# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T19:36:46+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Journal of the American Chemical Society') AND volume = 130 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
"4101712","10.0592","0.0008","23.0731","0.0018","13.9928","0.0011","90","","109.435","0.001","90","","3062.6","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H42 N2 O2 -","- C36 H42 N2 O2 -","- C144 H168 N8 O8 -","4","1","","Salata, Michael R.; Marks, Tobin J.","Synthesis, characterization, and marked polymerization selectivity characteristics of binuclear phenoxyiminato organozirconium catalysts.","Journal of the American Chemical Society","2008","130","1","12","13","10.1021/ja076857e","","","0.71073","MoKα","","0.0836","0.0616","","","0.1614","0.1872","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101713","26.914","0.006","9.765","0.002","16.289","0.004","90","","109.311","0.003","90","","4040.1","1.6","153","2","153","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C42 H58 N2 O2 Si2 -","- C42 H58 N2 O2 Si2 -","- C168 H232 N8 O8 Si8 -","4","1","","Salata, Michael R.; Marks, Tobin J.","Synthesis, characterization, and marked polymerization selectivity characteristics of binuclear phenoxyiminato organozirconium catalysts.","Journal of the American Chemical Society","2008","130","1","12","13","10.1021/ja076857e","","","0.71073","MoKα","","0.0533","0.0462","","","0.1123","0.1191","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101714","9.5123","0.0004","9.5123","0.0004","26.472","0.003","90","","90","","120","","2074.4","0.3","100","2","100","2","","","","","","","","5","P 31","P 31","144","DLT3_258","","","- C22 H20 N4 Pb3 S6 -","- C22 H20 N4 Pb3 S6 -","- C66 H60 N12 Pb9 S18 -","3","1","","Turner, Dayna L.; Vaid, Thomas P.; Stephens, Peter W.; Stone, Kevin H.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Semiconducting lead-sulfur-organic network solids.","Journal of the American Chemical Society","2008","130","1","14","15","10.1021/ja0770983","","","0.71073","MoKα","","0.0511","0.035","","","0.0573","0.0613","","","","","","1.033","","","","has coordinates,has disorder","204147","2020-10-21","18:00:00",""
"4101715","9.7206","0.001","14.3124","0.0014","19.73","0.002","70.85","0.002","81.48","0.002","84.019","0.002","2559.9","0.4","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H78 La2 N4 Si2 -","- C48 H78 La2 N4 Si2 -","- C96 H156 La4 N8 Si4 -","2","1","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Organolanthanide-based synthesis of 1,2,3-triazoles from nitriles and diazo compounds.","Journal of the American Chemical Society","2008","130","1","16","17","10.1021/ja077298e","","","0.71073","MoKα","","0.026","0.0197","","","0.0484","0.0517","","","","","","1.039","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101716","20.4393","0.001","20.4393","0.001","14.4731","0.0013","90","","90","","120","","5236.3","0.6","163","2","163","2","","","","","","","","5","P -3","-P 3","147","","","","- C81 H144 La3 N15 Si6 -","- C81 H144 La3 N15 Si6 -","- C162 H288 La6 N30 Si12 -","2","0.333333","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Organolanthanide-based synthesis of 1,2,3-triazoles from nitriles and diazo compounds.","Journal of the American Chemical Society","2008","130","1","16","17","10.1021/ja077298e","","","0.71073","MoKα","","0.0291","0.0255","","","0.0742","0.0772","","","","","","1.143","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101717","10.6329","0.0009","18.1349","0.0016","19.8862","0.0018","90","","104.163","0.002","90","","3718","0.6","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H57 La N4 Si -","- C34.17 H57 La N4 Si0.93 -","- C136.68 H228 La4 N16 Si3.72 -","4","1","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Organolanthanide-based synthesis of 1,2,3-triazoles from nitriles and diazo compounds.","Journal of the American Chemical Society","2008","130","1","16","17","10.1021/ja077298e","","","0.71073","MoKα","","0.034","0.0246","","","0.0591","0.0638","","","","","","1.041","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101718","10.727","0.006","17.626","0.01","20.211","0.011","90","","104.985","0.009","90","","3691","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H57 N4 Si Sm -","- C34 H57 N4 Si Sm -","- C136 H228 N16 Si4 Sm4 -","4","1","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Organolanthanide-based synthesis of 1,2,3-triazoles from nitriles and diazo compounds.","Journal of the American Chemical Society","2008","130","1","16","17","10.1021/ja077298e","","","0.71073","MoKα","","0.0765","0.0628","","","0.123","0.1274","","","","","","1.311","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101719","28.549","0.002","12.985","0.0011","20.9316","0.0018","90","","129.993","0.001","90","","5944.8","0.8","138","2","138","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C60 H90 N4 Si2 Sm2 -","- C60 H90 N4 Si2 Sm2 -","- C240 H360 N16 Si8 Sm8 -","4","1","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Organolanthanide-based synthesis of 1,2,3-triazoles from nitriles and diazo compounds.","Journal of the American Chemical Society","2008","130","1","16","17","10.1021/ja077298e","","","0.71073","MoKα","","0.0208","0.0199","","","0.0502","0.0508","","","","","","1.035","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101720","9.5887","0.001","14.3066","0.0015","19.579","0.002","69.775","0.002","81.002","0.002","83.535","0.002","2484.3","0.4","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H78 N4 Si2 Sm2 -","- C48 H78 N4 Si2 Sm2 -","- C96 H156 N8 Si4 Sm4 -","2","1","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Organolanthanide-based synthesis of 1,2,3-triazoles from nitriles and diazo compounds.","Journal of the American Chemical Society","2008","130","1","16","17","10.1021/ja077298e","","","0.71073","MoKα","","0.0297","0.0213","","","0.0504","0.0545","","","","","","1.028","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101721","21.7966","0.0008","14.0889","0.0004","22.0906","0.0006","90","","111.263","0.0009","90","","6322","0.3","100","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H27 Co F12 N2 O7 -","- C27 H27 Co F12 N2 O7 -","- C216 H216 Co8 F96 N16 O56 -","8","2","","Ishii, Norio; Okamura, Yoshitomo; Chiba, Susumu; Nogami, Takashi; Ishida, Takayuki","Giant coercivity in a one-dimensional cobalt-radical coordination magnet.","Journal of the American Chemical Society","2008","130","1","24","25","10.1021/ja077666e","","","0.71069","MoKα","","","0.0436","","","","0.0631","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101722","7.603","0.0003","9.635","0.0004","16.183","0.0006","90","","90","","90","","1185.48","0.08","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 O3 -","- C13 H15 O3 -","- C52 H60 O12 -","4","1","","Li, De Run; Murugan, Andiappan; Falck, J. R.","Enantioselective, organocatalytic oxy-michael addition to gamma/delta-hydroxy-alpha,beta-enones: boronate-amine complexes as chiral hydroxide synthons.","Journal of the American Chemical Society","2008","130","1","46","48","10.1021/ja076802c","","","0.71073","MoKα","","0.066","0.0506","","","0.1322","0.1491","","","","","","0.992","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101723","10.498","0.002","8.5","0.0017","9.94","0.002","90","","90","","90","","887","0.3","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C2 H7.33 Na2 O7.67 P2 Y -","- C2 H3 Na2 O7.67 P2 Y -","- C8 H12 Na8 O30.68 P8 Y4 -","4","0.5","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0529","0.0402","","","0.0941","0.1015","","","","","","1.05","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101724","10.755","0.002","8.847","0.0018","10.534","0.002","90","","90","","90","","1002.3","0.3","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H12 La2 Na4 O17 P4 -","- C4 H10 La2 Na4 O17 P4 -","- C8 H20 La4 Na8 O34 P8 -","2","0.25","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0345","0.0282","","","0.078","0.0815","","","","","","1.136","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101725","10.6825","0.0002","8.8219","0.0002","10.4567","0.0002","90","","90","","90","","985.44","0.03","150","2","175","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H11 Ce2 Na4 O17 P4 -","- C4 H10 Ce2 Na4 O17 P4 -","- C8 H20 Ce4 Na8 O34 P8 -","2","0.25","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0228","0.0223","","","0.0526","0.0528","","","","","","1.366","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101726","10.476","0.002","8.7385","0.0017","10.543","0.002","90","","90","","90","","965.2","0.3","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H12 Na4 Nd2 O17 P4 -","- C4 H10 Na4 Nd2 O17 P4 -","- C8 H20 Na8 Nd4 O34 P8 -","2","0.25","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0199","0.0175","","","0.0431","0.044","","","","","","1.101","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101727","10.438","0.002","8.651","0.0017","10.398","0.002","90","","90","","90","","938.9","0.3","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H11 Eu2 Na4 O16.5 P4 -","- C4 H10 Eu2 Na4 O16.5 P4 -","- C8 H20 Eu4 Na8 O33 P8 -","2","0.25","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0242","0.0198","","","0.0475","0.0492","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101728","8.0636","0.0019","9.7171","0.0019","9.972","0.002","90","","100.972","0.008","90","","767.1","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H3 Eu Na O7 P2 -","- C2 H3 Eu Na O7 P2 -","- C8 H12 Eu4 Na4 O28 P8 -","4","1","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.1007","0.0816","","","0.2385","0.2603","","","","","","1.123","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101729","10.4217","0.0005","8.6462","0.0004","10.3","0.0005","90","","90","","90","","928.11","0.08","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C2 H5 Gd Na2 O8 P2 -","- C2 H3 Gd Na2 O8 P2 -","- C8 H12 Gd4 Na8 O32 P8 -","4","0.5","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","1.5418","CuKα","","0.039","0.0387","","","0.1073","0.1075","","","","","","1.118","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101730","10.519","0.002","8.606","0.0017","9.999","0.002","90","","90","","90","","905.2","0.3","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H11 Na4 O16.5 P4 Tb2 -","- C4 H6 Na4 O16.5 P4 Tb2 -","- C8 H12 Na8 O33 P8 Tb4 -","2","0.25","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.066","0.0377","","","0.0689","0.0791","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101731","9.7235","0.0002","9.7323","0.0002","20.421","0.0005","90","","90","","90","","1932.48","0.07","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C2 H11 Eu O10 P2 -","- C2 H11 Eu O10 P2 -","- C16 H88 Eu8 O80 P16 -","8","1","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.024","0.0168","","","0.0397","0.0438","","","","","","1.132","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101732","9.774","0.005","20.406","0.009","9.805","0.005","90","","90","","90","","1955.6","1.7","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C2 H8 Ge0.1 Na0.9 Nd0.9 O9 P2 -","- C2 H4 Ge0.1 Na0.9 Nd0.9 O9 P2 -","- C16 H32 Ge0.8 Na7.2 Nd7.2 O72 P16 -","8","1","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0904","0.0457","","","0.0925","0.0983","","","","","","1.161","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101733","11.6223","0.0002","9.1515","0.0002","11.1093","0.0002","90","","111.372","0.001","90","","1100.35","0.04","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H13 O11 P2 Y -","- C2 H13 O11 P2 Y -","- C8 H52 O44 P8 Y4 -","4","1","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0256","0.0195","","","0.0444","0.0463","","","","","","1.08","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101734","5.3097","0.0003","6.79","0.0004","12.031","0.0007","80.49","0.002","81.694","0.002","77.851","0.002","415.49","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H7 O8 P2 Yb -","- C2 H7 O8 P2 Yb -","- C4 H14 O16 P4 Yb2 -","2","1","","Shi, F. N.; Cunha-Silva, L.; Ferreira, R. A. Sa; Mafra, L.; Trindade, T.; Carlos, L. D.; Paz, F. A. Almeida; Rocha, J.","Interconvertable modular framework and layered lanthanide(III)-etidronic acid coordination polymers.","Journal of the American Chemical Society","2008","130","1","150","167","10.1021/ja074119k","","","0.71073","MoKα","","0.0151","0.0146","","","0.0351","0.0355","","","","","","1.122","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101735","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","","Murata, Hidenori; Miyazaki, Yuji; Inaba, Akira; Paduan-Filho, Armando; Bindilatti, Valdir; Jr, Nei Fernandes Oliveira; Delen, Zeynep; Lahti, Paul M.","2-(4,5,6,7-Tetrafluorobenzimidazol-2-yl)-4,4,5,5-tetramethyl-4,5-dihydro-1- H-imidazole-3-oxide-1-oxyl, a hydrogen-bonded organic quasi-1D ferromagnet.","Journal of the American Chemical Society","2008","130","1","186","194","10.1021/ja074211g","","","0.71073","MoKα","","0.0863","0.0517","","","0.1613","0.1932","","","","","","1.158","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101736","9.698","0.007","7.153","0.005","11.571","0.007","90","","92.098","0.011","90","","802.1","0.9","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H17 I O3 -","- C18 H17 I O3 -","- C36 H34 I2 O6 -","2","1","","Liao, Xuebin; Weng, Zhiqiang; Hartwig, John F.","Enantioselective alpha-arylation of ketones with aryl triflates catalyzed by difluorphos complexes of palladium and nickel.","Journal of the American Chemical Society","2008","130","1","195","200","10.1021/ja074453g","","","0.71073","MoKα","","0.1076","0.0533","","","0.1191","0.1406","","","","","","0.872","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101737","4.848","0.001","19.811","0.001","19.907","0.001","90","","94.566","0.001","90","","1905.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-methoxyphenyl)-6,8-dipropyl-2,3-dihydrobenzo[b][1,4]oxathiin-5-ol","","- C21 H26 O3 S -","- C21 H26 O3 S -","- C84 H104 O12 S4 -","4","1","","Amorati, Riccardo; Catarzi, Francesca; Menichetti, Stefano; Pedulli, Gian Franco; Viglianisi, Caterina","Effect of ortho-SR groups on O-H bond strength and H-atom donating ability of phenols: a possible role for the Tyr-Cys link in galactose oxidase active site?","Journal of the American Chemical Society","2008","130","1","237","244","10.1021/ja075554h","","","1.54178","CuKα","","0.0666","0.0439","","","0.1227","0.135","","","","","","1.018","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101738","25.2803","0.0002","23.911","0.0002","35.54","0.0004","90","","102.274","0.0003","90","","20992","0.3","253","2","260","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C143 H195 B4 Cl4 Co4 Fe4 N81 O37 -","- C143 H187 B4 Cl4 Co4 Fe4 N81 O37 -","- C572 H748 B16 Cl16 Co16 Fe16 N324 O148 -","4","1","","Li, Dongfeng; Clérac, Rodolphe; Roubeau, Olivier; Harté, Etienne; Mathonière, Corine; Bris, Rémy Le; Holmes, Stephen M.","Magnetic and optical bistability driven by thermally and photoinduced intramolecular electron transfer in a molecular cobalt-iron prussian blue analogue.","Journal of the American Chemical Society","2008","130","1","252","258","10.1021/ja0757632","","","0.71073","MoKα","","0.1684","0.0962","","","0.2912","0.3288","","","","","","1.016","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00",""
