129","0.002","46.516","0.002","104.497","0.002","1446.03","0.15","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H23 N4 Ni O4 S2 -","- C32 H23 N4 Ni O4 S2 -","- C64 H46 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1427","0.0598","","","0.1222","0.1631","","","","","","0.951","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501352","7.914","0.004","10.998","0.007","25.259","0.01","94.67","0.03","47.86","0.02","109.29","0.03","1507.5","1.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H23 N4 Ni O4 S2 -","- C33 H23 N4 Ni O4 S2 -","- C66 H46 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.245","0.0847","","","0.1624","0.2143","","","","","","0.887","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501353","8.0561","0.0014","10.532","0.003","25.053","0.004","89.246","0.008","46.529","0.009","104.237","0.009","1444.1","0.6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.5 H22.5 N4.5 Ni O4.5 S2 -","- C32.5 H22.5 N4.5 Ni O4.5 S2 -","- C65 H45 N9 Ni2 O9 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1353","0.0579","","","0.0985","0.1153","","","","","","0.918","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4501354","8.08","0.003","10.559","0.004","25.127","0.008","90.539","0.014","46.499","0.017","104.295","0.016","1467","1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H23 N4 Ni O4 S2 -","- C33 H23 N4 Ni O4 S2 -","- C66 H46 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1406","0.0562","","","0.0768","0.0919","","","","","","0.89","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501355","7.89","0.006","10.494","0.008","24.94","0.02","88.86","0.05","46.97","0.05","104.38","0.04","1409","2","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H23 N4 Ni O4 S2 -","- C33 H23 N4 Ni O4 S2 -","- C66 H46 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1049","0.0612","","","0.1403","0.1584","","","","","","1.005","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501356","7.902","0.008","10.616","0.014","25.3","0.019","88.92","0.05","47.67","0.04","103.08","0.06","1484","3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H24 N4 Ni O4 S2 -","- C33 H24 N4 Ni O4 S2 -","- C66 H48 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.115","0.051","","","0.0855","0.1003","","","","","","0.928","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501357","7.9599","0.0009","10.6979","0.0011","25.101","0.003","91.691","0.006","46.861","0.006","105.439","0.005","1467.6","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H18 N4 Ni O4 S2 -","- C26 H18 N4 Ni O4 S2 -","- C52 H36 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.074","0.0469","","","0.1216","0.1288","","","","","","1.028","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501358","8.045","0.005","10.703","0.008","25.238","0.013","92.1","0.03","46.83","0.03","105.62","0.04","1492.3","1.9","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H22 N4 Ni O5 S2 -","- C33 H22 N4 Ni O5 S2 -","- C66 H44 N8 Ni2 O10 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.161","0.0673","","","0.1306","0.1631","","","","","","0.951","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501359","7.9188","0.0015","10.94","0.003","25.131","0.004","95.1","0.01","47.478","0.008","109.418","0.01","1484.2","0.6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H24 N4 Ni O4 S2 -","- C33 H24 N4 Ni O4 S2 -","- C66 H48 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.0721","0.0411","","","0.0843","0.0922","","","","","","1.016","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501360","8.0084","0.0012","10.8831","0.0017","25.266","0.003","94.429","0.007","47.263","0.007","108.899","0.006","1497.6","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H23 N5 Ni O4 S2 -","- C32 H23 N5 Ni O4 S2 -","- C64 H46 N10 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.0696","0.0392","","","0.0815","0.0886","","","","","","1.022","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501361","8.0119","0.0012","10.6195","0.0019","25.101","0.004","90.643","0.008","46.418","0.009","104.657","0.009","1455.5","0.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H18 N4 Ni O4 S2 -","- C26 H18 N4 Ni O4 S2 -","- C52 H36 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.0989","0.0558","","","0.1469","0.1609","","","","","","1.021","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501362","8.017","0.0006","10.9346","0.0011","25.16","0.002","95.529","0.006","47.384","0.005","108.006","0.005","1523.4","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H24 N4 Ni O4 S2 -","- C35 H24 N4 Ni O4 S2 -","- C70 H48 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.2152","0.0705","","","0.0915","0.117","","","","","","0.893","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501363","8.016","0.003","10.895","0.004","25.054","0.006","95.348","0.016","47.118","0.014","109.109","0.008","1488.2","0.9","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H24 N4 Ni O4 S2 -","- C35 H24 N4 Ni O4 S2 -","- C70 H48 N8 Ni2 O8 S4 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1022","0.0495","","","0.0905","0.1023","","","","","","0.932","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501364","23.888","0.003","15.07","0.009","31.114","0.004","120.34","0.03","35.968","0.007","136.79","0.04","4403","5","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C102 H66 N12 Ni3 O12 S6 -","- C102 H66 N12 Ni3 O12 S6 -","- C204 H132 N24 Ni6 O24 S12 -","2","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1291","0.0742","","","0.2107","0.2597","","","","","","1.115","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501365","11.0822","0.0004","20.8637","0.0009","22.935","0.001","90","","90","","90","","5302.9","0.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H21 N7 Ni O6 S2 -","- C24 H21 N7 Ni O6 S2 -","- C192 H168 N56 Ni8 O48 S16 -","8","1","","Sekiya, Ryo; Nishikiori, Shin-ichi","Structural Extension from an Isonicotinic Acid Dimer to 4-(4-Pyridyl)benzoic Acid (pybenH) Dimer: X-ray Crystal Structure Analysis and Inclusion Properties of a Hydrogen-Bonded Coordination Polymer [Ni(SCN)2(pybenH)2]\ιnfty","Crystal Growth & Design","2011","11","12","5574","","10.1021/cg201141k","","x-ray","0.71073","MoKα","","0.1223","0.0853","","","0.2323","0.2525","","","","","","1.019","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501366","13.0842","0.0011","13.0842","0.0011","19.878","0.002","90","","90","","120","","2947.1","0.5","298","2","298","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C40 H40 Br2 Cu N8 O6 -","- C40 Br2 Cu N8 O6 -","- C120 Br6 Cu3 N24 O18 -","3","0.5","","Banerjee, Subhabrata; Dastidar, Parthasarathi","Coordination Polymers in Selective Separation of Cations and Anions: A Series of Rarely Observed All Helical Three-Dimensional Coordination Polymers Derived from Various Chiral Amino Acid Based Bis-pyridyl-bis-amide Ligands","Crystal Growth & Design","2011","11","12","5592","","10.1021/cg201161q","","","0.71073","MoKα","","0.086","0.0777","","","0.2137","0.2216","","","","","","1.736","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501367","13.6744","0.0008","13.6744","0.0008","15.0225","0.0012","90","","90","","120","","2432.7","0.3","100","2","100","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C28 H38 Br2 Cu N8 O9 -","- C28 H18 Br2 Cu N8 O9 -","- C84 H54 Br6 Cu3 N24 O27 -","3","0.5","","Banerjee, Subhabrata; Dastidar, Parthasarathi","Coordination Polymers in Selective Separation of Cations and Anions: A Series of Rarely Observed All Helical Three-Dimensional Coordination Polymers Derived from Various Chiral Amino Acid Based Bis-pyridyl-bis-amide Ligands","Crystal Growth & Design","2011","11","12","5592","","10.1021/cg201161q","","","0.71073","MoKα","","0.08","0.0614","","","0.1591","0.1727","","","","","","1.115","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501368","13.0785","0.001","13.0785","0.001","20.083","0.003","90","","90","","120","","2974.9","0.5","100","2","100","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C34 H44 Br2 Cu N8 O6 -","- C34 H44 Br2 Cu N8 O6 -","- C102 H132 Br6 Cu3 N24 O18 -","3","0.5","","Banerjee, Subhabrata; Dastidar, Parthasarathi","Coordination Polymers in Selective Separation of Cations and Anions: A Series of Rarely Observed All Helical Three-Dimensional Coordination Polymers Derived from Various Chiral Amino Acid Based Bis-pyridyl-bis-amide Ligands","Crystal Growth & Design","2011","11","12","5592","","10.1021/cg201161q","","","0.71073","MoKα","","0.0263","0.0229","","","0.0579","0.06","","","","","","1.064","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501369","12.9292","0.0006","12.9292","0.0006","20.1039","0.0011","90","","90","","120","","2910.4","0.2","298","2","298","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C34 H44 Cl2 Cu N8 O6 -","- C34 H44 Cl2 Cu N8 O6 -","- C102 H132 Cl6 Cu3 N24 O18 -","3","0.5","","Banerjee, Subhabrata; Dastidar, Parthasarathi","Coordination Polymers in Selective Separation of Cations and Anions: A Series of Rarely Observed All Helical Three-Dimensional Coordination Polymers Derived from Various Chiral Amino Acid Based Bis-pyridyl-bis-amide Ligands","Crystal Growth & Design","2011","11","12","5592","","10.1021/cg201161q","","","0.71073","MoKα","","0.0299","0.0262","","","0.0618","0.064","","","","","","1.041","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501370","8.9583","0.0007","21.06","0.002","8.9583","0.0007","90","","130.337","0.012","90","","1288.