"4101739","25.2662","0.0002","23.5797","0.0002","35.597","0.0003","90","","102.444","0.0003","90","","20709.4","0.3","90","2","90","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C143 H195 B4 Cl4 Co4 Fe4 N81 O37 -","- C143 H187 B4 Cl4 Co4 Fe4 N81 O37 -","- C572 H748 B16 Cl16 Co16 Fe16 N324 O148 -","4","1","","Li, Dongfeng; Clérac, Rodolphe; Roubeau, Olivier; Harté, Etienne; Mathonière, Corine; Bris, Rémy Le; Holmes, Stephen M.","Magnetic and optical bistability driven by thermally and photoinduced intramolecular electron transfer in a molecular cobalt-iron prussian blue analogue.","Journal of the American Chemical Society","2008","130","1","252","258","10.1021/ja0757632","","","0.71073","MoKα","","0.1518","0.0939","","","0.2757","0.3244","","","","","","1.049","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00",""
"4101740","25.0653","0.0003","23.4624","0.0003","34.8074","0.0006","90","","102.365","0.0006","90","","19995.1","0.5","90","2","90","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C143 H195 B4 Cl4 Co4 Fe4 N81 O37 -","- C143 H186.1 B4 Cl4 Co4 Fe4 N81 O37 -","- C572 H744.4 B16 Cl16 Co16 Fe16 N324 O148 -","4","1","","Li, Dongfeng; Clérac, Rodolphe; Roubeau, Olivier; Harté, Etienne; Mathonière, Corine; Bris, Rémy Le; Holmes, Stephen M.","Magnetic and optical bistability driven by thermally and photoinduced intramolecular electron transfer in a molecular cobalt-iron prussian blue analogue.","Journal of the American Chemical Society","2008","130","1","252","258","10.1021/ja0757632","","","0.71073","MoKα","","0.1762","0.0934","","","0.2346","0.2773","","","","","","1.037","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00",""
"4101741","10.258","0.0002","15.2386","0.0003","16.9913","0.0004","90","","96.1396","0.0007","90","","2640.8","0.1","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H32 B Fe N12 -","- C23 H32 B Fe N12 -","- C92 H128 B4 Fe4 N48 -","4","1","","Li, Dongfeng; Clérac, Rodolphe; Roubeau, Olivier; Harté, Etienne; Mathonière, Corine; Bris, Rémy Le; Holmes, Stephen M.","Magnetic and optical bistability driven by thermally and photoinduced intramolecular electron transfer in a molecular cobalt-iron prussian blue analogue.","Journal of the American Chemical Society","2008","130","1","252","258","10.1021/ja0757632","","","0.71073","MoKα","","0.0793","0.0426","","","0.0851","0.0954","","","","","","1.035","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101742","6.8152","0.0011","10.669","0.002","12.389","0.002","81.193","0.005","75.297","0.005","85.65","0.005","860.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H21 N O6 -","- C19 H21 N O6 -","- C38 H42 N2 O12 -","2","1","","Nieto-Oberhuber, Cristina; Pérez-Galán, Patricia; Herrero-Gómez, Elena; Lauterbach, Thorsten; Rodríguez, Cristina; López, Salomé; Bour, Christophe; Rosellón, Antonio; Cárdenas, Diego J.; Echavarren, Antonio M.","Gold(I)-Catalyzed Intramolecular [4+2] Cycloadditions of Arylalkynes or 1,3-Enynes with Alkenes: Scope and Mechanism","Journal of the American Chemical Society","2008","130","1","269","279","10.1021/ja075794x","","","0.71073","MoKα","","0.1077","0.0744","","","0.2096","0.239","","","","","","1.017","","","","has coordinates","288243","2023-12-12","09:57:13",""
"4101743","12.9697","0.0014","6.1221","0.0007","14.1396","0.0015","90","","112.992","0.003","90","","1033.5","0.2","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H26 O4 -","- C25 H26 O4 -","- C50 H52 O8 -","2","1","","Nieto-Oberhuber, Cristina; Pérez-Galán, Patricia; Herrero-Gómez, Elena; Lauterbach, Thorsten; Rodríguez, Cristina; López, Salomé; Bour, Christophe; Rosellón, Antonio; Cárdenas, Diego J.; Echavarren, Antonio M.","Gold(I)-Catalyzed Intramolecular [4+2] Cycloadditions of Arylalkynes or 1,3-Enynes with Alkenes: Scope and Mechanism","Journal of the American Chemical Society","2008","130","1","269","279","10.1021/ja075794x","","","0.71073","MoKα","","0.0422","0.0389","","","0.1051","0.1083","","","","","","1.059","","","","has coordinates","288243","2023-12-12","09:57:13",""
"4101744","10.5493","0.0004","23.7803","0.0009","16.6927","0.0006","90","","90.11","0.002","90","","4187.6","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H63 Au Cl O3 P -","- C42 H63 Au Cl O3 P -","- C168 H252 Au4 Cl4 O12 P4 -","4","1","","Nieto-Oberhuber, Cristina; Pérez-Galán, Patricia; Herrero-Gómez, Elena; Lauterbach, Thorsten; Rodríguez, Cristina; López, Salomé; Bour, Christophe; Rosellón, Antonio; Cárdenas, Diego J.; Echavarren, Antonio M.","Gold(I)-Catalyzed Intramolecular [4+2] Cycloadditions of Arylalkynes or 1,3-Enynes with Alkenes: Scope and Mechanism","Journal of the American Chemical Society","2008","130","1","269","279","10.1021/ja075794x","","","0.71073","MoKα","","0.0486","0.0364","","","0.0913","0.0943","","","","","","1.048","","","","has coordinates","288243","2023-12-12","09:57:13",""
"4101745","14.872","0.003","13.467","0.003","22.558","0.005","90","","90","","90","","4517.9","1.7","100","0.1","100","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","frowh01","","","- C23 H38 O4 Si -","- C23 H38 O4 Si -","- C184 H304 O32 Si8 -","8","1","","He, Wei; Huang, Jie; Sun, Xiufeng; Frontier, Alison J.","Total Synthesis of (±)-Merrilactone A","Journal of the American Chemical Society","2008","130","1","300","308","10.1021/ja0761986","","","0.71073","MoKα","","0.0624","0.0497","","","0.137","0.1447","","","","","","1.055","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101746","10.3046","0.0009","11.086","0.001","11.7039","0.001","90","","109.354","0.001","90","","1261.46","0.19","100","0.1","100","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","frowh03","","","- C14 H16 O5 -","- C14 H16 O5 -","- C56 H64 O20 -","4","1","","He, Wei; Huang, Jie; Sun, Xiufeng; Frontier, Alison J.","Total Synthesis of (±)-Merrilactone A","Journal of the American Chemical Society","2008","130","1","300","308","10.1021/ja0761986","","","0.71073","MoKα","","0.0448","0.0351","","","0.091","0.0971","","","","","","1.025","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4107275","12.7029","0.001","24.0572","0.0015","14.2748","0.0013","90","","107.168","0.01","90","","4168","0.6","123","","123","1","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H49 Cl O P2 Ru -","- C49 H49 Cl O P2 Ru -","- C196 H196 Cl4 O4 P8 Ru4 -","4","1","","Jörg Maurer; Michael Linseis; Biprajit Sarkar; Brigitte Schwederski; Mark Niemeyer; Wolfgang Kaim; Stanislav Záliš; Chris Anson; Manfred Zabel; Rainer F. Winter","Ruthenium Complexes with Vinyl, Styryl, and Vinylpyrenyl Ligands: A Case of Non-innocence in Organometallic Chemistry","Journal of the American Chemical Society","2008","130","","259","268","10.1021/ja075547t","","","0.71073","MoKα","","0.0537","0.0385","","","0.0935","0.0987","","","","","","1.016","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107276","12.8317","0.0009","11.5248","0.0008","21.1954","0.0016","90","","103.428","0.006","90","","3048.7","0.4","150","","150","1","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H53 Cl O P2 Ru -","- C25 H53 Cl O P2 Ru -","- C100 H212 Cl4 O4 P8 Ru4 -","4","1","","Jörg Maurer; Michael Linseis; Biprajit Sarkar; Brigitte Schwederski; Mark Niemeyer; Wolfgang Kaim; Stanislav Záliš; Chris Anson; Manfred Zabel; Rainer F. Winter","Ruthenium Complexes with Vinyl, Styryl, and Vinylpyrenyl Ligands: A Case of Non-innocence in Organometallic Chemistry","Journal of the American Chemical Society","2008","130","","259","268","10.1021/ja075547t","","x-ray","0.71073","MoKα","","0.0517","0.0363","","","0.0936","0.1005","","","","","","1.031","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107277","13.2318","0.00008","26.71192","0.0001","13.38617","0.0001","90","","111.927","0.0008","90","","4389.03","0.05","123","","123","","","","","","","","see text","7","P 1 21/n 1","-P 2yn","14","","","","- C51 H50 Cl N O3 P2 Ru -","- C51 H50 Cl N O3 P2 Ru -","- C204 H200 Cl4 N4 O12 P8 Ru4 -","4","1","","Jörg Maurer; Michael Linseis; Biprajit Sarkar; Brigitte Schwederski; Mark Niemeyer; Wolfgang Kaim; Stanislav Záliš; Chris Anson; Manfred Zabel; Rainer F. Winter","Ruthenium Complexes with Vinyl, Styryl, and Vinylpyrenyl Ligands: A Case of Non-innocence in Organometallic Chemistry","Journal of the American Chemical Society","2008","130","","259","268","10.1021/ja075547t","","x-ray","1.54184","CuKα","","0.0388","0.0336","","","0.0932","0.0966","","","","","","1.078","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107278","8.964447","","8.964447","","3.957573","","90","","90","","120","","275.427","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- C6 Pb3 S6 -","- C6 Pb3 S6 -","- C6 Pb3 S6 -","1","0.0416667","","Dayna L. Turner; Thomas P. Vaid; Peter W. Stephens; Kevin H. Stone; Antonio G. DiPasquale; Arnold L. Rheingold","Semiconducting Lead-Sulfur-Organic Network Solids","Journal of the American Chemical Society","2008","130","","14","15","10.1021/ja0770983","powder diffraction","","0.6983","","","","","","","","","","","1.523","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4107279","6.938088","","7.145047","","7.891146","","85.8921","","66.5585","","67.5922","","330.323","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C4 H5 N Pb S2 -","- C4 H5 N Pb S2 -","- C8 H10 N2 Pb2 S4 -","2","1","","Dayna L. Turner; Thomas P. Vaid; Peter W. Stephens; Kevin H. Stone; Antonio G. DiPasquale; Arnold L. Rheingold","Semiconducting Lead-Sulfur-Organic Network Solids","Journal of the American Chemical Society","2008","130","","14","15","10.1021/ja0770983","powder diffraction","","0.6967","","","","","","","","","","","1.347","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4107280","30.9179","0.001","30.9179","0.001","35.2839","0.0015","90","","90","","120","","29209.7","1.8","123","2","123","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C41 H74 F3 N9 O14 -","- C27 H44 N9 O9 -","- C486 H792 N162 O162 -","18","1","","Petra Rzepecki; Katrin Hochdörffer; Torsten Schaller; Jan Zienau; Klaus Harms; Christian Ochsenfeld; Xiulan Xie; Thomas Schrader","Hierarchical Self-Assembly of Aminopyrazole Peptides into Nanorosettes in Water","Journal of the American Chemical Society","2008","130","","586","591","10.1021/ja0744807","","","0.71073","MoKα","","0.0791","0.0434","","","0.0922","0.1001","","","","","","0.752","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107281","16.024","0.005","24.939","0.003","16.859","0.003","90","","113.376","0.019","90","","6184","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C124 H108 Cu2 N4 O20 P4 -","- C124 H92 Cu2 N4 O20 P4 -","- C248 H184 Cu4 N8 O40 P8 -","2","0.5","","Emilio Pardo; Rosa Carrasco; Rafael Ruiz-García; Miguel Julve; Francesc Lloret; M. Carmen Muñoz; Yves Journaux; Eliseo Ruiz; Joan Cano","Structure and Magnetism of Dinuclear Copper(II) Metallacyclophanes with Oligoacenebis(oxamate) Bridging Ligands: Theoretical Predictions on Wirelike Magnetic Coupling","Journal of the American Chemical Society","2008","130","","576","585","10.1021/ja0747066","","","0.71073","MoKα","","0.1857","0.0865","","","0.217","0.2693","","","","","","1.111","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107282","10.7092","0.0009","11.3859","0.0009","18.7092","0.0015","95.66","0.004","103.796","0.004","106.241","0.004","2093.4","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H50 B F4 O P3 Pt -","- C40 H50 B F4 O P3 Pt -","- C80 H100 B2 F8 O2 P6 Pt2 -","2","1","","Jeremiah A. Feducia; Michel R. Gagné","Reversibility Effects on the Stereoselectivity of Pt(II)-Mediated Cascade Poly-ene Cyclizations","Journal of the American Chemical Society","2008","130","","592","599","10.1021/ja075518i","","","0.71073","MoKα","","0.0345","0.0328","","","0.0836","0.0844","","","","","","1.086","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107283","18.7099","0.0012","25.8448","0.0013","10.7596","0.0004","90","","90","","90","","5202.8","0.5","173","2","173","2","","","","","","","","10","P 21 21 2","P 2 2ab","18","","","","- C50.5 H55 B Cl F4 N O2 P3 Pt S -","- C50.5 H55 B Cl F4 N O2 P3 Pt S -","- C202 H220 B4 Cl4 F16 N4 O8 P12 Pt4 S4 -","4","1","","Jeremiah A. Feducia; Michel R. Gagné","Reversibility Effects on the Stereoselectivity of Pt(II)-Mediated Cascade Poly-ene Cyclizations","Journal of the American Chemical Society","2008","130","","592","599","10.1021/ja075518i","","","0.71073","MoKα","","0.0979","0.0706","","","0.1536","0.1683","","","","","","1.093","","","","has coordinates,has disorder","178818","2020-10-21","18:00:00",""
"4107284","10.5334","0.0014","44.022","0.006","19.544","0.003","90","","101.358","0.006","90","","8885","2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H50 B F4 O P3 Pt -","- C44 H50 B F4 O P3 Pt -","- C352 H400 B8 F32 O8 P24 Pt8 -","8","2","","Jeremiah A. Feducia; Michel R. Gagné","Reversibility Effects on the Stereoselectivity of Pt(II)-Mediated Cascade Poly-ene Cyclizations","Journal of the American Chemical Society","2008","130","","592","599","10.1021/ja075518i","","","0.71073","MoKα","","0.1103","0.0771","","","0.177","0.1918","","","","","","1.031","","","","has coordinates,has disorder","178818","2020-10-21","18:00:00",""
"4107285","12.3625","0.0004","12.3557","0.0004","19.3979","0.0009","96.957","0.002","93.558","0.002","119.028","0.002","2546.66","0.18","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H54 N2 O10 S2 -","- C58 H54 N2 O10 S2 -","- C116 H108 N4 O20 S4 -","2","1","","Seung-Doo Jeong; Jonathan L. Sessler; Vincent Lynch; Chang-Hee Lee","Dithiabenzisapphyrin: A Core-Modified Sapphyrin Bearing Exocyclic Double Bonds at themeso-Positions","Journal of the American Chemical Society","2008","130","","390","391","10.1021/ja075800p","","","0.71073","MoKα","","0.1517","0.0637","","","0.1083","0.1346","","","","","","1.015","","","","has coordinates,has disorder","178818","2020-10-21","18:00:00",""
"4107286","4.0985","0.001","6.5533","0.0016","26.857","0.007","90","","90","","90","","721.3","0.3","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H2 Br2 N2 O -","- C6 H2 Br2 N2 O -","- C24 H8 Br8 N8 O4 -","4","1","","Nicolas Blouin; Alexandre Michaud; David Gendron; Salem Wakim; Emily Blair; Rodica Neagu-Plesu; Michel Belletête; Gilles Durocher; Ye Tao; Mario Leclerc","Toward a Rational Design of Poly(2,7-Carbazole) Derivatives for Solar Cells","Journal of the American Chemical Society","2008","130","","732","742","10.1021/ja0771989","","","0.71073","MoKα","","0.0275","0.0234","","","0.0563","0.0572","","","","","","1.311","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107287","3.97","0.003","17.147","0.013","10.871","0.008","90","","90.057","0.009","90","","740","1","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H Br Cl N3 S -","- C5 H Br Cl N3 S -","- C20 H4 Br4 Cl4 N12 S4 -","4","1","","Nicolas Blouin; Alexandre Michaud; David Gendron; Salem Wakim; Emily Blair; Rodica Neagu-Plesu; Michel Belletête; Gilles Durocher; Ye Tao; Mario Leclerc","Toward a Rational Design of Poly(2,7-Carbazole) Derivatives for Solar Cells","Journal of the American Chemical Society","2008","130","","732","742","10.1021/ja0771989","","","0.71073","MoKα","","0.0646","0.0559","","","0.137","0.1395","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107288","16.2719","0.0001","27.306","0.0003","15.1544","0.0004","90","","90","","90","","6733.4","0.2","110","2","110","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C54 H72 F6 I6 P6 Pt3 -","- C54 H72 F6 I6 P6 Pt3 -","- C216 H288 F24 I24 P24 Pt12 -","4","0.5","","Anette Yahav-Levi; Israel Goldberg; Arkadi Vigalok; Andrei N. Vedernikov","Competitive Aryl-Iodide vs Aryl-Aryl Reductive Elimination Reactions in Pt(IV) Complexes: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","724","731","10.1021/ja077258a","","","0.71073","MoKα","","0.0485","0.0389","","","0.0897","0.0952","","","","","","1.079","","","","has coordinates,has disorder","178818","2020-10-21","18:00:00",""