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","barbituric acid CaCl2 (H2O)5","","- C4 H14 Ca Cl2 N2 O8 -","- C4 H8 Ca Cl2 N2 O8 -","- C16 H32 Ca4 Cl8 N8 O32 -","4","1","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","","","0.71073","MoKα","","0.0412","0.0318","","","","0.0715","","","","","","1.05","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501371","7.8917","0.0005","7.2632","0.0005","12.9379","0.0008","90","","102.815","0.007","90","","723.12","0.08","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","diaceamide CaCl2 (H2O)5","","- C4 H17 Ca Cl2 N O7 -","- C4 H7 Ca Cl2 N O7 -","- C8 H14 Ca2 Cl4 N2 O14 -","2","1","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","","","0.71073","MoKα","","0.0668","0.0551","","","","0.1497","","","","","","1.059","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501372","5.9055","0.0004","8.0258","0.0005","11.5035","0.0006","71.208","0.005","80.134","0.005","85.297","0.005","508.32","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","malonamide CaCl2 (H2O)2","","- C3 H10 Ca Cl2 N2 O4 -","- C3 H10 Ca Cl2 N2 O4 -","- C6 H20 Ca2 Cl4 N4 O8 -","2","1","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","","","0.71073","MoKα","","0.029","0.0251","","","","0.0682","","","","","","0.845","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501373","9.68836","0.00019","9.27808","0.00012","6.19667","0.00011","103.035","0.0016","98.5641","0.0014","107.858","0.0017","502.027","0.017","","","","","","","","","","","","5","P -1","-P 1","2","","nicotinamide CaCl2 H2O","","- C6 Ca Cl2 N2 O2 -","- C6 Ca Cl2 N2 O2 -","- C12 Ca2 Cl4 N4 O4 -","2","1","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501374","21.7401","0.0012","6.8716","0.0003","12.8167","0.0007","90","","117.775","0.007","90","","1694.08","0.19","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","nicotinamide2 CaCl2 (H2O)2","","- C12 H16 Ca Cl2 N4 O4 -","- C12 H16 Ca Cl2 N4 O4 -","- C48 H64 Ca4 Cl8 N16 O16 -","4","0.5","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","","","0.71073","MoKα","","0.0504","0.0384","","","","0.088","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4501375","8.89548","0.00008","9.60922","0.00013","11.9274","0.00012","90","","108.059","0.0006","90","","969.314","0.019","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","piracetam2 CaCl2 (H2O)2","","- C12 Ca Cl2 N4 O6 -","- C12 Ca Cl2 N4 O6 -","- C24 Ca2 Cl4 N8 O12 -","2","0.5","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501376","8.9444","0.0005","9.8519","0.0004","11.8823","0.0007","90","","106.52","0.007","90","","1003.84","0.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","piracetam2 SrCl2 (H2O)2","","- C12 H24 Cl2 N4 O6 Sr -","- C12 H24 Cl2 N4 O6 Sr -","- C24 H48 Cl4 N8 O12 Sr2 -","2","0.5","","Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro","Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients","Crystal Growth & Design","2011","11","12","5621","","10.1021/cg201177p","","","0.71073","MoKα","","0.0687","0.0377","","","0.0691","0.075","","","","","","0.933","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501377","24.665","0.002","10.7741","0.0009","16.0097","0.0014","90","","93.126","0.001","90","","4248.1","0.6","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 N3 O9 Zn -","- C12 H12 N3 O9 Zn -","- C96 H96 N24 O72 Zn8 -","8","1","","Cui, Peipei; Wu, Junling; Zhao, Xiaoliang; Sun, Di; Zhang, Liangliang; Guo, Jie; Sun, Daofeng","Two Solvent-Dependent Zinc(II) Supramolecular Isomers: Rarekgdand Lonsdaleite Network Topologies Based on a Tripodal Flexible Ligand","Crystal Growth & Design","2011","11","12","5182","","10.1021/cg201181s","","","0.71073","MoKα","","0.0372","0.0314","","","0.0854","0.0878","","","","","","1.077","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501378","24.0866","0.0019","4.8855","0.0004","22.2025","0.0017","90","","90","","90","","2612.7","0.4","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C20 H34 N6 O11 Zn -","- C20 H34 N6 O11 Zn -","- C80 H136 N24 O44 Zn4 -","4","1","","Cui, Peipei; Wu, Junling; Zhao, Xiaoliang; Sun, Di; Zhang, Liangliang; Guo, Jie; Sun, Daofeng","Two Solvent-Dependent Zinc(II) Supramolecular Isomers: Rarekgdand Lonsdaleite Network Topologies Based on a Tripodal Flexible Ligand","Crystal Growth & Design","2011","11","12","5182","","10.1021/cg201181s","","","0.71073","MoKα","","0.045","0.0354","","","0.0882","0.0941","","","","","","1.029","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501379","20.589","0.0015","20.5391","0.0015","10.4699","0.0008","90","","118.478","0.001","90","","3891.8","0.5","298","2","298","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C32 H46 N2 O13 U2 -","- C32 H46 N2 O13 U2 -","- C128 H184 N8 O52 U8 -","4","1","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.045","0.0361","","","0.0826","0.0871","","","","","","1.03","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501380","12.534","0.002","16.139","0.003","25.294","0.004","90","","90","","90","","5116.6","1.5","298","2","298","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C27 H58 N2 O39 U6 -","- C27 H28 N2 O39 U6 -","- C108 H112 N8 O156 U24 -","4","0.5","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.082","0.0522","","","0.1091","0.1216","","","","","","1.025","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501381","8.9327","0.0005","19.2047","0.0011","11.892","0.0007","90","","94.479","0.001","90","","2033.8","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 N O8 U -","- C18 H24 N O8 U -","- C72 H96 N4 O32 U4 -","4","1","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.0288","0.022","","","0.0418","0.0438","","","","","","1.029","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501382","9.6535","0.0009","9.7736","0.0009","17.4401","0.0016","87.842","0.002","75.944","0.001","70.217","0.001","1500.2","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H60 N4 O26 U5 -","- C48 H60 N4 O26 U5 -","- C48 H60 N4 O26 U5 -","1","0.5","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.0248","0.0191","","","0.0408","0.0423","","","","","","1.031","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501383","8.1535","0.0003","9.4052","0.0003","12.3338","0.0004","108.6","","96.054","0.001","100.771","0.001","866.68","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H19 N O6 U -","- C15 H19 N O6 U -","- C30 H38 N2 O12 U2 -","2","1","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.0224","0.0199","","","0.0407","0.0414","","","","","","1.102","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501384","9.4706","0.0004","8.3098","0.0003","17.9773","0.0006","90","","113.185","0.002","90","","1300.53","0.09","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N O5 U -","- C11 H13 N O5 U -","- C44 H52 N4 O20 U4 -","4","1","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.0224","0.0174","","","0.041","0.0428","","","","","","1.052","","","","has coordinates,has disorder","179544","2020-10-21","18:00:00",""