"4107289","16.3151","0.0002","16.4521","0.0003","16.5118","0.0003","90","","90","","90","","4432.06","0.13","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H24 F2 I2 P2 Pt -","- C18 H24 F2 I2 P2 Pt -","- C144 H192 F16 I16 P16 Pt8 -","8","1","","Anette Yahav-Levi; Israel Goldberg; Arkadi Vigalok; Andrei N. Vedernikov","Competitive Aryl-Iodide vs Aryl-Aryl Reductive Elimination Reactions in Pt(IV) Complexes: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","724","731","10.1021/ja077258a","","","0.71073","MoKα","","0.0558","0.0389","","","0.086","0.0932","","","","","","1.083","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107290","9.2719","0.0003","12.7773","0.0004","12.8114","0.0004","97.5703","0.0012","98.9282","0.0012","92.0227","0.0017","1483.9","0.08","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H29 Cl2 F2 I2 P2 Pt -","- C26 H29 Cl2 F2 I2 P2 Pt -","- C52 H58 Cl4 F4 I4 P4 Pt2 -","2","1","","Anette Yahav-Levi; Israel Goldberg; Arkadi Vigalok; Andrei N. Vedernikov","Competitive Aryl-Iodide vs Aryl-Aryl Reductive Elimination Reactions in Pt(IV) Complexes: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","724","731","10.1021/ja077258a","","","0.71073","MoKα","","0.0871","0.049","","","0.1133","0.1335","","","","","","0.999","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107291","8.6665","0.0002","18.8864","0.0005","11.6524","0.0002","90","","93.018","0.002","90","","1904.61","0.07","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 F I P2 Pt -","- C16 H20 F I P2 Pt -","- C64 H80 F4 I4 P8 Pt4 -","4","1","","Anette Yahav-Levi; Israel Goldberg; Arkadi Vigalok; Andrei N. Vedernikov","Competitive Aryl-Iodide vs Aryl-Aryl Reductive Elimination Reactions in Pt(IV) Complexes: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","724","731","10.1021/ja077258a","","","0.71073","MoKα","","0.0593","0.0425","","","0.0942","0.102","","","","","","1.036","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107292","7.6822","0.0002","8.574","0.0003","19.742","0.0007","90","","90","","90","","1300.35","0.07","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H16 O3 -","- C16 H16 O3 -","- C64 H64 O12 -","4","1","","Ngoc T. Vo; Robert D. M. Pace; Fionn O'Har; Matthew J. Gaunt","An Enantioselective Organocatalytic Oxidative Dearomatization Strategy","Journal of the American Chemical Society","2008","130","","404","405","10.1021/ja077457u","","","0.71073","MoKα","","0.0582","0.0437","","","0.098","0.1042","","","","","","1.056","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107293","8.37","0.0001","8.8878","0.0001","27.3366","0.0005","90","","90","","90","","2033.59","0.05","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H22 N2 O4 S -","- C22 H22 N2 O4 S -","- C88 H88 N8 O16 S4 -","4","1","","Ngoc T. Vo; Robert D. M. Pace; Fionn O'Har; Matthew J. Gaunt","An Enantioselective Organocatalytic Oxidative Dearomatization Strategy","Journal of the American Chemical Society","2008","130","","404","405","10.1021/ja077457u","","","0.71073","MoKα","","0.0482","0.0361","","","0.0773","0.0827","","","","","","1.018","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107294","16.7608","0.0007","8.7196","0.0004","15.6479","0.0006","90","","103.459","0.001","90","","2224.1","0.16","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H12 Br2 N2 -","- C11 H12 Br2 N2 -","- C88 H96 Br16 N16 -","8","1","","Chen Zhang; Chandra Kanta De; Rudrajit Mal; Daniel Seidel","α-Amination of Nitrogen Heterocycles: Ring-Fused Aminals","Journal of the American Chemical Society","2008","130","","416","417","10.1021/ja077473r","","","0.71073","MoKα","","0.0277","0.0228","","","0.0557","0.0572","","","","","","1.005","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107295","18.333","0.002","7.6856","0.001","18.386","0.002","90","","108.073","0.002","90","","2462.8","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Br2 N2 -","- C12 H14 Br2 N2 -","- C96 H112 Br16 N16 -","8","2","","Chen Zhang; Chandra Kanta De; Rudrajit Mal; Daniel Seidel","α-Amination of Nitrogen Heterocycles: Ring-Fused Aminals","Journal of the American Chemical Society","2008","130","","416","417","10.1021/ja077473r","","","0.71073","MoKα","","0.0405","0.0317","","","0.0745","0.0773","","","","","","1.007","","","","has coordinates,has disorder","178818","2020-10-21","18:00:00",""
"4107296","14.0594","0.0012","17.0448","0.0014","27.588","0.002","90","","102.559","0.002","90","","6453","0.9","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C57 H94 N10 O16 -","- C57 H94 N10 O16 -","- C228 H376 N40 O64 -","4","1","","Naoki Ousaka; Tomohiro Sato; Reiko Kuroda","Intramolecular Crosslinking of an Optically Inactive 310-Helical Peptide: Stabilization of Structure and Helix Sense","Journal of the American Chemical Society","2008","130","","463","465","10.1021/ja077857h","","","0.71073","MoKα","","0.1153","0.0704","","","0.1542","0.1738","","","","","","1.031","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107297","24.3532","0.0014","29.3664","0.0016","17.4082","0.001","90","","90","","90","","12449.7","1.2","110","2","110","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","","","- C117 H168.5 N23.5 O27 -","- C117 H165 N23.5 O27 -","- C468 H660 N94 O108 -","4","1","","Naoki Ousaka; Tomohiro Sato; Reiko Kuroda","Intramolecular Crosslinking of an Optically Inactive 310-Helical Peptide: Stabilization of Structure and Helix Sense","Journal of the American Chemical Society","2008","130","","463","465","10.1021/ja077857h","","","0.71073","MoKα","","0.117","0.0754","","","0.1708","0.1951","","","","","","1.034","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107298","10.549","0.002","11.907","0.003","36.842","0.008","90","","90","","90","","4627.6","1.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H25 N O4 S -","- C26 H25 N O4 S -","- C208 H200 N8 O32 S8 -","8","2","","Ming He; Jeffrey W. Bode","Enantioselective, NHC-Catalyzed Bicyclo-β-Lactam Formation via Direct Annulations of Enals and Unsaturated N-Sulfonyl Ketimines","Journal of the American Chemical Society","2008","130","","418","419","10.1021/ja0778592","","","0.71073","MoKα","","0.1073","0.048","","","0.0921","0.1043","","","","","","0.856","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107299","13.985","0.003","14.281","0.004","17.057","0.003","94.387","0.009","113.318","0.008","112.094","0.01","2795.1","1.2","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H81 B N3 O4 -","- C61 H81 B N3 O4 -","- C122 H162 B2 N6 O8 -","2","1","","Eiji Tsurumaki; Shohei Saito; Kil Suk Kim; Jong Min Lim; Yasuhide Inokuma; Dongho Kim; Atsuhiro Osuka","Synthesis and Characterization of meso-Aryl-Substituted Subchlorins","Journal of the American Chemical Society","2008","130","","438","439","10.1021/ja078042b","","","0.71075","MoKα","","0.1241","0.0799","","","0.2008","0.2306","","","","","","1.047","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4107300","14.0272","0.0017","14.2782","0.0018","17.054","0.002","94.453","0.002","113.348","0.002","112.079","0.002","2801","0.6","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H78 B N3 O4 -","- C60.988 H77.984 B N3 O4 -","- C121.976 H155.968 B2 N6 O8 -","2","1","","Eiji Tsurumaki; Shohei Saito; Kil Suk Kim; Jong Min Lim; Yasuhide Inokuma; Dongho Kim; Atsuhiro Osuka","Synthesis and Characterization of meso-Aryl-Substituted Subchlorins","Journal of the American Chemical Society","2008","130","","438","439","10.1021/ja078042b","","","0.71073","MoKα","","0.1094","0.0717","","","0.1882","0.2122","","","","","","1.03","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107301","8.1023","0.0005","15.3441","0.0009","15.9356","0.001","90","","90","","90","","1981.2","0.2","220","2","220","2","","","","","","","","4","P n m a","-P 2ac 2n","62","cmpd 2","Hafnium dimethyl complex","","- C18 H34 Hf N2 -","- C18 H34 Hf N2 -","- C72 H136 Hf4 N8 -","4","0.5","","Wei Zhang; Lawrence R. Sita","Highly Efficient, Living Coordinative Chain-Transfer Polymerization of Propene with ZnEt2: Practical Production of Ultrahigh to Very Low Molecular Weight Amorphous Atactic Polypropenes of Extremely Narrow Polydispersity","Journal of the American Chemical Society","2008","130","","442","443","10.1021/ja078120v","","","0.71073","MoKα","","0.0193","0.0156","","","0.0367","0.0387","","","","","","0.998","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107302","11.427","0.003","13.496","0.003","15.46","0.004","64.761","0.003","80.814","0.004","84.864","0.004","2128.3","0.9","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H40 B4 Br4 N4 O17 -","- C30 H40 B4 Br4 N4 O17 -","- C60 H80 B8 Br8 N8 O34 -","2","1","","Suk Joong Lee; Kaitlyn C. Gray; James S. Paek; Martin D. Burke","Simple, Efficient, and Modular Syntheses of Polyene Natural Products via Iterative Cross-Coupling","Journal of the American Chemical Society","2008","130","","466","468","10.1021/ja078129x","","","0.71073","MoKα","","0.059","0.0338","","","0.0699","0.0784","","","","","","1.002","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107303","6.9032","0.0014","16.06","0.003","16.51","0.003","87.714","0.012","84.74","0.011","80.831","0.012","1798.8","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C13.5 H22 B2 N O6.25 -","- C13.5 H22 B2 N O6.25 -","- C54 H88 B8 N4 O25 -","4","2","","Suk Joong Lee; Kaitlyn C. Gray; James S. Paek; Martin D. Burke","Simple, Efficient, and Modular Syntheses of Polyene Natural Products via Iterative Cross-Coupling","Journal of the American Chemical Society","2008","130","","466","468","10.1021/ja078129x","","","0.71073","MoKα","","0.2781","0.1097","","","0.2258","0.2804","","","","","","1.345","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107304","8.3828","0.0011","14.6251","0.0017","23.336","0.004","90","","90","","90","","2861","0.7","143","1","143","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H40 O3 S2 Si -","- C27 H40 O3 S2 Si -","- C108 H160 O12 S8 Si4 -","4","1","","Amos B. Smith; Matthew O. Duffey; Kallol Basu; Shawn P. Walsh; Hans W. Suennemann; Michael Frohn","Total Syntheses of the Assigned Structures of Lituarines B and C","Journal of the American Chemical Society","2008","130","","422","423","10.1021/ja078293k","","","0.71069","MoKα","","0.0383","0.028","","","0.0484","0.0516","","","","","","0.8","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107305","9.719","0.01","10.141","0.01","21.25","0.02","90","","98.578","0.016","90","","2071","4","143","1","143","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C34 H59 Cl2 I O8 Si -","- C34 H59 Cl2 I O8 Si -","- C68 H118 Cl4 I2 O16 Si2 -","2","1","","Amos B. Smith; Matthew O. Duffey; Kallol Basu; Shawn P. Walsh; Hans W. Suennemann; Michael Frohn","Total Syntheses of the Assigned Structures of Lituarines B and C","Journal of the American Chemical Society","2008","130","","422","423","10.1021/ja078293k","","","0.71069","MoKα","","0.1211","0.0864","","","0.1985","0.2242","","","","","","1.086","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107306","27.2326","0.0015","27.2326","0.0015","27.2326","0.0015","90","","90","","90","","20196.1","1.9","213","2","213","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- C10 H12 Ag2 N4 -","- C10 H12 Ag2 N4 -","- C480 H576 Ag96 N192 -","48","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.0806","0.0613","","","0.0917","0.1012","","","","","","1.01","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107307","18.537","0.0019","46.211","0.005","34.925","0.004","90","","90","","90","","29917","6","153","2","153","2","","","","","","","","4","C c c a :2","-C 2a 2ac","68","","","","- C60 H72 Cu12 N24 -","- C60 H72 Cu12 N24 -","- C960 H1152 Cu192 N384 -","16","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.0712","0.0512","","","0.1015","0.1109","","","","","","1.029","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107308","19.2056","0.0005","47.9669","0.0016","36.2063","0.0009","90","","90","","90","","33354.4","1.6","213","2","213","2","","","","","","","","4","C c c a :2","-C 2a 2ac","68","","","","- C60 H72 Ag12 N24 -","- C60 H72 Ag12 N24 -","- C960 H1152 Ag192 N384 -","16","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.0703","0.0494","","","0.0879","0.0975","","","","","","1.014","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107309","26.407","0.003","26.407","0.003","26.407","0.003","90","","90","","90","","18414","4","373","2","373","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- C10 H12 Cu2 N4 -","- C10 H12 Cu2 N4 -","- C480 H576 Cu96 N192 -","48","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.1169","0.0642","","","0.1617","0.2063","","","","","","1.013","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107310","61.7239","0.0011","61.7239","0.0011","26.9189","0.0005","90","","90","","90","","102557","3","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C222 H276 Ag30 N60 -","- C222 H276 Ag30 N60 -","- C3552 H4416 Ag480 N960 -","16","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.0821","0.0548","","","0.1051","0.1158","","","","","","1.051","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107311","27.1756","0.0008","27.1756","0.0008","81.019","0.003","90","","90","","90","","59834","3","123","2","123","2","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C90 H108 Ag18 N36 -","- C90 H108 Ag18 N36 -","- C1440 H1728 Ag288 N576 -","16","1","","Jie-Peng Zhang; Susumu Kitagawa","Supramolecular Isomerism, Framework Flexibility, Unsaturated Metal Center, and Porous Property of Ag(I)/Cu(I) 3,3',5,5'-Tetrametyl-4,4'-Bipyrazolate","Journal of the American Chemical Society","2008","130","","907","917","10.1021/ja075408b","","","0.71073","MoKα","","0.1741","0.1664","","","0.3831","0.387","","","","","","1.441","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107312","10.307","0.004","9.951","0.004","18.585","0.007","90","","98.394","0.006","90","","1885.8","1.