"4501385","25.4837","0.0008","15.9313","0.0005","25.4808","0.0011","90","","118.76","","90","","9068.8","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H58 N2 O18 U2 -","- C39 H53 N2 O18 U2 -","- C312 H424 N16 O144 U16 -","8","1","","Kerr, Andrew T.; Cahill, Christopher L.","Crystal Engineering with the Uranyl Cation III. Mixed Aliphatic Dicarboxylate/Aromatic Dipyridyl Coordination Polymers: Synthesis, Structures, and Speciation","Crystal Growth & Design","2011","11","12","5634","","10.1021/cg2011869","","x-ray","0.71073","MoKα","","0.0411","0.0263","","","0.0515","0.0556","","","","","","1.013","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501386","8.409","0.004","9.724","0.004","9.984","0.004","75.782","0.011","72.52","0.013","65.759","0.012","703","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H8 N2 O -","- C7 H8 N2 O -","- C28 H32 N8 O4 -","4","2","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.1459","0.0656","","","0.1529","0.1841","","","","","","0.75","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501387","11.936","0.002","9.768","0.002","14.267","0.003","90","","105.84","0.03","90","","1600.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H10 N2 O2 -","- C7 H10 N2 O2 -","- C56 H80 N16 O16 -","8","2","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.1311","0.0673","","","0.1672","0.1983","","","","","","0.973","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501388","7.252","0.003","26.885","0.01","8.724","0.003","90","","94.642","0.012","90","","1695.3","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H11 N2 O1.5 -","- C8 H10 N2 O1.5 -","- C64 H80 N16 O12 -","8","2","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.1332","0.0639","","","0.1532","0.1768","","","","","","1.099","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501389","15.07","0.009","7.742","0.004","12.065","0.007","90","","91.804","0.018","90","","1406.9","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C7 H8 N2 O -","- C7 H8 N2 O -","- C56 H64 N16 O8 -","8","1","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0831","0.0527","","","0.123","0.1414","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4501390","13.6085","0.0015","8.1708","0.0009","15.5985","0.0017","90","","110.465","0.004","90","","1625","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 N2 O -","- C8 H10 N2 O -","- C64 H80 N16 O8 -","8","2","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.1567","0.0646","","","0.1505","0.1978","","","","","","1.004","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501391","8.256","0.003","10.458","0.003","11.089","0.004","94.863","0.008","104.619","0.008","111.931","0.008","842.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Ag N5 O5 -","- C14 H16 Ag N5 O5 -","- C28 H32 Ag2 N10 O10 -","2","1","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0698","0.059","","","0.1577","0.1671","","","","","","1.099","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4501392","9.1256","0.0011","12.2367","0.0015","17.072","0.002","90","","94.572","0.003","90","","1900.3","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 Cu N6 O8 -","- C14 H16 Cu N6 O8 -","- C56 H64 Cu4 N24 O32 -","4","0.5","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0438","0.0344","","","0.1141","0.1205","","","","","","0.951","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501393","7.6683","0.0007","8.5377","0.0008","8.605","0.0008","73.392","0.003","71.199","0.003","83.191","0.003","510.84","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 Cu N4 O6 -","- C18 H22 Cu N4 O6 -","- C18 H22 Cu N4 O6 -","1","0.5","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0453","0.0366","","","0.1113","0.1183","","","","","","0.899","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501394","8.403","0.003","8.825","0.004","8.895","0.004","89.555","0.011","67.609","0.009","78.394","0.011","595.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H24 Cl2 Cu N4 O6 -","- C20 H24 Cl2 Cu N4 O6 -","- C20 H24 Cl2 Cu N4 O6 -","1","0.5","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0482","0.0422","","","0.1455","0.1518","","","","","","1.291","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501395","13.1142","0.0014","20.024","0.002","8.4874","0.0009","90","","97.524","0.003","90","","2209.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Cd N4 O7 -","- C18 H24 Cd N4 O7 -","- C72 H96 Cd4 N16 O28 -","4","1","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0425","0.0364","","","0.1181","0.1229","","","","","","1.021","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501396","10.2415","0.0008","11.5816","0.0009","16.2866","0.0012","90","","90.872","0.002","90","","1931.6","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 Cd I2 N4 O2 -","- C14 H16 Cd I2 N4 O2 -","- C56 H64 Cd4 I8 N16 O8 -","4","0.5","","Mukherjee, Gargi; Biradha, Kumar","Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes","Crystal Growth & Design","2011","11","12","5649","","10.1021/cg2012028","","","0.71073","MoKα","","0.0263","0.0229","","","0.0621","0.0637","","","","","","1.067","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501397","25.8301","0.0013","15.4939","0.0004","5.9465","0.0002","90","","90","","90","","2379.84","0.16","","","298","","","","","","","","","3","P b c a","-P 2ac 2ab","61","naproxen","","","- C14 H14 O3 -","- C14 H14 O3 -","- C112 H112 O24 -","8","1","","Braun, Doris E.; Ardid-Candel, Miguel; D’Oria, Emiliana; Karamertzanis, Panagiotis G.; Arlin, Jean-Baptiste; Florence, Alastair J.; Jones, Alan G.; Price, Sarah L.","Racemic Naproxen: A Multidisciplinary Structural and Thermodynamic Comparison with the Enantiopure Form","Crystal Growth & Design","2011","11","12","5659","","10.1021/cg201203u","powder diffraction","","","","","","","","","","","","","2.344","","","","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501398","19.869","0.003","19.869","0.003","27.47","0.007","90","","90","","120","","9392","3","273","2","273","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C81 H99 N0 O62 Pr6 -","- C81 H99 O62 Pr6 -","- C162 H198 O124 Pr12 -","2","0.166667","","Dai, Fangna; Sun, Di; Sun, Daofeng","Three 3D Lanthanide‒Organic Frameworks Based on Novel Flexible Multicarboxylates: From ssa to rtl Topologies","Crystal Growth & Design","2011","11","12","5670","","10.1021/cg201210p","","","0.71073","MoKα","","0.1238","0.0738","","","0.2135","0.2368","","","","","","0.957","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501399","9.0068","0.0004","22.9837","0.0009","14.8035","0.0006","90","","92.787","0.001","90","","3060.8","0.2","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H32 Er N O7 S2 -","- C30 H32 Er N O7 S2 -","- C120 H128 Er4 N4 O28 S8 -","4","1","","Dai, Fangna; Sun, Di; Sun, Daofeng","Three 3D Lanthanide‒Organic Frameworks Based on Novel Flexible Multicarboxylates: From ssa to rtl Topologies","Crystal Growth & Design","2011","11","12","5670","","10.1021/cg201210p","","","0.71073","MoKα","","0.0315","0.0259","","","0.0624","0.0657","","","","","","1.001","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4501400","9.0246","0.0018","23.061","0.004","16.967","0.003","90","","119.318","0.008","90","","3078.8","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 N O7 S2 Tm -","- C30 H32 N O7 S2 Tm -","- C120 H128 N4 O28 S8 Tm4 -","4","1","","Dai, Fangna; Sun, Di; Sun, Daofeng","Three 3D Lanthanide‒Organic Frameworks Based on Novel Flexible Multicarboxylates: From ssa to rtl Topologies","Crystal Growth & Design","2011","11","12","5670","","10.1021/cg201210p","","","0.71073","MoKα","","0.0509","0.0349","","","0.0783","0.0848","","","","","","1.05","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501401","36.4209","0.0018","36.4209","0.0018","16.7366","0.0016","90","","90","","90","","22201","3","291","2","291","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C84 H86 Mo2 N28 O9 Sm2 -","- C84 H86 Mo2 N28 O9 Sm2 -","- C672 H688 Mo16 N224 O72 Sm16 -","8","0.25","","Qian, Su-Yan; Zhou, Hu; Yuan, Ai-Hua; Song, You","Syntheses, Structures, and Magnetic Properties of Five Novel Octacyanometallate-Based Lanthanide Complexes with Helical Chains","Crystal Growth & Design","2011","11","12","5676","","10.1021/cg201217a","","","0.71073","MoKα","","0.0461","0.034","","","0.0996","0.1053","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501402","37.021","0.002","37.021","0.002","15.8242","0.0018","90","","90","","90","","21688","3","291","2","291","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C84 H86 Eu2 Mo2 N28 O9 -","- C84 H86 Eu2 Mo2 N28 O9 -","- C672 H688 Eu16 Mo16 N224 O72 -","8","0.25","","Qian, Su-Yan; Zhou, Hu; Yuan, Ai-Hua; Song, You","Syntheses, Structures, and Magnetic Properties of Five Novel Octacyanometallate-Based Lanthanide Complexes with Helical Chains","Crystal Growth & Design","2011","11","12","5676","","10.1021/cg201217a","","","0.71073","MoKα","","0.0532","0.04","","","0.1149","0.1207","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501403","15.289","0.0015","20.5","0.0016","21.715","0.0012","90","","123.397","0.003","90","","5682.2","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H50 N14 O4 Sm W -","- C46 H50 N14 O4 Sm W -","- C184 H200 N56 O16 Sm4 W4 -","4","1","","Qian, Su-Yan; Zhou, Hu; Yuan, Ai-Hua; Song, You","Syntheses, Structures, and Magnetic Properties of Five Novel Octacyanometallate-Based Lanthanide Complexes with Helical Chains","Crystal Growth & Design","2011","11","12","5676","","10.1021/cg201217a","","","0.71073","MoKα","","0.0783","0.0532","","","0.1148","0.1211","","","","","","1.036","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501404","16.9844","0.0012","18.95","0.002","23.4842","0.0016","90","","125.795","0.003","90","","6130.8","0.9","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H62 Mo N16 O8 Pr -","- C42 H62 Mo N16 O8 Pr -","- C168 H248 Mo4 N64 O32 Pr4 -","4","1","","Qian, Su-Yan; Zhou, Hu; Yuan, Ai-Hua; Song, You","Syntheses, Structures, and Magnetic Properties of Five Novel Octacyanometallate-Based Lanthanide Complexes with Helical Chains","Crystal Growth & Design","2011","11","12","5676","","10.1021/cg201217a","","","0.71073","MoKα","","0.0636","0.0503","","","0.1234","0.1272","","","","","","1.065","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501405","17.0136","0.0013","19.237","0.003","23.1634","0.0015","90","","126.1","0.003","90","","6125.5","1.2","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H62 N16 O8 Pr W -","- C42 H62 N16 O8 Pr W -","- C168 H248 N64 O32 Pr4 W4 -","4","1","","Qian, Su-Yan; Zhou, Hu; Yuan, Ai-Hua; Song, You","Syntheses, Structures, and Magnetic Properties of Five Novel Octacyanometallate-Based Lanthanide Complexes with Helical Chains","Crystal Growth & Design","2011","11","12","5676","","10.1021/cg201217a","","","0.71073","MoKα","","0.0546","0.0423","","","0.0907","0.0937","","","","","","1.047","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501406","5.979","0.0005","18.5907","0.0014","8.1134","0.0006","90","","90.217","0.003","90","","901.83","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 Ag N2 O4 -","- C6 H10 Ag N2 O4 -","- C24 H40 Ag4 N8 O16 -","4","1","","Zhang, Qi-Long; Zhu, Bi-Xue; Zhang, Yun-Qiuan; Tao, Zhu; Clegg, Jack K.; Lindoy, Leonard F.; Wei, Gang","Silver(I) Coordination Polymers Incorporating Neutral γ-Carbon BoundN,N′-Bis(acetylacetone)alkanediimine Units","Crystal Growth & Design","2011","11","12","5688","","10.1021/cg201222a","","","0.71073","MoKα","","0.0803","0.0749","","","0.183","0.1847","","","","","","1.146","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501407","8.5611","0.0004","9.6326","0.0005","14.2471","0.0007","90","","98.892","0.002","90","","1160.78","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H14 Ag N2 O4 -","- C8 H14 Ag N2 O4 -","- C32 H56 Ag4 N8 O16 -","4","1","","Zhang, Qi-Long; Zhu, Bi-Xue; Zhang, Yun-Qiuan; Tao, Zhu; Clegg, Jack K.; Lindoy, Leonard F.; Wei, Gang","Silver(I) Coordination Polymers Incorporating Neutral γ-Carbon BoundN,N′-Bis(acetylacetone)alkanediimine Units","Crystal Growth & Design","2011","11","12","5688","","10.1021/cg201222a","","","0.71073","MoKα","","0.052","0.0475","","","0.1306","0.1343","","","","","","1.077","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501408","15.552","0.004","5.1737","0.0013","18.305","0.005","90","","114.02","0.009","90","","1345.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Ag N2 O5 -","- C12 H14 Ag N2 O5 -","- C48 H56 Ag4 N8 O20 -","4","1","","Zhang, Qi-Long; Zhu, Bi-Xue; Zhang, Yun-Qiuan; Tao, Zhu; Clegg, Jack K.; Lindoy, Leonard F.; Wei, Gang","Silver(I) Coordination Polymers Incorporating Neutral γ-Carbon BoundN,N′-Bis(acetylacetone)alkanediimine Units","Crystal Growth & Design","2011","11","12","5688","","10.1021/cg201222a","","","0.71073","MoKα","","0.0331","0.0283","","","0.0722","0.0748","","","","","","1.04","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501409","16.456","0.002","5.2236","0.0007","18.018","0.002","90","","113.186","0.003","90","","1423.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Ag N2 O5 -","- C13 H16 Ag N2 O5 -","- C52 H64 Ag4 N8 O20 -","4","1","","Zhang, Qi-Long; Zhu, Bi-Xue; Zhang, Yun-Qiuan; Tao, Zhu; Clegg, Jack K.; Lindoy, Leonard F.; Wei, Gang","Silver(I) Coordination Polymers Incorporating Neutral γ-Carbon BoundN,N′-Bis(acetylacetone)alkanediimine Units","Crystal Growth & Design","2011","11","12","5688","","10.1021/cg201222a","","","0.71073","MoKα","","0.0397","0.0316","","","0.0886","0.0937","","","","","","1.05","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501410","9.0801","0.0005","8.1551","0.0005","33.2742","0.0018","90","","95.781","0.002","90","","2451.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 Ag N3 O7 -","- C24 H28 Ag N3 O7 -","- C96 H112 Ag4 N12 O28 -","4","1","","Zhang, Qi-Long; Zhu, Bi-Xue; Zhang, Yun-Qiuan; Tao, Zhu; Clegg, Jack K.; Lindoy, Leonard F.; Wei, Gang","Silver(I) Coordination Polymers Incorporating Neutral γ-Carbon BoundN,N′-Bis(acetylacetone)alkanediimine Units","Crystal Growth & Design","2011","11","12","5688","","10.1021/cg201222a","","","0.71073","MoKα","","0.0501","0.0356","","","0.0882","0.094","","","","","","1.065","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501411","23.712","0.005","12.822","0.003","10.888","0.002","90","","112.132","0.002","90","","3066.4","1.1","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C29 H24 Cd Cl2 N6 O2 S2 -","- C29 H24 Cd Cl2 N6 O2 S2 -","- C116 H96 Cd4 Cl8 N24 O8 S8 -","4","0.5","","Xiao, Jing; Chen, Cheng-Xia; Liu, Qi-Kui; Ma, Jian-Ping; Dong, Yu-Bin","Cd(II)-Schiff-Base Metal‒Organic Frameworks: Synthesis, Structure, and Reversible Adsorption and Separation of Volatile Chlorocarbons","Crystal Growth & Design","2011","11","12","5696","","10.1021/cg201226t","","","0.71073","MoKα","","0.0483","0.0425","","","0.1006","0.1039","","","","","","1.061","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501412","8.89282","0.00013","9.74543","0.00016","6.8513","0.0001","107.106","0.001","108.351","0.0009","85.6751","0.0009","538.54","0.015","","","","","","","","","","","","2","P -1","-P 1","2","","","","- C3 O7 -","- C3 O7 -","- C12 O28 -","4","2","","Lim, Gin Keat; Fujii, Kotaro; Harris, Kenneth D. M.; Apperley, David C.","Structure Determination from Powder X-ray Diffraction Data of a New Polymorph of a High-Density Organic Hydrate Material, with an Assessment of Hydrogen-Bond Disorder by Rietveld Refinement","Crystal Growth & Design","2011","11","12","5192","","10.1021/cg201230k","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501413","13.8818","0.0003","16.0838","0.0006","17.2845","0.0005","90","","90.418","0.002","90","","3859","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H80 N24 O44 S2 U2 -","- C50 H72 N24 O44 S2 U2 -","- C100 H144 N48 O88 S4 U4 -","2","0.5","","Thuéry, Pierre","Coordination Polymers and Frameworks in Uranyl Ion Complexes with Sulfonates and Cucurbit[6]uril","Crystal Growth & Design","2011","11","12","5702","","10.1021/cg201253z","","","0.71073","MoKα","","0.0548","0.0379","","","0.0891","0.0937","","","","","","1.044","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501414","12.3287","0.0005","12.7531","0.0006","13.0826","0.0006","117.076","0.002","90.143","0.003","93.097","0.003","1828.01","0.15","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H66 N25 Na O40 S2 U2 -","- C50 H52 N25 Na O40 S2 U2 -","- C50 H52 N25 Na O40 S2 U2 -","1","0.5","","Thuéry, Pierre","Coordination Polymers and Frameworks in Uranyl Ion Complexes with Sulfonates and Cucurbit[6]uril","Crystal Growth & Design","2011","11","12","5702","","10.1021/cg201253z","","","0.71073","MoKα","","0.0482","0.0395","","","0.108","0.1115","","","","","","1.069","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501415","12.3792","0.0005","12.7824","0.0006","12.9655","0.0006","117.302","0.002","90.134","0.003","92.964","0.003","1819.84","0.14","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H67 Cs N24 O38 S2 U2 -","- C50 H60 Cs N24 O38 S2 U2 -","- C50 H60 Cs N24 O38 S2 U2 -","1","0.5","","Thuéry, Pierre","Coordination Polymers and Frameworks in Uranyl Ion Complexes with Sulfonates and Cucurbit[6]uril","Crystal Growth & Design","2011","11","12","5702","","10.1021/cg201253z","","","0.71073","MoKα","","0.0437","0.0384","","","0.1076","0.1107","","","","","","1.093","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501416","18.1419","0.0005","18.9467","0.0005","24.0974","0.0006","90","","94.418","0.002","90","","8258.4","0.4","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C57 H72 Cs2 N24 O43 S3 U2 -","- C57 H63 Cs2 N24 O43 S3 U2 -","- C228 H252 Cs8 N96 O172 S12 U8 -","4","1","","Thuéry, Pierre","Coordination Polymers and Frameworks in Uranyl Ion Complexes with Sulfonates and Cucurbit[6]uril","Crystal Growth & Design","2011","11","12","5702","","10.1021/cg201253z","","","0.71073","MoKα","","0.0678","0.0452","","","0.1245","0.1333","","","","","","1.051","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501417","12.3243","0.0005","15.8934","0.0006","39.6333","0.001","90","","90","","90","","7763.2","0.5","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C50 