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H48 As2 K2 O12 Te2 -","- C24 H48 As2 K2 O12 Te2 -","- C48 H96 As4 K4 O24 Te4 -","2","0.5","","Angel Ugrinov; Ayusman Sen; Arthur C. Reber; Meichun Qian; Shiv N. Khanna","[Te2As2]2-: A Planar Motif with ""Conflicting"" Aromaticity","Journal of the American Chemical Society","2008","130","","782","783","10.1021/ja075513l","","","0.71073","MoKα","","0.0637","0.0599","","","0.1972","0.2025","","","","","","1.116","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107313","26.564","0.002","26.564","0.002","10.8869","0.0009","90","","90","","120","","6653.1","0.9","100","2","100","2","","","","","","","","3","P 63/m","-P 6c","176","La2@C78Ad","La2@C78Ad","","- C90 H18.67 La2 -","- C90.3594 H19.4 La2 -","- C542.156 H116.4 La12 -","6","0.5","","Baopeng Cao; Hidefumi Nikawa; Tsukasa Nakahodo; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Hiroshi Sawa; Zdenek Slanina; Naomi Mizorogi; Shigeru Nagase","Addition of Adamantylidene to La2@C78: Isolation and Single-Crystal X-ray Structural Determination of the Monoadducts","Journal of the American Chemical Society","2008","130","","983","989","10.1021/ja076462v","","x-ray","0.6887","synchrotron","","0.1175","0.0711","","","0.2221","0.2349","","","","","","1.022","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107314","9.546","0.003","10.848","0.003","18.803","0.005","93.51","0.005","91.168","0.005","94.964","0.006","1935.6","1","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C46.5 H45 Cl2 N3 O1.5 P Rh -","- C46.5 H45 Cl2 N3 O1.5 P Rh -","- C93 H90 Cl4 N6 O3 P2 Rh2 -","2","1","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition-Metal Complexes","Journal of the American Chemical Society","2008","130","","990","1002","10.1021/ja076709o","","","0.7107","MoKα","","0.1018","0.0698","","","0.1686","0.1966","","","","","","1.121","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107315","11.4831","0.0018","13.406","0.002","13.519","0.002","80.666","0.006","86.396","0.006","66.557","0.005","1884.1","0.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H43 Cl2 N2 O P -","- C46 H43 Cl2 N2 O P -","- C92 H86 Cl4 N4 O2 P2 -","2","1","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition-Metal Complexes","Journal of the American Chemical Society","2008","130","","990","1002","10.1021/ja076709o","","","0.7107","MoKα","","0.0747","0.0579","","","0.1214","0.1306","","","","","","1.05","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107316","9.57301","0.00017","10.8775","0.0002","40.2774","0.0007","90","","90.5195","0.0007","90","","4193.93","0.13","100.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H51 Cl2 N3 O P Rh -","- C50 H51 Cl2 N3 O P Rh -","- C200 H204 Cl8 N12 O4 P4 Rh4 -","4","1","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition-Metal Complexes","Journal of the American Chemical Society","2008","130","","990","1002","10.1021/ja076709o","","","1.54187","CuKα","","","0.0539","","","","0.1334","","","","","","1.074","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107317","14.7171","0.0016","12.7237","0.0013","20.121","0.002","90","","96.749","0.002","90","","3741.7","0.7","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H39 Au Cl N2 P S -","- C45 H39 Au Cl N2 P S -","- C180 H156 Au4 Cl4 N8 P4 S4 -","4","1","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition-Metal Complexes","Journal of the American Chemical Society","2008","130","","990","1002","10.1021/ja076709o","","","0.7107","MoKα","","0.0368","0.0306","","","0.0622","0.0646","","","","","","1.044","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107318","11.056","0.002","13.536","0.003","14.851","0.003","108.605","0.003","93.413","0.001","100.105","0.003","2057.7","0.7","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H53 N2 O P Pd -","- C51 H53 N2 O P Pd -","- C102 H106 N4 O2 P2 Pd2 -","2","1","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition-Metal Complexes","Journal of the American Chemical Society","2008","130","","990","1002","10.1021/ja076709o","","","0.7107","MoKα","","0.0405","0.0367","","","0.0905","0.0921","","","","","","1.064","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107319","25.9707","0.0005","10.16657","0.00018","31.7731","0.0006","90","","113.403","0.0007","90","","7699","0.3","93.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H42 Cl2 N3 P -","- C46 H42 Cl2 N3 P -","- C368 H336 Cl16 N24 P8 -","8","2","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition-Metal Complexes","Journal of the American Chemical Society","2008","130","","990","1002","10.1021/ja076709o","","","1.54187","CuKα","","","0.1414","","","","0.4181","","","","","","1.237","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107320","10.9623","0.0002","22.194","0.0005","12.8804","0.0003","90","","112.154","0.001","90","","2902.41","0.11","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H39 F3 Ir N O -","- C31 H39 F3 Ir N O -","- C124 H156 F12 Ir4 N4 O4 -","4","1","","Mark R. Ringenberg; Swarna Latha Kokatam; Zachariah M. Heiden; Thomas B. Rauchfuss","Redox-Switched Oxidation of Dihydrogen Using a Non-Innocent Ligand","Journal of the American Chemical Society","2008","130","","788","789","10.1021/ja076801k","","","0.71073","MoKα","","0.0559","0.0349","","","0.0827","0.0925","","","","","","1.036","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107321","12.7251","0.0003","16.5921","0.0004","18.5918","0.0005","102.098","0.002","102.096","0.002","100.019","0.002","3654.24","0.17","297","2","297","2","","","","","","","","8","P -1","-P 1","2","","","","- C65 H55 B Cl4 F27 Ir N O -","- C65 H55 B Cl4 F27 Ir N O -","- C130 H110 B2 Cl8 F54 Ir2 N2 O2 -","2","1","","Mark R. Ringenberg; Swarna Latha Kokatam; Zachariah M. Heiden; Thomas B. Rauchfuss","Redox-Switched Oxidation of Dihydrogen Using a Non-Innocent Ligand","Journal of the American Chemical Society","2008","130","","788","789","10.1021/ja076801k","","","0.71073","MoKα","","0.1112","0.0657","","","0.1574","0.1819","","","","","","1.037","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107322","21.4287","0.0007","21.4287","0.0007","23.3492","0.0009","90","","90","","120","","9285.3","0.6","120","2","120","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C74 H208 Co13 N18 O62 -","- C74 H108 Co13 N18 O62.04 -","- C148 H216 Co26 N36 O124.08 -","2","0.0833333","","Graham N. Newton; Geoffrey J. T. Cooper; Paul Kögerler; De-Liang Long; Leroy Cronin","Trading Templates: Supramolecular Transformations between {CoII13} and {CoII12} Nanoclusters","Journal of the American Chemical Society","2008","130","","790","791","10.1021/ja0768183","","","0.71073","MoKα","","0.1129","0.0778","","","0.2144","0.2478","","","","","","1.072","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107323","15.19","0.003","16.496","0.003","43.489","0.007","90","","90","","90","","10897","3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C73 H119.5 Cl2 N12.5 O34 Zn -","- C73 H95.5 Cl2 N12.5 O34 Zn -","- C292 H382 Cl8 N50 O136 Zn4 -","4","1","","Hiroyuki Miyake; Hiroshi Kamon; Ikuko Miyahara; Hideki Sugimoto; Hiroshi Tsukube","Time-Programmed Peptide Helix Inversion of a Synthetic Metal Complex Triggered by an Achiral NO3- Anion","Journal of the American Chemical Society","2008","130","","792","793","10.1021/ja0768385","","","0.7107","MoKα","","0.192","0.1634","","","0.3946","0.4169","","","","","","1.159","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107324","15.6682","0.0008","15.6682","0.0008","37.154","0.002","90","","90","","120","","7899","0.7","100","2","100","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C79 H102 Cl15 N15 O20 Zn -","- C79 H102 Cl15 N15 O20 Zn -","- C237 H306 Cl45 N45 O60 Zn3 -","3","0.5","","Hiroyuki Miyake; Hiroshi Kamon; Ikuko Miyahara; Hideki Sugimoto; Hiroshi Tsukube","Time-Programmed Peptide Helix Inversion of a Synthetic Metal Complex Triggered by an Achiral NO3- Anion","Journal of the American Chemical Society","2008","130","","792","793","10.1021/ja0768385","","","0.7107","MoKα","","0.1217","0.118","","","0.3496","0.3531","","","","","","1.66","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107325","10.1639","0.0019","12.297","0.002","14.944","0.003","90","","109.881","0.001","90","","1756.5","0.6","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","frowh05","","","- C19 H22 O7 -","- C19 H22 O7 -","- C76 H88 O28 -","4","1","","Wei He; Ildiko R. Herrick; Tulay A. Atesin; Patrick A. Caruana; Colleen A. Kellenberger; Alison J. Frontier","Polarizing the Nazarov Cyclization: The Impact of Dienone Substitution Pattern on Reactivity and Selectivity","Journal of the American Chemical Society","2008","130","","1003","1011","10.1021/ja077162g","","","0.71073","MoKα","","0.0605","0.0452","","","0.107","0.1143","","","","","","1.03","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107326","18.453","0.0004","18.453","0.0004","76.976","0.004","90","","90","","120","","22699.7","1.4","90","2","90","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","PCN-14","","","- C270 H162 Cu18 O90 -","- C270 H126 Cu18 O90 -","- C540 H252 Cu36 O180 -","2","0.0555556","","Shengqian Ma; Daofeng Sun; Jason M. Simmons; Christopher D. Collier; Daqiang Yuan; Hong-Cai Zhou","Metal-Organic Framework from an Anthracene Derivative Containing Nanoscopic Cages Exhibiting High Methane Uptake","Journal of the American Chemical Society","2008","130","","1012","1016","10.1021/ja0771639","","","1.54178","CuKα","","0.0597","0.0518","","","0.1591","0.1658","","","","","","1.071","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107327","14.4595","0.0006","15.5595","0.0005","43.521","0.002","90","","96.035","0.005","90","","9737.2","0.7","150","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C89 H100 Cl3 Eu N17 O13.5 S3 -","- C89 H93 Cl3 Eu N17 O13.5 S3 -","- C356 H372 Cl12 Eu4 N68 O54 S12 -","4","1","","Gabriel Canard; Sylvain Koeller; Gérald Bernardinelli; Claude Piguet","Effective Concentration as a Tool for Quantitatively Addressing Preorganization in Multicomponent Assemblies: Application to the Selective Complexation of Lanthanide Cations","Journal of the American Chemical Society","2008","130","","1025","1040","10.1021/ja0772290","","","0.71073","MoKα","","","0.05","","","","0.049","","","","","","1.37","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107328","12.5244","0.0006","18.3649","0.0008","32.6093","0.0015","90","","90","","90","","7500.4","0.6","90","2","90","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","[RNiCO][BF4]2 + 4DCM","","","- C65 H96 B2 Cl8 F8 N4 Ni O P4 -","- C65 H96 B2 Cl8 F8 N4 Ni O P4 -","- C260 H384 B8 Cl32 F32 N16 Ni4 O4 P16 -","4","1","","Aaron D. Wilson; Kendra Fraze; Brendan Twamley; Susie M. Miller; Daniel L. DuBois; M. Rakowski DuBois","The Role of the Second Coordination Sphere of [Ni(PCy2NBz2)2](BF4)2 in Reversible Carbon Monoxide Binding","Journal of the American Chemical Society","2008","130","","1061","1068","10.1021/ja077328d","","","0.71073","MoKα","","0.0502","0.0445","","","0.1155","0.1191","","","","","","1.062","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107329","12.5357","0.0007","17.9197","0.0009","33.6355","0.0018","90","","90","","90","","7555.7","0.7","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C73 H112 B2 F8 N6 Ni O P4 -","- C73 H112 B2 F8 N6 Ni O P4 -","- C292 H448 B8 F32 N24 Ni4 O4 P16 -","4","1","","Aaron D. Wilson; Kendra Fraze; Brendan Twamley; Susie M. Miller; Daniel L. DuBois; M. Rakowski DuBois","The Role of the Second Coordination Sphere of [Ni(PCy2NBz2)2](BF4)2 in Reversible Carbon Monoxide Binding","Journal of the American Chemical Society","2008","130","","1061","1068","10.1021/ja077328d","","","0.71073","MoKα","","0.1058","0.06","","","0.1258","0.1447","","","","","","0.994","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107330","39.938","0.006","39.938","0.006","39.938","0.006","90","","90","","90","","63703","17","173","2","173","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C42 H40 N2 O18 Zn4 -","- C42.08 H41.12 N2 O18 Zn4 -","- C1009.92 H986.88 N48 O432 Zn96 -","24","0.125","","Hyungphil Chun","Low-Level Self-Assembly of Open Framework Based on Three Different Polyhedra: Metal-Organic Analogue of Face-Centered Cubic Dodecaboride","Journal of the American Chemical Society","2008","130","","800","801","10.1021/ja0776778","","","0.71073","MoKα","","0.1035","0.0892","","","0.2092","0.2195","","","","","","1.18","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107331","10.51","0.011","25.71","0.03","11.552","0.017","90","","114.11","0.05","90","","2849","6","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H36 N2 O5 S Si -","- C28 H36 N2 O5 S Si -","- C112 H144 N8 O20 S4 Si4 -","4","1","","Yuji Onizawa; Hiroyuki Kusama; Nobuharu Iwasawa","Efficient Control of π-Alkyne and Vinylidene Complex Pathways for the W(CO)5(L)-Catalyzed Synthesis of Two Types of Nitrogen-Containing Bicyclic Compounds","Journal of the American Chemical Society","2008","130","","802","803","10.1021/ja0782605","","","0.71075","MoKα","","0.0576","0.0485","","","0.1644","0.1731","","","","","","1.327","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107332","7.9221","0.0002","30.679","0.0007","6.319","0.0002","90","","100.367","0.002","90","","1510.71","0.07","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 N O4 S -","- C15 H19 N O4 S -","- C60 H76 N4 O16 S4 -","4","1","","Yuji Onizawa; Hiroyuki Kusama; Nobuharu Iwasawa","Efficient Control of π-Alkyne and Vinylidene Complex Pathways for the W(CO)5(L)-Catalyzed Synthesis of Two Types of Nitrogen-Containing Bicyclic Compounds","Journal of the American Chemical Society","2008","130","","802","803","10.1021/ja0782605","","","0.71073","MoKα","","0.0451","0.0424","","","0.1088","0.1112","","","","","","1.131","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107333","21.944","0.003","22.017","0.002","20.452","0.002","90","","90","","90","","9881.2","1.9","103","","103","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C96 H18 Cl2 La2 -","- C96 H18 Cl2 La2 -","- C768 H144 Cl16 La16 -","8","1","","Michio Yamada; Chika Someya; Takatsugu Wakahara; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Kenji Yoza; Ernst Horn; Michael T. H. Liu; Naomi Mizorogi; Shigeru Nagase","Metal Atoms Collinear with the Spiro Carbon of 6,6-Open Adducts, M2@C80(Ad) (M = La and Ce, Ad = Adamantylidene)","Journal of the American Chemical Society","2008","130","","1171","1176","10.1021/ja073924w","","","0.71075","MoKα","","0.0806","0.0602","","","0.1631","0.1714","","","","","","1.218","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107334","22.031","0.003","22.122","0.003","20.498","0.002","90","","90","","90","","9990","2","273","","273","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C96 H18 Cl2 La2 -","- C96 H18 Cl2 La2 -","- C768 H144 Cl16 La16 -","8","1","","Michio Yamada; Chika Someya; Takatsugu Wakahara; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Kenji Yoza; Ernst Horn; Michael T. H. Liu; Naomi Mizorogi; Shigeru Nagase","Metal Atoms Collinear with the Spiro Carbon of 6,6-Open Adducts, M2@C80(Ad) (M = La and Ce, Ad = Adamantylidene)","Journal of the American Chemical Society","2008","130","","1171","1176","10.1021/ja073924w","","","0.71075","MoKα","","0.1178","0.0746","","","0.18","0.1945","","","","","","1.192","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107335","21.966","0.003","22.066","0.003","20.473","0.002","90","","90","","90","","9923","2","188","","188","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C96 H18 Cl2 La2 -","- C96 H18 Cl2 La2 -","- C768 H144 Cl16 La16 -","8","1","","Michio Yamada; Chika Someya; Takatsugu Wakahara; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Kenji Yoza; Ernst Horn; Michael T. H. Liu; Naomi Mizorogi; Shigeru Nagase","Metal Atoms Collinear with the Spiro Carbon of 6,6-Open Adducts, M2@C80(Ad) (M = La and Ce, Ad = Adamantylidene)","Journal of the American Chemical Society","2008","130","","1171","1176","10.1021/ja073924w","","","0.71075","MoKα","","0.0843","0.0593","","","0.1582","0.1675","","","","","","1.148","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107336","21.958","0.003","22.035","0.002","20.4625","0.0017","90","","90","","90","","9900.7","1.8","133","","133","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C96 H18 Cl2 La2 -","- C96 H18 Cl2 La2 -","- C768 H144 Cl16 La16 -","8","1","","Michio Yamada; Chika Someya; Takatsugu Wakahara; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Kenji Yoza; Ernst Horn; Michael T. H. Liu; Naomi Mizorogi; Shigeru Nagase","Metal Atoms Collinear with the Spiro Carbon of 6,6-Open Adducts, M2@C80(Ad) (M = La and Ce, Ad = Adamantylidene)","Journal of the American Chemical Society","2008","130","","1171","1176","10.1021/ja073924w","","","0.71075","MoKα","","0.0757","0.059","","","0.1609","0.168","","","","","","1.232","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107337","10.4875","0.0008","17.2088","0.0013","21.1554","0.0015","90","","90","","90","","3818.1","0.5","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C42 H53 Cl Mo N2 O2 -","- C42 H53 Cl Mo N2 O2 -","- C168 H212 Cl4 Mo4 N8 O8 -","4","0.5","","Soumya Sarkar; Adam R. Carlson; Melanie K. Veige; Joseph M. Falkowski; Khalil A. Abboud; Adam S. Veige","Synthesis, Characterization, and Reactivity of a d2, Mo(IV) Complex Supported by a New OCO-Trianionic Pincer Ligand","Journal of the American Chemical Society","2008","130","","1116","1117","10.1021/ja074901k","","","0.71073","MoKα","","0.0386","0.0263","","","0.0771","0.0804","","","","","","1.241","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107338","8.5921","0.001","11.8394","0.0014","18.796","0.002","87.278","0.002","89.349","0.002","69.916","0.002","1793.7","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H57 Mo N3 O4 -","- C36 H57 Mo N3 O4 -","- C72 H114 Mo2 N6 O8 -","2","1","","Soumya Sarkar; Adam R. Carlson; Melanie K. Veige; Joseph M. Falkowski; Khalil A. Abboud; Adam S. Veige","Synthesis, Characterization, and Reactivity of a d2, Mo(IV) Complex Supported by a New OCO-Trianionic Pincer Ligand","Journal of the American Chemical Society","2008","130","","1116","1117","10.1021/ja074901k","","","0.71073","MoKα","","0.0772","0.0477","","","0.0957","0.109","","","","","","0.964","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107339","11.3721","0.0009","18.4744","0.0014","14.49","0.0011","90","","102","0.002","90","","2977.7","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H41 Br0 Mo N3 O3 -","- C31 H41 Br0.04 Mo N3 O3 -","- C124 H164 Br0.16 Mo4 N12 O12 -","4","1","","Soumya Sarkar; Adam R. Carlson; Melanie K. Veige; Joseph M. Falkowski; Khalil A. Abboud; Adam S. Veige","Synthesis, Characterization, and Reactivity of a d2, Mo(IV) Complex Supported by a New OCO-Trianionic Pincer Ligand","Journal of the American Chemical Society","2008","130","","1116","1117","10.1021/ja074901k","","","0.71073","MoKα","","0.0877","0.0539","","","0.1028","0.1136","","","","","","1.022","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107340","27.596","0.002","12.179","0.0011","15.0118","0.0013","90","","110.139","0.002","90","","4736.9","0.7","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H33.98 Br0.02 O2 -","- C28 H33.98 Br0.02 O2 -","- C224 H271.84 Br0.16 O16 -","8","1","","Soumya Sarkar; Adam R. Carlson; Melanie K. Veige; Joseph M. Falkowski; Khalil A. Abboud; Adam S. Veige","Synthesis, Characterization, and Reactivity of a d2, Mo(IV) Complex Supported by a New OCO-Trianionic Pincer Ligand","Journal of the American Chemical Society","2008","130","","1116","1117","10.1021/ja074901k","","","0.71073","MoKα","","0.068","0.0423","","","0.1066","0.1168","","","","","","1.05","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107341","14.1177","0.001","14.6884","0.001","15.0127","0.001","90","","100.867","0.001","90","","3057.3","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H40 Mo N3 Na O3 -","- C31 H40 Mo N3 Na O3 -","- C124 H160 Mo4 N12 Na4 O12 -","4","1","","Soumya Sarkar; Adam R. Carlson; Melanie K. Veige; Joseph M. Falkowski; Khalil A. Abboud; Adam S. Veige","Synthesis, Characterization, and Reactivity of a d2, Mo(IV) Complex Supported by a New OCO-Trianionic Pincer Ligand","Journal of the American Chemical Society","2008","130","","1116","1117","10.1021/ja074901k","","","0.71073","MoKα","","0.0377","0.027","","","0.0662","0.0695","","","","","","1.029","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107342","12.985","0.002","30.152","0.005","13.181","0.002","90","","118.745","0.003","90","","4524.7","1.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H85 Nb O3 Si3 -","- C38 H68.59 Nb O3 Si3 -","- C152 H274.36 Nb4 O12 Si12 -","4","1","","Kurt F. Hirsekorn; Elliott B. Hulley; Peter T. Wolczanski; Thomas R. Cundari","Olefin Substitution in (silox)3M(olefin) (silox =tBu3SiO; M = Nb, Ta): The Role of Density of States in Second vs Third Row Transition Metal Reactivity","Journal of the American Chemical Society","2008","130","","1183","1196","10.1021/ja074972j","","","0.71073","MoKα","","0.0736","0.0541","","","0.1834","0.1921","","","","","","1.358","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107343","24.2852","0.0013","8.8145","0.0005","23.9509","0.0013","90","","111.97","0.003","90","","4754.7","0.5","173","2","173","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C80 H180 O7 Si6 Ta2 -","- C80 H172 O7 Si6 Ta2 -","- C160 H344 O14 Si12 Ta4 -","2","1","","Kurt F. Hirsekorn; Elliott B. Hulley; Peter T. Wolczanski; Thomas R. Cundari","Olefin Substitution in (silox)3M(olefin) (silox =tBu3SiO; M = Nb, Ta): The Role of Density of States in Second vs Third Row Transition Metal Reactivity","Journal of the American Chemical Society","2008","130","","1183","1196","10.1021/ja074972j","","","0.71073","MoKα","","0.0484","0.0312","","","0.0616","0.0651","","","","","","1.015","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107344","12.6914","0.0005","17.3097","0.0007","22.8051","0.0008","90","","90.974","0.001","90","","5009.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H91 Nb O3 Si3 -","- C45 H91 Nb O3 Si3 -","- C180 H364 Nb4 O12 Si12 -","4","1","","Kurt F. Hirsekorn; Elliott B. Hulley; Peter T. Wolczanski; Thomas R. Cundari","Olefin Substitution in (silox)3M(olefin) (silox =tBu3SiO; M = Nb, Ta): The Role of Density of States in Second vs Third Row Transition Metal Reactivity","Journal of the American Chemical Society","2008","130","","1183","1196","10.1021/ja074972j","","","0.71073","MoKα","","0.0668","0.0396","","","0.0858","0.0958","","","","","","1.026","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107345","13.0005","0.0009","20.9227","0.0015","17.2188","0.0011","90","","91.034","0.003","90","","4682.8","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H89 Nb O3 Si3 -","- C40 H89 Nb O3 Si3 -","- C160 H356 Nb4 O12 Si12 -","4","1","","Kurt F. Hirsekorn; Elliott B. Hulley; Peter T. Wolczanski; Thomas R. Cundari","Olefin Substitution in (silox)3M(olefin) (silox =tBu3SiO; M = Nb, Ta): The Role of Density of States in Second vs Third Row Transition Metal Reactivity","Journal of the American Chemical Society","2008","130","","1183","1196","10.1021/ja074972j","","","0.71073","MoKα","","0.0653","0.0351","","","0.0849","0.0935","","","","","","1.072","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107346","9.6066","0.0002","10.5689","0.0002","19.4575","0.0002","77.684","0.0004","87.776","0.0004","72.669","0.0004","1841.8","0.06","193.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C31 H54 B Cl2 Cu N7 O -","- C31 H54 B Cl2 Cu N7 O -","- C62 H108 B2 Cl4 Cu2 N14 O2 -","2","1","","Kiyoshi Fujisawa; Akira Tateda; Yoshitaro Miyashita; Ken-ichi Okamoto; Florian Paulat; V. K. K. Praneeth; Anna Merkle; Nicolai Lehnert","Structural and Spectroscopic Characterization of Mononuclear Copper(I) Nitrosyl Complexes: End-on versus Side-on Coordination of NO to Copper(I)","Journal of the American Chemical Society","2008","130","","1205","1213","10.1021/ja075071d","","","0.7107","MoKα","","","0.0825","","","","0.1077","","","","","","1.829","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107347","33.4238","0.0017","15.7109","0.0005","10.2231","0.0004","90","","90","","90","","5368.3","0.4","183.1","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C35 H56 Cl13 Cu N7 O5 -","- C35 H56 Cl13 Cu N7 O5 -","- C140 H224 Cl52 Cu4 N28 O20 -","4","0.5","","Kiyoshi Fujisawa; Akira Tateda; Yoshitaro Miyashita; Ken-ichi Okamoto; Florian Paulat; V. K. K. Praneeth; Anna Merkle; Nicolai Lehnert","Structural and Spectroscopic Characterization of Mononuclear Copper(I) Nitrosyl Complexes: End-on versus Side-on Coordination of NO to Copper(I)","Journal of the American Chemical Society","2008","130","","1205","1213","10.1021/ja075071d","","","0.7107","MoKα","","","0.0677","","","","0.0948","","","","","","1.462","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107348","8.859","0.0008","8.859","0.0008","2.7094","0.0005","90","","90","","90","","212.64","0.05","293","2","293","2","","","","","","","","2","P 4/m b m","-P 4 2ab","127","","","","- Ga5 Mn2 -","- Ga5 Mn2 -","- Ga10 Mn4 -","2","0.125","","Sang-Hwan Kim; Magnus Boström; Dong-Kyun Seo","Two-Dimensional Superdegeneracy and Structure-Magnetism Correlations in Strong Ferromagnet, Mn2Ga5","Journal of the American Chemical Society","2008","130","","1384","1391","10.1021/ja0765924","","","0.71073","MoKα","","0.0404","0.0382","","","0.0818","0.083","","","","","","1.492","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107349","16.617","0.003","19.661","0.004","12.12","0.002","90","","90","","90","","3959.7","1.3","163","2","163","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C44 H28 Cd Cl2 N8 O8 -","- C44 H28 Cd Cl2 N8 O8.02 -","- C176 H112 Cd4 Cl8 N32 O32.08 -","4","0.25","","Gregory M. Cockrell; Gang Zhang; Donald G. VanDerveer; Randolph P. Thummel; Robert D. Hancock","Enhanced Metal Ion Selectivity of 2,9-Di-(pyrid-2-yl)-1,10-phenanthroline and Its Use as a Fluorescent Sensor for Cadmium(II)","Journal of the American Chemical Society","2008","130","","1420","1430","10.1021/ja077141m","","","0.71073","MoKα","","0.0367","0.0321","","","0.0705","0.0734","","","","","","1.138","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107350","13.651","0.003","11.338","0.002","15.033","0.003","90","","107.58","0.03","90","","2218.1","0.8","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 Cl2 Hg N4 O8.5 -","- C22 H14 Cl2 Hg N4 O8.5 -","- C88 H56 Cl8 Hg4 N16 O34 -","4","1","","Gregory M. Cockrell; Gang Zhang; Donald G. VanDerveer; Randolph P. Thummel; Robert D. Hancock","Enhanced Metal Ion Selectivity of 2,9-Di-(pyrid-2-yl)-1,10-phenanthroline and Its Use as a Fluorescent Sensor for Cadmium(II)","Journal of the American Chemical Society","2008","130","","1420","1430","10.1021/ja077141m","","","0.71073","MoKα","","0.0803","0.0652","","","0.1622","0.1791","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107351","15.715","0.003","11.425","0.002","27.309","0.006","90","","104.72","0.03","90","","4742.2","1.7","158","2","158","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14.5 Cl2 N4 O9 Pb -","- C22 H14.5 Cl2 N4 O9 Pb -","- C176 H116 Cl16 N32 O72 Pb8 -","8","2","","Gregory M. Cockrell; Gang Zhang; Donald G. VanDerveer; Randolph P. Thummel; Robert D. Hancock","Enhanced Metal Ion Selectivity of 2,9-Di-(pyrid-2-yl)-1,10-phenanthroline and Its Use as a Fluorescent Sensor for Cadmium(II)","Journal of the American Chemical Society","2008","130","","1420","1430","10.1021/ja077141m","","","0.71073","MoKα","","0.0597","0.0515","","","0.0985","0.1016","","","","","","1.208","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107352","14.541","0.003","18.514","0.004","19.462","0.004","74.96","0.03","88.13","0.03","68.18","0.03","4686","2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H63 Cl2 Fe N7 O11 -","- C42 H63 Cl2 Fe N7 O11 -","- C168 H252 Cl8 Fe4 N28 O44 -","4","2","","Maksym Seredyuk; Ana B. Gaspar; Vadim Ksenofontov; Yury Galyametdinov; Joachim Kusz; Philipp Gütlich","Does the Solid-Liquid Crystal Phase Transition Provoke the Spin-State Change in Spin-Crossover Metallomesogens?","Journal of the American Chemical Society","2008","130","","1431","1439","10.1021/ja077265z","","","0.71073","MoKα","","0.0907","0.047","","","0.1288","0.1454","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107353","18.713","0.005","19.072","0.005","14.697","0.005","90","0.005","111.175","0.005","90","0.005","4891","2","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H69 Cl2 Fe N7 O11 -","- C45 H69 Cl2 Fe N7 O11 -","- C180 H276 Cl8 Fe4 N28 O44 -","4","1","","Maksym Seredyuk; Ana B. Gaspar; Vadim Ksenofontov; Yury Galyametdinov; Joachim Kusz; Philipp Gütlich","Does the Solid-Liquid Crystal Phase Transition Provoke the Spin-State Change in Spin-Crossover Metallomesogens?","Journal of the American Chemical Society","2008","130","","1431","1439","10.1021/ja077265z","","","0.71073","MoKα","","0.1311","0.0483","","","0.102","0.122","","","","","","0.857","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107354","18.836","0.004","19.926","0.004","15.216","0.003","90","","108.56","0.03","90","","5414","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H69 Cl2 Fe N7 O11 -","- C45 H69 Cl2 Fe N7 O11 -","- C180 H276 Cl8 Fe4 N28 O44 -","4","1","","Maksym Seredyuk; Ana B. Gaspar; Vadim Ksenofontov; Yury Galyametdinov; Joachim Kusz; Philipp Gütlich","Does the Solid-Liquid Crystal Phase Transition Provoke the Spin-State Change in Spin-Crossover Metallomesogens?","Journal of the American Chemical Society","2008","130","","1431","1439","10.1021/ja077265z","","","0.71073","MoKα","","0.322","0.0902","","","0.2473","0.2926","","","","","","0.82","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107355","18.8707","0.0011","13.9159","0.0008","12.4345","0.0007","90","","95.581","0.003","90","","3249.9","0.3","130","2","130","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Eilaf002","Eilaf002","","- C50 H32 N2 -","- C50 H32 N2 -","- C200 H128 N8 -","4","0.5","","Eilaf Ahmed; Alejandro L. Briseno; Younan Xia; Samson A. Jenekhe","High Mobility Single-Crystal Field-Effect Transistors from Bisindoloquinoline Semiconductors","Journal of the American Chemical Society","2008","130","","1118","1119","10.1021/ja077444g","","","0.71073","MoKα","","0.1826","0.0579","","","0.1025","0.1311","","","","","","0.963","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107356","9.228","0.002","11.56","0.003","14.204","0.004","90","","90","","90","","1515.2","0.7","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C64 H76 N4 O12 -","4","1","","Masami Sakamoto; Mamoru Kato; Yoko Aida; Kazuyuki Fujita; Takashi Mino; Tsutomu Fujita","Photosensitized 2 + 2 Cycloaddition Reaction Using Homochirality Generated by Spontaneous Crystallization","Journal of the American Chemical Society","2008","130","","1132","1133","10.1021/ja077912m","","","1.54178","CuKα","","0.0462","0.0445","","","0.1157","0.1181","","","","","","1.073","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107357","9.914","0.002","13.46","0.003","14.925","0.004","90","","108.382","0.002","90","","1890","0.8","173","","173","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C80 H108 N4 O16 -","4","1","","Masami Sakamoto; Mamoru Kato; Yoko Aida; Kazuyuki Fujita; Takashi Mino; Tsutomu Fujita","Photosensitized 2 + 2 Cycloaddition Reaction Using Homochirality Generated by Spontaneous Crystallization","Journal of the American Chemical