H84 K2 N24 O44 S2 U -","- C50 H62 K2 N24 O44 S2 U -","- C200 H248 K8 N96 O176 S8 U4 -","4","1","","Thuéry, Pierre","Coordination Polymers and Frameworks in Uranyl Ion Complexes with Sulfonates and Cucurbit[6]uril","Crystal Growth & Design","2011","11","12","5702","","10.1021/cg201253z","","","0.71073","MoKα","","0.0503","0.0417","","","0.1069","0.1101","","","","","","0.999","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501418","12.0599","0.0005","12.2791","0.0005","12.938","0.0006","68.73","0.002","78.639","0.003","75.692","0.003","1717.76","0.13","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H66 N24 O42 S2 U4 -","- C38 H66 N24 O42 S2 U4 -","- C38 H66 N24 O42 S2 U4 -","1","0.5","","Thuéry, Pierre","Coordination Polymers and Frameworks in Uranyl Ion Complexes with Sulfonates and Cucurbit[6]uril","Crystal Growth & Design","2011","11","12","5702","","10.1021/cg201253z","","","0.71073","MoKα","","0.0395","0.031","","","0.0804","0.0828","","","","","","1.057","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501419","18.076","0.005","30.754","0.008","34.191","0.009","90","","90","","90","","19007","9","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C84 H334 Cl2 K2 N44 O159 -","- C84 H80 Cl2 K2 N44 O32 -","- C336 H320 Cl8 K8 N176 O128 -","4","0.5","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.1992","0.1063","","","0.283","0.3203","","","","","","0.953","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501420","17.787","0.007","18.343","0.008","49.14","0.02","90","","90","","90","","16033","11","223","2","223","2","","","","","","","","6","I b c a","-I 2b 2c","73","","","","- C54 H86 Cl N24 O40 Rb -","- C54 H48 Cl N24 O26 Rb -","- C432 H384 Cl8 N192 O208 Rb8 -","8","0.5","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.1929","0.1296","","","0.3751","0.4083","","","","","","1.311","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501421","10.3714","0.0008","18.4416","0.0015","24.7943","0.0019","81.556","0.003","78.978","0.003","81.251","0.003","4566.6","0.6","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H78 Cl2 N28 O38 Rb2 -","- C78 H72 Cl2 N28 O38 Rb2 -","- C156 H144 Cl4 N56 O76 Rb4 -","2","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0878","0.0548","","","0.1611","0.1768","","","","","","1.093","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501422","10.8896","0.001","28.942","0.003","21.465","0.0019","90","","97.671","0.003","90","","6704.5","1.1","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H63 Cl2 Cs2 N23 O28 -","- C48 H45 Cl2 Cs2 N23 O20 -","- C192 H180 Cl8 Cs8 N92 O80 -","4","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0722","0.0589","","","0.1789","0.1881","","","","","","1.071","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501423","10.759","0.001","27.934","0.003","21.294","0.002","90","","96.364","0.003","90","","6360.3","1.1","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H67 Ca Cl2 N23 O30 -","- C48 H45 Ca Cl2 N23 O23 -","- C192 H180 Ca4 Cl8 N92 O92 -","4","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.1307","0.1176","","","0.3066","0.3134","","","","","","1.067","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501424","21.546","0.004","11.056","0.002","30.688","0.006","90","","105.313","0.002","90","","7051","2","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H74 Cl2 N24 O34 Sr -","- C54 H50 Cl2 N24 O29 Sr -","- C216 H200 Cl8 N96 O116 Sr4 -","4","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0929","0.0567","","","0.1481","0.1642","","","","","","1.01","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501425","20.4952","0.0016","19.6231","0.0016","19.3671","0.0016","90","","103.305","0.002","90","","7580","1.1","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H80 Ba Cl2 N24 O37 -","- C54 H70 Ba Cl2 N24 O32 -","- C216 H280 Ba4 Cl8 N96 O128 -","4","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.058","0.051","","","0.1534","0.1603","","","","","","1.084","","","","has coordinates","189193","2020-10-21","18:00:00",""
"4501426","16.725","0.003","11.85","0.002","13.514","0.002","90","","90","","90","","2678.4","0.8","223","2","223","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C42 H50 Br2 K2 N22 O21 -","- C42 H40 Br2 K2 N22 O20 -","- C84 H80 Br4 K4 N44 O40 -","2","0.5","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0338","0.029","","","0.0706","0.0728","","","","","","1.023","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501427","16.445","0.004","11.991","0.003","29.729","0.007","90","","96.851","0.003","90","","5820","2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C84 H136 I2 K2 N44 O60 -","- C84 H80 I2 K2 N44 O37 -","- C168 H160 I4 K4 N88 O74 -","2","0.5","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.1052","0.0736","","","0.2046","0.2184","","","","","","1.089","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501428","12.0327","0.0018","16.188","0.002","28.931","0.004","90","","90","","90","","5635.3","1.3","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H54 K2 N24 O29 -","- C42 H40 K2 N24 O27 -","- C168 H160 K8 N96 O108 -","4","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0647","0.0525","","","0.1375","0.1458","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4501429","11.7842","0.0016","24.518","0.003","18.522","0.003","90","","90","","90","","5351.5","1.3","223","2","223","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C36 H53 I2 K2 N21 O22 -","- C36 H35 I2 K2 N21 O16 -","- C144 H140 I8 K8 N84 O64 -","4","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0433","0.0374","","","0.0936","0.0969","","","","","","1.035","","","","has coordinates,has disorder","179545","2020-10-21","18:00:00",""
"4501430","11.898","0.002","15.873","0.003","14.603","0.003","90","","90.604","0.002","90","","2757.7","0.9","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H52 K2 N24 O28 -","- C42 H40 K2 N24 O26 -","- C84 H80 K4 N48 O52 -","2","1","","Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu","Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol","Crystal Growth & Design","2011","11","12","5712","","10.1021/cg201272e","","","0.71073","MoKα","","0.0435","0.0414","","","0.1132","0.1152","","","","","","1.033","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501431","5.5126","0.0007","11.0763","0.0014","17.406","0.002","90","","94.931","0.004","90","","1058.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N4 O2 -","- C24 H22 N4 O2 -","- C48 H44 N8 O4 -","2","0.5","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.091","0.0577","","","0.1593","0.1773","","","","","","1.149","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501432","8.7244","0.0017","10.227","0.002","14.472","0.003","89.265","0.006","78.105","0.005","74.384","0.006","1215.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Cu2 I2 N4 -","- C24 H22 Cu2 I2 N4 -","- C48 H44 Cu4 I4 N8 -","2","1","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.0413","0.029","","","0.0942","0.1116","","","","","","0.835","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501433","7.1455","0.0006","8.7718","0.0008","10.462","0.0009","67.487","0.002","87.84","0.002","78.498","0.002","593.07","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Cu2 I2 N4 -","- C24 H22 Cu2 I2 N4 -","- C24 H22 Cu2 I2 N4 -","1","0.5","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.0411","0.0345","","","0.1115","0.1173","","","","","","0.912","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501434","9.452","0.002","10.3711","0.0011","10.901","0.0012","112.507","0.006","104.459","0.009","97.657","0.009","924.1","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H36 Cd3 Cl6 N6 O2 -","- C30 H36 Cd3 Cl6 N6 O2 -","- C30 H36 Cd3 Cl6 N6 O2 -","1","0.5","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.0827","0.0561","","","0.155","0.1786","","","","","","1.302","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501435","5.7847","0.0007","17.012","0.002","11.2798","0.0014","90","","104.402","0.004","90","","1075.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 Cl2 Cu N4 -","- C24 H22 Cl2 Cu N4 -","- C48 H44 Cl4 Cu2 N8 -","2","0.5","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.106","0.0584","","","0.1374","0.159","","","","","","0.91","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501436","11.102","0.002","14.458","0.003","23.518","0.004","90","","113.883","0.008","90","","3451.7","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H40 Cd N6 O9 -","- C32 H38 Cd N6 O9 -","- C128 H152 Cd4 N24 O36 -","4","1","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.1186","0.0598","","","0.1565","0.1814","","","","","","1.03","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4501437","10.847","0.003","10.99","0.004","11.076","0.004","83.459","0.012","85.689","0.01","84.363","0.011","1302.7","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H26 I2 N4 O Zn -","- C25 H25 I2 N4 O Zn -","- C50 H50 I4 N8 O2 Zn2 -","2","1","","Samai, Suman; Biradha, Kumar","Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions","Crystal Growth & Design","2011","11","12","5723","","10.1021/cg2013254","","","0.71073","MoKα","","0.2261","0.077","","","0.156","0.1992","","","","","","0.749","","","","has coordinates","179545","2020-10-21","18:00:00",""