Society","2008","130","","1132","1133","10.1021/ja077912m","","","0.71073","MoKα","","0.0393","0.0369","","","0.106","0.1086","","","","","","0.967","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107358","14.1734","0.0017","14.2085","0.0017","19.193","0.002","90","","106.093","0.001","90","","3713.7","0.7","173","","173","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C160 H216 N8 O32 -","8","1","","Masami Sakamoto; Mamoru Kato; Yoko Aida; Kazuyuki Fujita; Takashi Mino; Tsutomu Fujita","Photosensitized 2 + 2 Cycloaddition Reaction Using Homochirality Generated by Spontaneous Crystallization","Journal of the American Chemical Society","2008","130","","1132","1133","10.1021/ja077912m","","","0.71073","MoKα","","0.055","0.0462","","","0.1265","0.1319","","","","","","1.013","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107359","35.42","0.02","14.532","0.008","29.733","0.017","90","","124.497","0.008","90","","12613","12","193","2","193","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C117 H188 F3 Fe N4 O11 S Si8 -","- C117 H188 F3 Fe N4 O11 S Si8 -","- C468 H752 F12 Fe4 N16 O44 S4 Si32 -","4","0.5","","Ming Fang; Scott R. Wilson; Kenneth S. Suslick","A Four-Coordinate Fe(III) Porphyrin Cation","Journal of the American Chemical Society","2008","130","","1134","1135","10.1021/ja078061l","","","0.71073","MoKα","","0.0896","0.0573","","","0.1486","0.1717","","","","","","1.025","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107360","37.028","0.002","29.3262","0.0019","29.3677","0.0018","90","","90","","90","","31890","3","193","2","193","2","","","","","","","","10","C m c 21","C 2c -2","36","","","","- C998.48 H1702.91 Ag2.48 B115.33 Br62.91 Cl8 Fe8 N32 O64 Si64 -","- C1000.49 H1706.93 Ag2.488 B115.368 Br62.928 Cl8 Fe8 N32 O64 Si64 -","- C1000.49 H1706.93 Ag2.488 B115.368 Br62.928 Cl8 Fe8 N32 O64 Si64 -","1","0.125","","Ming Fang; Scott R. Wilson; Kenneth S. Suslick","A Four-Coordinate Fe(III) Porphyrin Cation","Journal of the American Chemical Society","2008","130","","1134","1135","10.1021/ja078061l","","","0.71073","MoKα","","0.3398","0.0986","","","0.2398","0.2824","","","","","","1.289","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107361","23.048","0.003","24.649","0.003","17.081","0.003","90","","132.192","0.004","90","","7189.6","1.9","295","2","295","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","NTHU6","","","- C30 H43 Ga10 N4 O51 P9 -","- C4 Ga10 O48 P9 -","- C16 Ga40 O192 P36 -","4","0.5","","Ya-Ching Yang; Sue-Lein Wang","Intrinsic Yellow Light Phosphor: An Organic-Inorganic Hybrid Gallium Oxalatophosphate with Hexameric Octahedral Ga6(OH)4O26 Cluster","Journal of the American Chemical Society","2008","130","","1146","1147","10.1021/ja7101423","","","0.71073","MoKα","","0.1477","0.0788","","","0.2099","0.2493","","","","","","0.997","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107362","9.2186","0.0003","11.7478","0.0003","12.7738","0.0003","83.2188","0.0015","70.2479","0.0014","76.7223","0.0016","1265.95","0.06","160","1","160","1","","","","","","","","3","P 1","P 1","1","","","","- C65 H60 O5 -","- C65 H60 O5 -","- C65 H60 O5 -","1","1","","Tomoharu Hayama; Kim K. Baldridge; Yao-Ting Wu; Anthony Linden; Jay S. Siegel","Steric Isotope Effects Gauged by the Bowl-Inversion Barrier in Selectively Deuterated Pentaarylcorannulenes","Journal of the American Chemical Society","2008","130","","1583","1591","10.1021/ja073052y","","","0.71073","MoKα","","0.0652","0.0451","","","0.0999","0.1124","","","","","","1.067","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107363","23.176","0.001","13.167","0.0008","12.921","0.0008","90","","90.623","0.004","90","","3942.7","0.4","175","","175","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C100 H72 Mn2 N8 O6 P2 -","- C100 H72 Mn2 N8 O6 P2 -","- C200 H144 Mn4 N16 O12 P4 -","2","0.25","","Kevin Bernot; Javier Luzon; Roberta Sessoli; Alessandro Vindigni; Julien Thion; Sébastien Richeter; Dominique Leclercq; Joulia Larionova; Arie van der Lee","The Canted Antiferromagnetic Approach to Single-Chain Magnets","Journal of the American Chemical Society","2008","130","","1619","1627","10.1021/ja0751734","","","0.71073","MoKα","","0.0738","0.0352","","0.0571","0.0393","0.0393","","","","","","1.0814","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107364","5.6073","0.0005","18.281","0.0008","7.6481","0.0006","90","","106.229","0.0015","90","","752.75","0.1","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.0874","0.047","","0.0528","0.0507","0.0507","","","","","","1.1385","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107365","5.6275","0.0004","18.3713","0.0006","7.6644","0.0005","90","","106.207","0.0013","90","","760.89","0.08","190","","190","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.0892","0.0452","","0.0488","0.0472","0.0472","","","","","","1.1489","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107366","5.6455","0.0004","18.4798","0.0006","7.6562","0.0005","90","","106.3","0.0014","90","","766.65","0.08","250","","250","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.0822","0.0462","","0.0424","0.041","0.041","","","","","","1.2317","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107367","5.676","0.0004","18.6088","0.0006","7.6826","0.0005","90","","106.267","0.0012","90","","778.98","0.08","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.1351","0.0434","","0.0824","0.0449","0.0449","","","","","","1.1641","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107368","5.7087","0.0004","18.765","0.0007","7.6914","0.0005","90","","106.287","0.0013","90","","790.87","0.08","350","","350","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.1175","0.0551","","0.0592","0.0511","0.0511","","","","","","1.0677","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107369","10.8535","0.0005","5.5167","0.0004","13.9943","0.0005","90","","100.41","0.0012","90","","824.12","0.08","120","","120","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.098","0.0647","","0.0763","0.0733","0.0733","","","","","","1.1007","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107370","5.5993","0.0004","18.2465","0.0007","7.6646","0.0005","90","","106.362","0.0013","90","","751.36","0.08","120","","120","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 O2 -","- C9 H8 O2 -","- C36 H32 O8 -","4","1","","Mujeeb Khan; Gunther Brunklaus; Volker Enkelmann; Hans-Wolfgang Spiess","Transient States in [2 + 2] Photodimerization of Cinnamic Acid: Correlation of Solid-State NMR and X-ray Analysis","Journal of the American Chemical Society","2008","130","","1741","1748","10.1021/ja0773711","","","0.71073","MoKα","","0.0783","0.0461","","0.0563","0.0559","0.0559","","","","","","1.0903","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107371","19.447","0.004","16.846","0.003","18.629","0.004","90","","110.58","0.03","90","","5713","2","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C69 H49 Eu N2 O10 S2 -","- C69 H49 Eu N2 O10 S2 -","- C276 H196 Eu4 N8 O40 S8 -","4","1","","Xiao-Yan Chen; Xiaoping Yang; Bradley J. Holliday","Photoluminescent Europium-Containing Inner Sphere Conducting Metallopolymer","Journal of the American Chemical Society","2008","130","","1546","1547","10.1021/ja077626a","","","0.71073","MoKα","","0.1145","0.0487","","","0.1099","0.1401","","","","","","1.042","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107372","11.2456","0.0012","16.1839","0.0017","18.494","0.002","90","","99.2275","0.0015","90","","3322.3","0.6","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H48 B I N6 O Tm -","- C28 H48 B I N6 O Tm -","- C112 H192 B4 I4 N24 O4 Tm4 -","4","1","","Jianhua Cheng; Josef Takats; Michael J. Ferguson; Robert McDonald","Heteroleptic Tm(II) Complexes: One More Success for Trofimenko's Scorpionates","Journal of the American Chemical Society","2008","130","","1544","1545","10.1021/ja0776273","","","0.71073","MoKα","","0.0346","0.0292","","","0.073","0.0777","","","","","","1.059","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107373","16.787","0.002","18.042","0.002","26.963","0.004","90","","91.884","0.0018","90","","8161.9","1.8","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H66 B N6 Si2 Tm -","- C34 H66 B N6 Si2 Tm -","- C272 H528 B8 N48 Si16 Tm8 -","8","1","","Jianhua Cheng; Josef Takats; Michael J. Ferguson; Robert McDonald","Heteroleptic Tm(II) Complexes: One More Success for Trofimenko's Scorpionates","Journal of the American Chemical Society","2008","130","","1544","1545","10.1021/ja0776273","","","0.71073","MoKα","","0.0365","0.0303","","","0.0652","0.068","","","","","","1.162","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107374","14.9492","0.0009","12.2865","0.0007","20.639","0.0012","90","","97.402","0.001","90","","3759.2","0.4","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H58 B N7 Si2 Tm -","- C30 H58 B N7 Si2 Tm -","- C120 H232 B4 N28 Si8 Tm4 -","4","1","","Jianhua Cheng; Josef Takats; Michael J. Ferguson; Robert McDonald","Heteroleptic Tm(II) Complexes: One More Success for Trofimenko's Scorpionates","Journal of the American Chemical Society","2008","130","","1544","1545","10.1021/ja0776273","","","0.71073","MoKα","","0.0192","0.0169","","","0.0427","0.0441","","","","","","1.046","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107375","12.0407","0.0014","16.986","0.002","18.706","0.002","90","","90","","90","","3825.8","0.8","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H64 B2 N6 O Tm -","- C34 H64 B2 N6 O Tm -","- C136 H256 B8 N24 O4 Tm4 -","4","1","","Jianhua Cheng; Josef Takats; Michael J. Ferguson; Robert McDonald","Heteroleptic Tm(II) Complexes: One More Success for Trofimenko's Scorpionates","Journal of the American Chemical Society","2008","130","","1544","1545","10.1021/ja0776273","","","0.71073","MoKα","","0.0453","0.0351","","","0.0812","0.0878","","","","","","1.057","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107376","11.8157","0.0013","12.2451","0.0013","20.595","0.002","97.773","0.0018","96.1553","0.0017","99.5271","0.0018","2885.9","0.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H90 B2 N12 O Tm -","- C52 H90 B2 N12 O Tm -","- C104 H180 B4 N24 O2 Tm2 -","2","1","","Jianhua Cheng; Josef Takats; Michael J. Ferguson; Robert McDonald","Heteroleptic Tm(II) Complexes: One More Success for Trofimenko's Scorpionates","Journal of the American Chemical Society","2008","130","","1544","1545","10.1021/ja0776273","","","0.71073","MoKα","","0.0869","0.0537","","","0.1171","0.1337","","","","","","1.022","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107377","23.598","0.003","15.571","0.002","24.217","0.003","90","","91.4127","0.0018","90","","8895.7","1.9","193","2","193","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C82 H138 B2 N16 Tm2 -","- C76 H124 B2 N16 Tm2 -","- C304 H496 B8 N64 Tm8 -","4","1","","Jianhua Cheng; Josef Takats; Michael J. Ferguson; Robert McDonald","Heteroleptic Tm(II) Complexes: One More Success for Trofimenko's Scorpionates","Journal of the American Chemical Society","2008","130","","1544","1545","10.1021/ja0776273","","","0.71073","MoKα","","0.0657","0.0636","","","0.1586","0.1596","","","","","","1.17","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107378","6.9074","0.0014","7.8604","0.0011","9.561","0.0018","81.332","0.014","84.602","0.016","72.896","0.016","489.81","0.16","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H5 O5 Re -","- C9 H5 O5 Re -","- C18 H10 O10 Re2 -","2","1","","Liu, Yu; Spingler, Bernhard; Schmutz, Paul; Alberto, Roger","Metal-Mediated Retro Diels-Alder of Dicyclopentadiene Derivatives: A Convenient Synthesis of [(Cp-R)M(CO)3] (M = 99mTc, Re) Complexes","Journal of the American Chemical Society","2008","130","5","1554","1555","10.1021/ja077741l","","","0.7107","MoKα","","0.0191","0.0164","","","0.0382","0.0388","","","","","","1.071","","","","has coordinates","219213","2020-10-21","18:00:00",""
"4107379","9.9948","0.0011","11.9574","0.0012","12.8209","0.0013","98.31","0.012","99.288","0.012","103.772","0.012","1441.7","0.3","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 N O6 Re -","- C13 H12 N O6 Re -","- C52 H48 N4 O24 Re4 -","4","2","","Liu, Yu; Spingler, Bernhard; Schmutz, Paul; Alberto, Roger","Metal-Mediated Retro Diels-Alder of Dicyclopentadiene Derivatives: A Convenient Synthesis of [(Cp-R)M(CO)3] (M = 99mTc, Re) Complexes","Journal of the American Chemical Society","2008","130","5","1554","1555","10.1021/ja077741l","","","0.71073","MoKα","","0.0459","0.0362","","","0.1025","0.1067","","","","","","0.991","","","","has coordinates","219213","2020-10-21","18:00:00",""
"4107380","7.9757","0.0002","8.3191","0.0002","11.4545","0.0002","89.5244","0.0015","85.4836","0.0015","77.2782","0.0018","739.02","0.03","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H8 Cl6 O2 -","- C12 H8 Cl6 O2 -","- C24 H16 Cl12 O4 -","2","1","","Liu, Yu; Spingler, Bernhard; Schmutz, Paul; Alberto, Roger","Metal-Mediated Retro Diels-Alder of Dicyclopentadiene Derivatives: A Convenient Synthesis of [(Cp-R)M(CO)3] (M = 99mTc, Re) Complexes","Journal of the American Chemical Society","2008","130","5","1554","1555","10.1021/ja077741l","","","0.7107","MoKα","","0.0348","0.0269","","","0.0777","0.0817","","","","","","1.131","","","","has coordinates","219213","2020-10-21","18:00:00",""