"4510887","7.3934","0.0002","27.5812","0.0006","10.5964","0.0003","90","","109.234","0.003","90","","2040.19","0.1","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H37 N2 O2.5 -","- C22 H37 N2 O2.5 -","- C88 H148 N8 O10 -","4","2","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0379","0.0327","","","0.0701","0.0711","","","","","","0.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510888","19.454","0.0007","18.7009","0.0008","10.8348","0.0004","90","","90","","90","","3941.8","0.3","298","2","298","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C21 H32 N2 O -","- C21 H32 N2 O -","- C168 H256 N16 O8 -","8","2","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0718","0.0487","","","0.1033","0.1149","","","","","","1.024","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510889","10.4243","0.001","7.4432","0.0005","27.018","0.002","90","","94.069","0.009","90","","2091","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22.5 H36.5 N2.5 O2 -","- C22.5 H36.5 N2.5 O2 -","- C90 H146 N10 O8 -","4","2","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0668","0.0493","","","0.1208","0.1327","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510890","7.1392","0.0005","10.9541","0.0008","26.8891","0.0016","90","","90","","90","","2102.8","0.2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H38 N2 O2 -","- C23 H38 N2 O2 -","- C92 H152 N8 O8 -","4","1","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0993","0.055","","","0.0705","0.0894","","","","","","0.892","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510891","10.3775","0.0008","7.4347","0.0006","15.5801","0.0008","90","","91.895","0.006","90","","1201.4","0.15","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H40 N2 O5 -","- C25 H40 N2 O5 -","- C50 H80 N4 O10 -","2","1","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0921","0.0504","","","0.0824","0.09","","","","","","0.875","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510892","24.545","0.001","7.2894","0.0003","15.25","0.0008","90","","122.679","0.007","90","","2296.6","0.3","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C24 H40 N2 O2 -","- C24 H40 N2 O2 -","- C96 H160 N8 O8 -","4","1","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0375","0.0318","","","0.0725","0.0739","","","","","","0.98","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510893","7.5672","0.0003","19.6475","0.0009","26.3375","0.0009","90","","90","","90","","3915.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21.5 H32 N2.5 O1.5 -","- C21.5 H32 N2.5 O1.5 -","- C172 H256 N20 O12 -","8","2","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0852","0.0476","","","0.1086","0.1176","","","","","","0.909","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510894","10.5093","0.0003","7.2906","0.0002","15.5622","0.0005","90","","94.812","0.003","90","","1188.16","0.06","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H44 N2 O4 -","- C24 H44 N2 O4 -","- C48 H88 N4 O8 -","2","1","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0397","0.0332","","","0.0733","0.0747","","","","","","0.973","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510895","7.3164","0.0004","21.562","0.002","24.0058","0.0011","90","","90","","90","","3787.1","0.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 N2 O -","- C21 H32 N2 O -","- C168 H256 N16 O8 -","8","2","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.1056","0.038","","","0.0616","0.0703","","","","","","0.756","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510896","7.233","0.002","11.85","0.002","48.672","0.002","90","","90","","90","","4171.7","1.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23.5 H34.5 N2.5 O -","- C23.5 H34.5 N2.5 O -","- C188 H276 N20 O8 -","8","2","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0962","0.0679","","","0.1132","0.1223","","","","","","1.085","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510897","7.2098","0.0005","10.4654","0.0007","26.0313","0.0013","90","","90","","90","","1964.2","0.2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H34 N2 O2 -","- C21 H34 N2 O2 -","- C84 H136 N8 O8 -","4","1","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.072","0.0372","","","0.0631","0.0676","","","","","","0.801","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510898","25.321","0.002","7.421","0.002","15.393","0.002","90","","123.4","","90","","2414.8","0.7","298","2","298","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C25 H42 N2 O2 -","- C25 H42 N2 O2 -","- C100 H168 N8 O8 -","4","1","","Karpinska, Jolanta; Erxleben, Andrea; McArdle, Patrick","17β-Hydroxy-17α-methylandrostano[3,2-c]pyrazole, Stanozolol: The Crystal Structures of Polymorphs 1 and 2 and 10 Solvates","Crystal Growth & Design","2011","11","7","2829","","10.1021/cg101651p","","","0.7107","MoKα","","0.0691","0.0503","","","0.129","0.1418","","","","","","1.039","","","","has coordinates","179655","2020-10-21","18:00:00",""
"4510900","6.0397","0.0009","15.037","0.001","18.109","0.002","90","","99.52","0.01","90","","1622","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Br8 N4 O4 Sb2 -","- C20 H16 Br8 N4 O4 Sb2 -","- C40 H32 Br16 N8 O8 Sb4 -","2","0.5","","Leblanc, Nicolas; Allain, Magali; Mercier, Nicolas; Cariati, Elena","ProtonatedN,N′-Dioxide-4,4′-bipyridine, an Interesting Synthon for the Building of Polar H-Bonded Networks?","Crystal Growth & Design","2011","11","12","5200","","10.1021/cg201299n","","x-ray","0.71073","MoKα","","","0.0389","","","","0.0811","","","","","","1.041","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510901","9.522","0.001","15.132","0.0005","15.646","0.002","116.111","0.006","99.342","0.008","91.892","0.006","1983.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H50 Bi4 Br18 N10 O12 -","- C50 H40 Bi4 Br18 N10 O12 -","- C50 H40 Bi4 Br18 N10 O12 -","1","0.5","","Leblanc, Nicolas; Allain, Magali; Mercier, Nicolas; Cariati, Elena","ProtonatedN,N′-Dioxide-4,4′-bipyridine, an Interesting Synthon for the Building of Polar H-Bonded Networks?","Crystal Growth & Design","2011","11","12","5200","","10.1021/cg201299n","","x-ray","0.71073","MoKα","","","0.0631","","","","0.1816","","","","","","1.082","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510902","9.552","0.001","15.0481","0.0005","15.256","0.001","115.358","0.006","98.472","0.007","92.445","0.008","1946.2","0.3","300","2","300","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H46 Bi4 Br18 N10 O10 -","- C50 H40 Bi4 Br18 N10 O10 -","- C50 H40 Bi4 Br18 N10 O10 -","1","0.5","","Leblanc, Nicolas; Allain, Magali; Mercier, Nicolas; Cariati, Elena","ProtonatedN,N′-Dioxide-4,4′-bipyridine, an Interesting Synthon for the Building of Polar H-Bonded Networks?","Crystal Growth & Design","2011","11","12","5200","","10.1021/cg201299n","","x-ray","0.71073","MoKα","","","0.0471","","","","0.1254","","","","","","1.039","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510903","7.0757","0.0001","16.7851","0.0002","9.8164","0.0001","90","","94.27","0.01","90","","1162.62","0.03","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/a 1","-P 2yab","14","","","","- C10 H10 Cl2 N2 O2 -","- C10 H10 Cl2 N2 O2 -","- C40 H40 Cl8 N8 O8 -","4","1","","Leblanc, Nicolas; Allain, Magali; Mercier, Nicolas; Cariati, Elena","ProtonatedN,N′-Dioxide-4,4′-bipyridine, an Interesting Synthon for the Building of Polar H-Bonded Networks?","Crystal Growth & Design","2011","11","12","5200","","10.1021/cg201299n","","x-ray","0.71073","MoKα","","0.0727","0.0366","","","0.0797","0.0962","","","","","","1.074","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510904","7.3066","0.0008","9.8027","0.0005","16.057","0.001","90","","90","","90","","1150.07","0.16","293","2","293","2","","","","","","","synthesis