"4107381","9.644","0.003","13.419","0.004","9.634","0.004","92","0.03","106.85","0.03","92.01","0.02","1191.2","0.7","298.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H18 B F5 N2 O4 -","- C28 H18 B F5 N2 O4 -","- C56 H36 B2 F10 N4 O8 -","2","1","","Keitaro Umezawa; Yuki Nakamura; Hiroshi Makino; Daniel Citterio; Koji Suzuki","Bright, Color-Tunable Fluorescent Dyes in the Visible-Near-Infrared Region","Journal of the American Chemical Society","2008","130","","1550","1551","10.1021/ja077756j","","","0.71073","MoKα","","","0.129","","","","0.436","","","","","","1.44","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107382","31.34","0.0007","31.34","0.0007","31.34","0.0007","90","","90","","90","","30782","1.2","100","2","100","2","","","","","","","","5","F m -3","-F 2 2 3","202","","","","- C6 H2.25 N0.75 Ni0.75 O3.9 -","- C6 H2.25 N0.75 Ni0.75 O3.9 -","- C384 H144 N48 Ni48 O249.6 -","64","0.666667","","Amy J. Cairns; Jason A. Perman; Lukasz Wojtas; Victor Ch. Kravtsov; Mohamed H. Alkordi; Mohamed Eddaoudi; Michael J. Zaworotko","Supermolecular Building Blocks (SBBs) and Crystal Design: 12-Connected Open Frameworks Based on a Molecular Cubohemioctahedron","Journal of the American Chemical Society","2008","130","","1560","1561","10.1021/ja078060t","","","0.71073","MoKα","","0.1575","0.1432","","","0.3462","0.3575","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107383","39.288","0.002","39.288","0.002","39.288","0.002","90","","90","","90","","60643","5","100","2","100","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C32.55 H13 Co1.5 N2 O23.3 -","- C32.55 H13 Co1.5 N2 O23.2933 -","- C781.2 H312 Co36 N48 O559.04 -","24","1","","Amy J. Cairns; Jason A. Perman; Lukasz Wojtas; Victor Ch. Kravtsov; Mohamed H. Alkordi; Mohamed Eddaoudi; Michael J. Zaworotko","Supermolecular Building Blocks (SBBs) and Crystal Design: 12-Connected Open Frameworks Based on a Molecular Cubohemioctahedron","Journal of the American Chemical Society","2008","130","","1560","1561","10.1021/ja078060t","","","0.71073","MoKα","","0.1627","0.1296","","","0.2902","0.3058","","","","","","1.18","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107384","9.3903","0.0006","36.41","0.002","16.0789","0.001","90","","91.323","0.001","90","","5495.9","0.6","243","2","243","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Quinazolinyl)MoP4H","","","- C20 H43 Mo N2 O0.5 P4 -","- C20 H43 Mo N2 O0.5 P4 -","- C160 H344 Mo8 N16 O4 P32 -","8","2","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.0572","0.0392","","","0.0817","0.0865","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107385","12.4605","0.0018","16.177","0.003","27.824","0.004","90","","90","","90","","5608.6","1.5","243","2","243","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H43 Mo N P4 -","- C21 H43 Mo N P4 -","- C168 H344 Mo8 N8 P32 -","8","1","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.1441","0.0607","","","0.1434","0.1744","","","","","","1.024","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107386","14.1285","0.0014","12.2475","0.0012","12.9005","0.0013","90","","94.425","0.002","90","","2225.6","0.4","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","iqmop3","","","- C18 H34 Mo N P3 -","- C18 H34 Mo N P3 -","- C72 H136 Mo4 N4 P12 -","4","1","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.0602","0.039","","","0.1498","0.1623","","","","","","1.063","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107387","17.804","0.005","15.736","0.005","30.893","0.01","90","","90","","90","","8655","5","243","2","243","2","","","","","","","","5","P b c n","-P 2n 2ab","60","qoxCMoP3","","","- C17 H33 Mo N2 P3 -","- C17 H33 Mo N2 P3 -","- C272 H528 Mo16 N32 P48 -","16","2","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.1943","0.0595","","","0.108","0.1409","","","","","","1.012","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107388","9.9124","0.001","28.104","0.003","9.9549","0.001","90","","105.144","0.002","90","","2676.9","0.5","243","2","243","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H42 Mo N2 P4 -","- C20 H42 Mo N2 P4 -","- C80 H168 Mo4 N8 P16 -","4","1","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.1068","0.09","","","0.2057","0.2118","","","","","","1.113","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107389","10.345","0.006","9.391","0.005","10.985","0.006","90","","95.973","0.008","90","","1061.4","1","243","2","243","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H34 Mo N P3 -","- C18 H34 Mo N P3 -","- C36 H68 Mo2 N2 P6 -","2","1","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.0904","0.0869","","","0.2401","0.2437","","","","","","1.095","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107390","17.9472","0.0012","13.4906","0.0009","18.049","0.0012","90","","97.63","0.002","90","","4331.3","0.5","243","2","243","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","qoxMoP3","","","- C17 H33 Mo N2 P3 -","- C17 H33 Mo N2 P3 -","- C136 H264 Mo8 N16 P24 -","8","2","","Guang Zhu; Keliang Pang; Gerard Parkin","New Modes for Coordination of Aromatic Heterocyclic Nitrogen Compounds to Molybdenum: Catalytic Hydrogenation of Quinoline, Isoquinoline, and Quinoxaline by Mo(PMe3)4H4","Journal of the American Chemical Society","2008","130","","1564","1565","10.1021/ja078102d","","","0.71073","MoKα","","0.0461","0.038","","","0.2099","0.2225","","","","","","1.169","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107391","5.9705","0.0018","12.7","0.004","15.989","0.005","111.141","0.005","100.421","0.005","94.74","0.005","1097.6","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H28 N2 O7 -","- C23 H28 N2 O7 -","- C46 H56 N4 O14 -","2","1","","Matthew B. Boxer; Matsujiro Akakura; Hisashi Yamamoto","Ketone Super Silyl Enol Ethers in Sequential Reactions: Diastereoselective Generation of Tertiary Carbinols in One Pot","Journal of the American Chemical Society","2008","130","","1580","1582","10.1021/ja7102586","","","0.71073","MoKα","","0.085","0.0762","","","0.2379","0.2418","","","","","","1.155","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107392","12.966","0.004","7.848","0.002","24.942","0.005","90","","114.475","0.012","90","","2310","1.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 N2 O7.25 -","- C25 H24 N2 O7.196 -","- C100 H96 N8 O28.784 -","4","1","","Matthew B. Boxer; Matsujiro Akakura; Hisashi Yamamoto","Ketone Super Silyl Enol Ethers in Sequential Reactions: Diastereoselective Generation of Tertiary Carbinols in One Pot","Journal of the American Chemical Society","2008","130","","1580","1582","10.1021/ja7102586","","","0.71073","MoKα","","0.0695","0.0527","","","0.1317","0.1397","","","","","","1.025","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107393","9.079","0.005","16.098","0.009","20.702","0.012","90","","90","","90","","3026","3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H21 F O2 -","- C18 H21 F O2 -","- C144 H168 F8 O16 -","8","1","","Matthew B. Boxer; Matsujiro Akakura; Hisashi Yamamoto","Ketone Super Silyl Enol Ethers in Sequential Reactions: Diastereoselective Generation of Tertiary Carbinols in One Pot","Journal of the American Chemical Society","2008","130","","1580","1582","10.1021/ja7102586","","","0.71073","MoKα","","0.1073","0.0665","","","0.1403","0.157","","","","","","1.038","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107394","27.91","0.01","13.839","0.006","44.93","0.02","90","","90","","90","","17354","12","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C64.4 H46 I6 N14.4 O2.8 Zn3 -","- C64.4 H46 I6 N14.4 O2.8 Zn3 -","- C515.2 H368 I48 N115.2 O22.4 Zn24 -","8","1","","Tsuyoshi Haneda; Masaki Kawano; Takehide Kawamichi; Makoto Fujita","Direct Observation of the Labile Imine Formation through Single-Crystal-to-Single-Crystal Reactions in the Pores of a Porous Coordination Network","Journal of the American Chemical Society","2008","130","","1578","1579","10.1021/ja7111564","","","0.71073","MoKα","","0.1333","0.0747","","","0.2234","0.2689","","","","","","1.064","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107395","28.4","0.01","13.872","0.006","44.18","0.02","90","","90","","90","","17405","13","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C64.2 H47 I6 N13 O0.7 Zn3 -","- C64.2 H47 I6 N13 O0.7 Zn3 -","- C513.6 H376 I48 N104 O5.6 Zn24 -","8","1","","Tsuyoshi Haneda; Masaki Kawano; Takehide Kawamichi; Makoto Fujita","Direct Observation of the Labile Imine Formation through Single-Crystal-to-Single-Crystal Reactions in the Pores of a Porous Coordination Network","Journal of the American Chemical Society","2008","130","","1578","1579","10.1021/ja7111564","","","0.71073","MoKα","","0.0915","0.0573","","","0.1679","0.1896","","","","","","1.11","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107396","28.14","0.01","14.022","0.005","44.48","0.02","90","","90","","90","","17551","12","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C57.2 H42.2 I6 N13 O Zn3 -","- C57.2 H42.2 I6 N13 O Zn3 -","- C457.6 H337.6 I48 N104 O8 Zn24 -","8","1","","Tsuyoshi Haneda; Masaki Kawano; Takehide Kawamichi; Makoto Fujita","Direct Observation of the Labile Imine Formation through Single-Crystal-to-Single-Crystal Reactions in the Pores of a Porous Coordination Network","Journal of the American Chemical Society","2008","130","","1578","1579","10.1021/ja7111564","","","0.71073","MoKα","","0.1724","0.0895","","","0.2529","0.3058","","","","","","1.08","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107397","28.28","0.003","14.012","0.002","44.907","0.005","90","","90","","90","","17795","4","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C66 H48 I6 N13 O2.5 Zn3 -","- C66 H48 I6 N13 O2.5 Zn3 -","- C528 H384 I48 N104 O20 Zn24 -","8","1","","Tsuyoshi Haneda; Masaki Kawano; Takehide Kawamichi; Makoto Fujita","Direct Observation of the Labile Imine Formation through Single-Crystal-to-Single-Crystal Reactions in the Pores of a Porous Coordination Network","Journal of the American Chemical Society","2008","130","","1578","1579","10.1021/ja7111564","","","0.71073","MoKα","","0.1151","0.0691","","","0.2101","0.2398","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107398","23.1","0.02","12.32","0.01","12.78","0.01","90","","92.03","0.01","90","","3635","5","299","","","","","","","","","","Local laboratory","5","I 1 2/a 1","-I 2ya","15","","","","- C36 H36 N2 O7 Pd -","- C36 H36 N2 O7 Pd -","- C144 H144 N8 O28 Pd4 -","4","0.5","","Raivis Zalubovskis; Alexis Bouet; Ester Fjellander; Samuel Constant; David Linder; Andreas Fischer; Jérôme Lacour; Timofei Privalov; Christina Moberg","Self-Adaptable Catalysts: Substrate-Dependent Ligand Configuration","Journal of the American Chemical Society","2008","130","","1845","1855","10.1021/ja074044k","","","0.71073","MoKα","","0.1368","0.0755","","","0.1632","0.1939","","","","","","1.101","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107399","8.36","0.0014","12.466","0.005","30.729","0.012","90","","90","","90","","3202.4","1.9","299","","","","","","","","","","Local laboratory","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H30 N2 O3 Pd -","- C34 H30 N2 O3 Pd -","- C136 H120 N8 O12 Pd4 -","4","1","","Raivis Zalubovskis; Alexis Bouet; Ester Fjellander; Samuel Constant; David Linder; Andreas Fischer; Jérôme Lacour; Timofei Privalov; Christina Moberg","Self-Adaptable Catalysts: Substrate-Dependent Ligand Configuration","Journal of the American Chemical Society","2008","130","","1845","1855","10.1021/ja074044k","","","0.71073","MoKα","","0.1761","0.1225","","","0.2677","0.2966","","","","","","1.18","","","","has coordinates","178819","2020-10-21","18:00:00",""
"4107400","27.1559","0.0012","15.5424","0.0007","21.7182","0.0016","90","","123.467","0.002","90","","7646.8","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","DL226","","","- H66 Na7 O92 Sb W18 -","- Na7 O91.56 Sb W18 -","- Na28 O366.24 Sb4 W72 -","4","0.5","","De-Liang Long; Carsten Streb; Yu-Fei Song; Scott Mitchell; Leroy Cronin","Unravelling the Complexities of Polyoxometalates in Solution Using Mass Spectrometry: Protonation versus Heteroatom Inclusion","Journal of the American Chemical Society","2008","130","","1830","1832","10.1021/ja075940z","","","0.71073","MoKα","","0.0517","0.0362","","","0.0822","0.088","","","","","","1.079","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107401","31.239","0.003","15.9238","0.0017","33.43","0.004","90","","102.469","0.002","90","","16237","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C102 H230 N9 O62 P W18 -","- C91.8 H172.1 N8.5 O62 P W18 -","- C367.2 H688.4 N34 O248 P4 W72 -","4","1","","De-Liang Long; Carsten Streb; Yu-Fei Song; Scott Mitchell; Leroy Cronin","Unravelling the Complexities of Polyoxometalates in Solution Using Mass Spectrometry: Protonation versus Heteroatom Inclusion","Journal of the American Chemical Society","2008","130","","1830","1832","10.1021/ja075940z","","","0.71073","MoKα","","0.0735","0.0444","","","0.0968","0.1106","","","","","","1.053","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107402","26.78","0.004","15.516","0.002","19.956","0.003","90","","90","","90","","8292","2","100","2","100","2","","","","","","","","6","P m n 21","P 2ac -2","31","","","","- C102 H225 N9 O62 P2 W18 -","- C90.2 H124.4 N9 O62 P2 W18 -","- C180.4 H248.8 N18 O124 P4 W36 -","2","0.5","","De-Liang Long; Carsten Streb; Yu-Fei Song; Scott Mitchell; Leroy Cronin","Unravelling the Complexities of Polyoxometalates in Solution Using Mass Spectrometry: Protonation versus Heteroatom Inclusion","Journal of the American Chemical Society","2008","130","","1830","1832","10.1021/ja075940z","","","0.71073","MoKα","","0.0524","0.0416","","","0.1054","0.1143","","","","","","1.06","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107403","12.655","0.003","10.451","0.003","13.937","0.003","90","","95.035","0.005","90","","1836.2","0.8","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H32 Br4 N4 Na O12 -","- C32 H32 Br4 N4 Na O12 -","- C64 H64 Br8 N8 Na2 O24 -","2","1","","Sergiy V. Rosokha; Marshall D. Newton; Almaz S. Jalilov; Jay K. Kochi","The Spectral Elucidation versus the X-ray Structure of the Critical Precursor Complex in Bimolecular Electron Transfers: Application of Experimental/Theoretical Solvent Probes to Ion-Radical (Redox) Dyads","Journal of the American Chemical Society","2008","130","","1944","1952","10.1021/ja076591b","","","0.71073","MoKα","","0.1198","0.0641","","","0.1206","0.144","","","","","","0.984","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107404","16.395","0.008","6.057","0.002","18.058","0.009","90","","90","","90","","1793.2","1.4","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 Br2 N2 O2 -","- C8 Br2 N2 O2 -","- C64 Br16 N16 O16 -","8","1","","Sergiy V. Rosokha; Marshall D. Newton; Almaz S. Jalilov; Jay K. Kochi","The Spectral Elucidation versus the X-ray Structure of the Critical Precursor Complex in Bimolecular Electron Transfers: Application of Experimental/Theoretical Solvent Probes to Ion-Radical (Redox) Dyads","Journal of the American Chemical Society","2008","130","","1944","1952","10.1021/ja076591b","","","0.71073","MoKα","","0.1399","0.053","","","0.0638","0.0809","","","","","","0.953","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107405","11.429","0.002","16.066","0.003","16.214","0.003","90","","106.861","0.003","90","","2849.2","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 Br2 N2 Na O10 -","- C24 H32 Br2 N2 Na O10 -","- C96 H128 Br8 N8 Na4 O40 -","4","0.5","","Sergiy V. Rosokha; Marshall D. Newton; Almaz S. Jalilov; Jay K. Kochi","The Spectral Elucidation versus the X-ray Structure of the Critical Precursor Complex in Bimolecular Electron Transfers: Application of Experimental/Theoretical Solvent Probes to Ion-Radical (Redox) Dyads","Journal of the American Chemical Society","2008","130","","1944","1952","10.1021/ja076591b","","","0.71073","MoKα","","0.1041","0.0551","","","0.1443","0.173","","","","","","1.046","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107406","19.495","0.004","6.6031","0.0013","13.671","0.003","90","","100.01","0.03","90","","1733","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 Cl N O2 -","- C20 H22 Cl N O2 -","- C80 H88 Cl4 N4 O8 -","4","1","","Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood","Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile","Journal of the American Chemical Society","2008","130","","2087","2100","10.1021/ja076663z","","","0.71073","MoKα","","0.159","0.0773","","","0.1809","0.2199","","","","","","1.103","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107407","6.6274","0.0013","8.4935","0.0017","30.477","0.006","90","","92.37","0.03","90","","1714.1","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O3 S2 -","- C19 H19 N O3 S2 -","- C76 H76 N4 O12 S8 -","4","1","","Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood","Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile","Journal of the American Chemical Society","2008","130","","2087","2100","10.1021/ja076663z","","","0.71073","MoKα","","0.132","0.087","","","0.2031","0.2233","","","","","","1.096","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107408","7.3072","0.0015","9.769","0.002","11.803","0.002","82.88","0.03","84.75","0.03","84.9","0.03","830","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H19 