as described","5","P c a b","-P 2bc 2ac","61","","","","- C10 H10 Cl2 N2 O2 -","- C10 H10 Cl2 N2 O2 -","- C40 H40 Cl8 N8 O8 -","4","0.5","","Leblanc, Nicolas; Allain, Magali; Mercier, Nicolas; Cariati, Elena","ProtonatedN,N′-Dioxide-4,4′-bipyridine, an Interesting Synthon for the Building of Polar H-Bonded Networks?","Crystal Growth & Design","2011","11","12","5200","","10.1021/cg201299n","","x-ray","0.71073","MoKα","","0.0835","0.04","","","0.0718","0.0853","","","","","","1.075","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510906","16.602","0.003","10.546","0.002","7.07","0.0014","90","","99.3","0.03","90","","1221.6","0.4","150","2","150","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","Orcinol:Urea","","","- C9 H16 N4 O4 -","- C9 H16 N4 O4 -","- C36 H64 N16 O16 -","4","0.5","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.1041","0.088","","","0.2638","0.287","","","","","","1.173","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510907","17.213","0.003","8.478","0.0017","21.65","0.004","90","","91.04","0.03","90","","3158.9","1","150","2","150","2","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","Orcinol:N,NdimethylaminoPyridne","","","- C29 H37 Cl3 N4 O4 -","- C29 H37 Cl3 N4 O4 -","- C116 H148 Cl12 N16 O16 -","4","0.5","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0722","0.0658","","","0.192","0.204","","","","","","1.042","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510908","7.8586","0.0019","8.1455","0.0019","16.239","0.004","83.929","0.006","81.521","0.006","86.524","0.006","1021.3","0.4","150","2","150","2","","","","","","","see text","4","P -1","-P 1","2","Orcinol: N,N-dimethyl,4-aminopyridine","","","- C21 H28 N4 O2 -","- C21 H28 N4 O2 -","- C42 H56 N8 O4 -","2","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.1706","0.1087","","","0.2962","0.3372","","","","","","1.063","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510909","6.9967","0.0014","8.5801","0.0017","13.531","0.003","90","","95.16","0.03","90","","809","0.3","150","2","150","2","","","","","","","see text","4","P 1 21/n 1","-P 2yn","14","Orcinol:Pyrazine","","","- C9 H10 N O2 -","- C9 H10 N O2 -","- C36 H40 N4 O8 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.041","0.0377","","","0.1029","0.1052","","","","","","1.08","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510910","13.845","0.003","9.6116","0.0017","15.059","0.003","90","","97.096","0.007","90","","1988.6","0.7","150","2","150","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","Orcinol:N,NdimethylaminoPyridne","","","- C21 H28 N4 O2 -","- C21 H28 N4 O2 -","- C84 H112 N16 O8 -","4","0.5","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.054","0.0415","","","0.1055","0.1125","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510911","7.495","0.002","17.596","0.005","14.389","0.004","90","","97.656","0.007","90","","1880.7","0.9","150","2","150","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","Orcinol:4-CyanoPyridine","","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C80 H80 N8 O16 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0682","0.0489","","","0.127","0.1379","","","","","","1.049","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510912","7.837","0.002","9.702","0.003","17.83","0.005","98.229","0.007","100.908","0.007","103.819","0.007","1267.2","0.6","150","2","150","","","","","","","","see text","4","P -1","-P 1","2","Orcinol:Acridine","","","- C33 H26 N2 O2 -","- C33 H26 N2 O2 -","- C66 H52 N4 O4 -","2","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.1661","0.107","","","0.272","0.3193","","","","","","1.014","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510913","8.7636","0.0007","10.9081","0.0009","13.3171","0.0011","112.508","0.008","104.169","0.007","92.57","0.007","1126.56","0.18","150","2","150","2","","","","","","","see text","4","P -1","-P 1","2","Orcinol:Pyrimidine","","","- C11 H13 N3 O2 -","- C11 H13 N3 O2 -","- C44 H52 N12 O8 -","4","2","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0561","0.0457","","","0.1168","0.1242","","","","","","1.054","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510914","7.2456","0.0012","12.316","0.002","12.59","0.002","90","","96.268","0.007","90","","1116.8","0.3","150","2","150","","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","Orcinol:Piperazine","","","- C11 H18 N2 O2 -","- C11 H18 N2 O2 -","- C44 H72 N8 O8 -","4","0.5","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0416","0.0396","","","0.1116","0.1127","","","","","","1.12","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510915","20.06","0.003","20.06","0.003","6.423","0.0013","90","","90","","90","","2584.6","0.8","150","2","150","","","","","","","","see text","3","I -4","I -4","82","Orcinol","","","- C7 H8 O2 -","- C7 H8 O2 -","- C112 H128 O32 -","16","2","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0826","0.0564","","","0.1439","0.2169","","","","","","1.059","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510916","8.176","0.0016","9.294","0.0019","16.888","0.003","102.32","0.03","102.03","0.03","93.53","0.03","1218.6","0.5","150","2","150","2","","","","","","","see text","4","P -1","-P 1","2","Orcinol:Phenazine","","","- C31 H24 N4 O2 -","- C31 H24 N4 O2 -","- C62 H48 N8 O4 -","2","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.1622","0.0804","","","0.1359","0.1747","","","","","","1.061","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510917","9.899","0.002","7.951","0.0016","9.1707","0.0018","90","","96.88","0.03","90","","716.6","0.3","150","2","150","2","","","","","","","see text","3","P 1 21/c 1","-P 2ybc","14","Orcinol:H2O","","","- C7 H10 O3 -","- C7 H10 O3 -","- C28 H40 O12 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.0525","0.0436","","","0.1267","0.1441","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4510918","8.4494","0.0009","12.362","0.0013","19.748","0.002","83.323","0.007","77.689","0.007","89.497","0.006","2001.3","0.4","150","2","150","2","","","","","","","see text","4","P -1","-P 1","2","Orcinol:aminodimethylpyrimidine","","","- C19 H26 N6 O2 -","- C19 H26 N6 O2 -","- C76 H104 N24 O8 -","4","2","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","","0.71075","MoKα","","0.1331","0.0641","","","0.1584","0.1938","","","","","","1.015","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510919","9.339","0.0007","25.441","0.002","13.7503","0.0011","90","","90","","90","","3267","0.4","150","2","150","2","","","","","","","see text","4","P n a 21","P 2c -2n","33","Orcinol:Acridine Hydrate","","","- C20 H18 N O2.5 -","- C20 H18 N O2.5 -","- C160 H144 N8 O20 -","8","2","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0446","0.041","","","0.0956","0.0976","","","","","","1.06","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510920","13.783","0.007","13.52","0.007","15.981","0.006","90","","124.11","0.03","90","","2466","2","150","2","150","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","Orcinol:Phenantrholine","","","- C31 H24 N4 O2 -","- C31 H24 N4 O2 -","- C124 H96 N16 O8 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0574","0.047","","","0.1235","0.1373","","","","","","1.116","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510921","7.2","0.0014","7.5989","0.0015","35.894","0.007","90","","91.01","0.03","90","","1963.5","0.7","150","2","150","2","","","","","","","see text","4","P 1 21/n 1","-P 2yn","14","Orcinol:1245Tetracyanobenzene","","","- C22 H11 N6 O2 -","- C22 H11 N6 O2 -","- C88 H44 N24 O8 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.0817","0.0571","","","0.1669","0.1987","","","","","","1.081","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510922","17.572","0.003","21.702","0.004","7.065","0.0014","90","","90","","90","","2694.2","0.9","150","2","150","","","","","","","","see text","4","P c c n","-P 2ab 2ac","56","OrcinolHexamine","","","- C13 H20 N4 O2 -","- C13 H20 N4 O2 -","- C104 H160 N32 O16 -","8","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.0474","0.0408","","","0.1244","0.1421","","","","","","1.11","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510923","10.498","0.008","8.887","0.007","15.557","0.009","90","","113.8","0.04","90","","1328","1.7","150","2","150","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","Orcinol:4(N,N-dimethylaminopyridine","","","- C14 H18 N2 O2 -","- C14 H18 N2 O2 -","- C56 H72 N8 O8 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.0533","0.0465","","","0.124","0.1295","","","","","","1.069","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510924","7.926","0.0016","12.56","0.003","16.75","0.003","96.16","0.03","99.97","0.03","98.56","0.03","1608.8","0.6","150","2","150","2","","","","","","","see text","4","P -1","-P 1","2","Orcinol:Nicotinamide","","","- C31 H34 N8 O7 -","- C31 H34 N8 O7 -","- C62 H68 N16 O14 -","2","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.3593","0.1323","","","0.2927","0.4461","","","","","","1.007","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510925","13.784","0.014","16.174","0.017","24.55","0.02","90","","90","","90","","5473","9","150","2","150","","","","","","","","see text","3","P 21 21 21","P 2ac 2ab","19","Orcinol form II","","","- C7 H8 O2 -","- C7 H8 O2 -","- C224 H256 O64 -","32","8","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.11","0.0927","","","0.2247","0.2428","","","","","","1.233","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510926","33.63","0.007","7.26","0.0015","15.358","0.003","90","","95.65","0.03","90","","3731.5","1.3","150","","150","","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","Orcinol:Isonicotinamide","","","- C19 H20 N4 O4 -","- C19 H20 N4 O4 -","- C152 H160 N32 O32 -","8","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.0717","0.0554","","","0.1461","0.1661","","","","","","1.161","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510927","8.2817","0.0012","10.9094","0.0012","16.6","0.002","99.961","0.009","96.163","0.007","93.253","0.005","1464.3","0.3","150","2","150","2","","","","","","","see text","4","P -1","-P 1","2","(Orcinol:Nicotinamide)","","","- C31 H32 N8 O6 -","- C31 H32 N8 O6 -","- C62 H64 N16 O12 -","2","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.1042","0.0537","","","0.116","0.135","","","","","","0.994","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510928","8.29","0.0017","9.99","0.002","12.69","0.003","104.66","0.03","103.82","0.03","96.33","0.03","970.9","0.4","150","2","150","","","","","","","","see text","4","P -1","-P 1","2","Orcinol:Quinoxaline2:1","","","- C22 H22 N2 O4 -","- C22 H22 N2 O4 -","- C44 H44 N4 O8 -","2","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71075","MoKα","","0.1798","0.1056","","","0.2542","0.338","","","","","","1.087","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510929","7.0702","0.0014","14.274","0.003","19.73","0.004","90","","99.05","0.03","90","","1966.4","0.7","150","2","150","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","Orcinol:Quinoxaline","","","- C23 H20 N4 O2 -","- C23 H20 N4 O2 -","- C92 H80 N16 O8 -","4","1","","Mukherjee, Arijit; Grobelny, Pawel; Thakur, Tejender S.; Desiraju, Gautam R.","Polymorphs, Pseudopolymorphs, and Co-Crystals of Orcinol: Exploring the Structural Landscape with High Throughput Crystallography","Crystal Growth & Design","2011","11","6","2637","","10.1021/cg200361x","","x-ray","0.71073","MoKα","","0.1038","0.0676","","","0.1562","0.1831","","","","","","1.149","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510930","6.5942","0.0004","13.5455","0.0009","8.0423","0.0003","90","","90","","90","","718.35","0.07","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","phloroglucinol dihydrate","","- C6 H10 O5 -","- C6 H10 O5 -","- C24 H40 O20 -","4","0.5","","Thomas, Lynne H.; Craig, Gavin A.; Morrison, Carole A.; Reilly, Anthony M.; Wilson, Chick C.","New Route to Local Order Models for Disordered Crystalline Materials: Diffuse Scattering and Computational Modeling of Phloroglucinol Dihydrate","Crystal Growth & Design","2011","11","6","2045","","10.1021/cg101704h","","","0.71075","MoKα","","0.0362","0.0357","","","","0.1086","","","","","","1.132","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510931","7.2028","0.0002","11.7764","0.0003","17.1677","0.0005","90","","90","","90","","1456.22","0.07","100","2","100","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","paracetamol","acetaminophen","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C64 H72 N8 O16 -","8","1","","Thomas, Lynne H.; Wales, Craig; Zhao, Lihua; Wilson, Chick C.","Paracetamol Form II: An Elusive Polymorph through Facile Multicomponent Crystallization Routes","Crystal Growth & Design","2011","11","5","1450","","10.1021/cg2002018","","","0.71073","MoKα","","0.0593","0.0471","","","0.1306","0.1394","","","","","","1.206","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510932","12.5115","0.0004","7.3273","0.0002","12.6648","0.0004","90","","100.052","0.002","90","","1143.23","0.06","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","1","","Zipp, Caitlin F.; Fernandes, Manuel. A.; Marques, Helder M.; Michael, Joseph P.; Perry, Christopher B.","Polymorphs ofN-[2-(Hydroxymethyl)phenyl]benzamide: Structural Characterization and Analysis of Molecule···Molecule Interactions by Means of Atom−Atom Potentials and DFT","Crystal Growth & Design","2011","11","5","1431","","10.1021/cg101733u","","","0.71073","MoKα","","0.0542","0.0417","","","0.0977","0.105","","","","","","1.007","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510933","5.1936","0.0006","13.2328","0.0014","17.0316","0.0017","90","","90.125","0.004","90","","1170.5","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","1","","Zipp, Caitlin F.; Fernandes, Manuel. A.; Marques, Helder M.; Michael, Joseph P.; Perry, Christopher B.","Polymorphs ofN-[2-(Hydroxymethyl)phenyl]benzamide: Structural Characterization and Analysis of Molecule···Molecule Interactions by Means of Atom−Atom Potentials and DFT","Crystal Growth & Design","2011","11","5","1431","","10.1021/cg101733u","","","0.71073","MoKα","","0.1067","0.0555","","","0.1193","0.137","","","","","","1.053","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510935","7.584","0.004","13.088","0.007","6.198","0.003","90","","90","","90","","615.2","0.5","90","1","90","1","","","","","","","see text","3","P n a 21","P 2c -2n","33","","","","- C8 H5 F -","- C8 H5 F -","- C32 H20 F4 -","4","1","","Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R.","Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine","Crystal Growth & Design","2011","11","9","3954","","10.1021/cg2005453","","x-ray","0.71073","MoKα","","0.0912","0.0636","","","0.1338","0.1435","","","","","","1.024","","","","has coordinates,has disorder","179656","2020-10-21","18:00:00",""
"4510936","6.0163","0.0011","13.997","0.003","22.244","0.004","90","","90.304","0.004","90","","1873.1","0.6","90","1","90","1","","","","","","","see text","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 F -","- C8 H5 F -","- C96 H60 F12 -","12","3","","Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R.","Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine","Crystal Growth & Design","2011","11","9","3954","","10.1021/cg2005453","","x-ray","0.71073","MoKα","","0.1144","0.0595","","","0.133","0.1502","","","","","","1.009","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510937","7.101","0.002","6.5984","0.0018","13.273","0.004","90","","99.882","0.004","90","","612.7","0.3","90","1","90","1","","","","","","","see text","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H5 F -","- C8 H5 F -","- C32 H20 F4 -","4","1","","Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R.","Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine","Crystal Growth & Design","2011","11","9","3954","","10.1021/cg2005453","","x-ray","0.71073","MoKα","","0.0438","0.0416","","","0.1027","0.1038","","","","","","1.151","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510938","7.0506","0.0015","5.932","0.0013","7.4848","0.0016","90","","103.46","0.003","90","","304.45","0.11","90","1","90","1","","","","","","","see text","3","P 1 21 1","P 2yb","4","","","","- C8 H5 F -","- C8 H5 F -","- C16 H10 F2 -","2","1","","Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R.","Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine","Crystal Growth & Design","2011","11","9","3954","","10.1021/cg2005453","","x-ray","0.71073","MoKα","","0.0388","0.0363","","","0.1043","0.106","","","","","","1.087","","","","has coordinates","179656","2020-10-21","18:00:00",""
"4510939","3.868","0.003","5.941","0.004","13.486","0.009","90","","98.089","0.012","90","","306.8","0.4","90","1","90","1","","","","","","","see text","3","P 1 21 1","P 2yb","4","","","","- C8 H5 F -","- C8 H5 F -","- C16 H10 F2 -","2","1","","Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R.","Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine","Crystal Growth & Design","2011","11","9","3954","","10.1021/cg2005453","","x-ray","0.71073","MoKα","","0.1019","0.0673","","","0.1448","0.1582","","","","","","1.009","","","","has coordinates","179656","2020-10-21","18:00:00",""