N O2 S2 -","- C19 H19 N O2 S2 -","- C38 H38 N2 O4 S4 -","2","1","","Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood","Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile","Journal of the American Chemical Society","2008","130","","2087","2100","10.1021/ja076663z","","","0.71073","MoKα","","0.0515","0.0387","","","0.1257","0.1347","","","","","","1.006","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107409","12.042","0.002","7.0724","0.0014","25.747","0.005","90","","90.04","0.03","90","","2192.8","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 Cl3 D2 N O3 -","- C20 H22 Cl N O3 -","- C80 H88 Cl4 N4 O12 -","4","1","","Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood","Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile","Journal of the American Chemical Society","2008","130","","2087","2100","10.1021/ja076663z","","","0.71073","MoKα","","0.0824","0.0533","","","0.1409","0.1504","","","","","","1.009","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107410","10.625","0.002","11.705","0.002","12.203","0.002","80.13","0.03","68.04","0.03","84.11","0.03","1385.5","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H26 Cl7 D2 N O4 -","- C22 H28 Cl7 N O4 -","- C44 H56 Cl14 N2 O8 -","2","1","","Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood","Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile","Journal of the American Chemical Society","2008","130","","2087","2100","10.1021/ja076663z","","","0.71073","MoKα","","0.0712","0.0467","","","0.1356","0.1517","","","","","","1.002","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107411","8.3743","0.0017","13.782","0.003","16.23","0.003","75.13","0.03","76.11","0.03","86.95","0.03","1757.4","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H22 Cl N O2 -","- C20 H22 Cl N O2 -","- C80 H88 Cl4 N4 O8 -","4","2","","Sarah E. Reisman; Joseph M. Ready; Matthew M. Weiss; Atsushi Hasuoka; Makoto Hirata; Kazuhiko Tamaki; Timo V. Ovaska; Catherine J. Smith; John L. Wood","Evolution of a Synthetic Strategy: Total Synthesis of (\±)-Welwitindolinone A Isonitrile","Journal of the American Chemical Society","2008","130","","2087","2100","10.1021/ja076663z","","","0.71073","MoKα","","0.1538","0.0606","","","0.1075","0.1286","","","","","","1.008","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107412","17.803","0.003","14.124","0.002","24.465","0.004","90","","104.57","0.003","90","","5953.9","1.6","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H82 Cl2 N4 O4 U2 -","- C58 H82 Cl2 N4 O4 U2 -","- C232 H328 Cl8 N16 O16 U8 -","4","1","","Trevor W. Hayton; Guang Wu","Synthesis, Characterization, and Reactivity of a Uranyl β-Diketiminate Complex","Journal of the American Chemical Society","2008","130","","2005","2014","10.1021/ja077538q","","","0.71073","MoKα","","0.1216","0.0526","","","0.1107","0.1473","","","","","","0.884","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107413","17.775","0.004","12.932","0.003","19.438","0.005","90","","112.366","0.004","90","","4132","1.7","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H61 Cl2 Li N2 O4 U -","- C37 H41 Cl2 Li N2 O4 U -","- C148 H164 Cl8 Li4 N8 O16 U4 -","4","1","","Trevor W. Hayton; Guang Wu","Synthesis, Characterization, and Reactivity of a Uranyl β-Diketiminate Complex","Journal of the American Chemical Society","2008","130","","2005","2014","10.1021/ja077538q","","","0.71073","MoKα","","0.1135","0.054","","","0.1249","0.1475","","","","","","0.916","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107414","23.37","0.003","9.6101","0.0012","25.184","0.003","90","","115.539","0.003","90","","5103.4","1.1","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H69 Cl N2 O3 P U -","- C53 H69 Cl N2 O3 P U -","- C212 H276 Cl4 N8 O12 P4 U4 -","4","1","","Trevor W. Hayton; Guang Wu","Synthesis, Characterization, and Reactivity of a Uranyl β-Diketiminate Complex","Journal of the American Chemical Society","2008","130","","2005","2014","10.1021/ja077538q","","","0.71073","MoKα","","0.1763","0.0824","","","0.1663","0.2121","","","","","","0.995","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107415","33.114","0.005","20.457","0.003","20.698","0.003","90","","90","","90","","14021","4","150","2","150","2","","","","","","","","8","P b c n","-P 2n 2ab","60","","","","- C75 H93 F3 N2 O7 P2 S U -","- C69 H63 F3 N2 O7 P2 S U -","- C552 H504 F24 N16 O56 P16 S8 U8 -","8","1","","Trevor W. Hayton; Guang Wu","Synthesis, Characterization, and Reactivity of a Uranyl β-Diketiminate Complex","Journal of the American Chemical Society","2008","130","","2005","2014","10.1021/ja077538q","","","0.71073","MoKα","","0.1521","0.0586","","","0.132","0.148","","","","","","0.891","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107416","13.076","0.002","13.66","0.002","17.378","0.003","100.768","0.002","107.258","0.002","90.241","0.002","2906.2","0.8","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C59.5 H71 F3 N2 O7 P2 S U -","- C59.5 H70.5 F3 N2 O7 P2 S U -","- C119 H141 F6 N4 O14 P4 S2 U2 -","2","1","","Trevor W. Hayton; Guang Wu","Synthesis, Characterization, and Reactivity of a Uranyl β-Diketiminate Complex","Journal of the American Chemical Society","2008","130","","2005","2014","10.1021/ja077538q","","","0.71073","MoKα","","0.0847","0.0552","","","0.1202","0.1347","","","","","","0.936","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107417","20.737","0.004","10.882","0.002","14.34","0.003","109.824","0.003","106.438","0.003","90.834","0.003","2897.8","1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C58.5 H71 N2 O4 P2 U -","- C58.5 H71 N2 O4 P2 U -","- C117 H142 N4 O8 P4 U2 -","2","1","","Trevor W. Hayton; Guang Wu","Synthesis, Characterization, and Reactivity of a Uranyl β-Diketiminate Complex","Journal of the American Chemical Society","2008","130","","2005","2014","10.1021/ja077538q","","","0.71073","MoKα","","0.0756","0.0472","","","0.1113","0.1169","","","","","","0.922","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107418","10.5501","0.0004","32.0848","0.0016","12.7865","0.0006","90","","104.112","0.004","90","","4197.6","0.3","130","2","130","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(TPP)GaOTf","","","- C52 H36 F3 Ga N4 O3 S -","- C52 H36 F3 Ga N4 O3 S -","- C208 H144 F12 Ga4 N16 O12 S4 -","4","1","","Antonio G. DiPasquale; James M. Mayer","Hydrogen Peroxide: A Poor Ligand to Gallium Tetraphenylporphyrin","Journal of the American Chemical Society","2008","130","","1812","1813","10.1021/ja077598w","","","0.71073","MoKα","","0.2125","0.0561","","","0.0921","0.1297","","","","","","0.855","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107419","10.2941","0.0003","8.0385","0.0003","21.5792","0.0007","90","","98.2436","0.0019","90","","1767.21","0.1","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(TPP)GaOH2","","","- C44 H32 Cl Ga N4 O6 -","- C44 H32 Cl Ga N4 O6.02 -","- C88 H64 Cl2 Ga2 N8 O12.04 -","2","0.5","","Antonio G. DiPasquale; James M. Mayer","Hydrogen Peroxide: A Poor Ligand to Gallium Tetraphenylporphyrin","Journal of the American Chemical Society","2008","130","","1812","1813","10.1021/ja077598w","","","0.71073","MoKα","","0.114","0.0595","","","0.1486","0.1709","","","","","","0.993","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107420","13.344","0.005","13.344","0.005","9.651","0.004","90","","90","","90","","1718.5","1.2","130","2","130","2","","","","","","","","5","I 4/m","-I 4","87","(TPP)GaOH","(TPP)GaOH","","- C44 H29 Ga N4 O -","- C44 H29.04 Ga N4 O -","- C88 H58.08 Ga2 N8 O2 -","2","0.125","","Antonio G. DiPasquale; James M. Mayer","Hydrogen Peroxide: A Poor Ligand to Gallium Tetraphenylporphyrin","Journal of the American Chemical Society","2008","130","","1812","1813","10.1021/ja077598w","","","0.71069","MoKα","","0.0854","0.0638","","","0.1389","0.1467","","","","","","1.134","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107421","13.536","0.002","13.536","0.002","9.6581","0.0017","90","","90","","90","","1769.6","0.5","130","2","130","2","","","","","","","","4","I 4/m","-I 4","87","(TPP)GaCH3","","","- C45 H31 Ga N4 -","- C45 H31.12 Ga N4 -","- C90 H62.24 Ga2 N8 -","2","0.125","","Antonio G. DiPasquale; James M. Mayer","Hydrogen Peroxide: A Poor Ligand to Gallium Tetraphenylporphyrin","Journal of the American Chemical Society","2008","130","","1812","1813","10.1021/ja077598w","","","0.71073","MoKα","","0.1143","0.0619","","","0.128","0.1458","","","","","","1.001","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107422","13.7287","0.0005","14.0318","0.0006","15.9173","0.0005","90","","113.86","0.002","90","","2804.23","0.19","100","","100","","","","","","","","toluene","3","P 1 21/n 1","-P 2yn","14","","tetraphenyl-cyclobutadiene-pentamethyl-cyclopentadienyl-iron","","- C38 H35 Fe -","- C38 H35 Fe -","- C152 H140 Fe4 -","4","1","","Alois Fürstner; Keisuke Majima; Rubén Martín; Helga Krause; Egmont Kattnig; Richard Goddard; Christian W. Lehmann","A Cheap Metal for a ""Noble"" Task: Preparative and Mechanistic Aspects of Cycloisomerization and Cycloaddition Reactions Catalyzed by Low-Valent Iron Complexes","Journal of the American Chemical Society","2008","130","","1992","2004","10.1021/ja0777180","","","0.71073","MoKα","","0.1127","0.0562","","","0.1026","0.123","","","","","","1.008","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107423","8.103","0.0002","9.4613","0.0002","11.1671","0.0002","94.945","0.001","98.755","0.001","107.135","0.001","800.77","0.03","100","","100","","","","","","","","tetrahydrofuran","5","P -1","-P 1","2","","tetramethyl-ethylenediamine-lithium-bis-ethylene-cyclopentadienyl-iron","","- C15 H29 Fe Li N2 -","- C15 H29 Fe Li N2 -","- C30 H58 Fe2 Li2 N4 -","2","1","","Alois Fürstner; Keisuke Majima; Rubén Martín; Helga Krause; Egmont Kattnig; Richard Goddard; Christian W. Lehmann","A Cheap Metal for a ""Noble"" Task: Preparative and Mechanistic Aspects of Cycloisomerization and Cycloaddition Reactions Catalyzed by Low-Valent Iron Complexes","Journal of the American Chemical Society","2008","130","","1992","2004","10.1021/ja0777180","","","0.71073","MoKα","","0.0401","0.0356","","","0.0897","0.0927","","","","","","1.057","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107424","18.9769","0.0003","24.381","0.0003","15.8073","0.0002","90","","118.19","","90","","6446.15","0.15","100","","100","","","","","","","","toluene","5","C 1 c 1","C -2yc","9","","dimethyloxyethylene-lithium-cyclooctadiene-cyclopentadienyl-ferrate","","- C17 H27 Fe Li O2 -","- C17 H27 Fe Li O2 -","- C272 H432 Fe16 Li16 O32 -","16","4","","Alois Fürstner; Keisuke Majima; Rubén Martín; Helga Krause; Egmont Kattnig; Richard Goddard; Christian W. Lehmann","A Cheap Metal for a ""Noble"" Task: Preparative and Mechanistic Aspects of Cycloisomerization and Cycloaddition Reactions Catalyzed by Low-Valent Iron Complexes","Journal of the American Chemical Society","2008","130","","1992","2004","10.1021/ja0777180","","","0.71073","MoKα","","0.0545","0.0431","","","0.1086","0.1158","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107425","8.3738","0.0002","12.9293","0.0002","18.653","0.0004","90","","96.274","0.001","90","","2007.42","0.07","100","","100","","","","","","","","toluene","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H27 N O2 S -","- C24 H27 N O2 S -","- C96 H108 N4 O8 S4 -","4","1","","Alois Fürstner; Keisuke Majima; Rubén Martín; Helga Krause; Egmont Kattnig; Richard Goddard; Christian W. Lehmann","A Cheap Metal for a ""Noble"" Task: Preparative and Mechanistic Aspects of Cycloisomerization and Cycloaddition Reactions Catalyzed by Low-Valent Iron Complexes","Journal of the American Chemical Society","2008","130","","1992","2004","10.1021/ja0777180","","","0.71073","MoKα","","0.0757","0.0461","","","0.122","0.1514","","","","","","1.113","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107426","44.358","0.008","44.358","0.008","44.358","0.008","90","","90","","90","","87280","3","100","2","100","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C4.5 H1.5 Cu N2.16667 O6.571667 -","- C4.5 H1.5 Cu N2.16667 O6.57167 -","- C864 H288 Cu192 N416 O1261.76 -","192","1","","Farid Nouar; Jarrod F. Eubank; Till Bousquet; Lukasz Wojtas; Michael J. Zaworotko; Mohamed Eddaoudi","Supermolecular Building Blocks (SBBs) for the Design and Synthesis of Highly Porous Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","1833","1835","10.1021/ja710123s","","","0.71073","MoKα","","0.1085","0.0787","","","0.1781","0.1933","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107427","8.41004","0.00015","10.48964","0.00019","9.3145","0.00017","90","","107.815","0.0008","90","","782.31","0.02","296.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H20 Br N O3 -","- C15 H20 Br N O3 -","- C30 H40 Br2 N2 O6 -","2","1","","Yushi Futamura; Ryuichi Sawa; Yoji Umezawa; Masayuki Igarashi; Hikaru Nakamura; Kimiko Hasegawa; Mikio Yamasaki; Etsu Tashiro; Yoshikazu Takahashi; Yuzuru Akamatsu; Masaya Imoto","Discovery of Incednine as a Potent Modulator of the Anti-apoptotic Function of Bcl-xL from Microbial Origin","Journal of the American Chemical Society","2008","130","","1822","1823","10.1021/ja710124p","","","1.54187","CuKα","","","0.0362","","","","0.1076","","","","","","1.205","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107428","17.467","0.008","19.302","0.009","20.928","0.009","90","","90.49","0.02","90","","7056","6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C69 H70 N8 O12 -","- C69 H70 N8 O12 -","- C276 H280 N32 O48 -","4","1","","Mónica Alvarez-Pérez; Stephen M. Goldup; David A. Leigh; Alexandra M. Z. Slawin","A Chemically-Driven Molecular Information Ratchet","Journal of the American Chemical Society","2008","130","","1836","1838","10.1021/ja7102394","","","1.54178","CuKα","","0.1905","0.1633","","","0.4264","0.4514","","","","","","1.61","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107429","28.02","0.0012","10.6337","0.0003","10.9221","0.0004","90","","100.33","0.003","90","","3201.6","0.2","110.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H28 N6 -","- C42 H28 N6 -","- C168 H112 N24 -","4","0.5","","Fu She Han; Masayoshi Higuchi; Dirk G. Kurth","Metallosupramolecular Polyelectrolytes Self-Assembled from Various Pyridine Ring-Substituted Bisterpyridines and Metal Ions: Photophysical, Electrochemical, and Electrochromic Properties","Journal of the American Chemical Society","2008","130","","2073","2081","10.1021/ja710380a","","","1.54187","CuKα","","","0.0445","","","","0.1404","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107430","7.775","0.0008","5.3753","0.0006","12.1491","0.0013","90","","102.836","0.002","90","","495.06","0.09","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C7 H15 N3 O5 -","- C7 H15 N3 O5 -","- C14 H30 N6 O10 -","2","1","","Manish A. Mehta; Matthew T. Eddy; Seth A. McNeill; Frank D. Mills; Joanna R. Long","Determination of Peptide Backbone Torsion Angles Using Double-Quantum Dipolar Recoupling Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2008","130","","2202","2212","10.1021/ja074244w","","","0.71073","MoKα","","0.0265","0.0262","","","0.0731","0.0735","","","","","","1.079","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107431","16.2291","0.0004","9.3934","0.0002","16.6087","0.0004","90","","99.51","0.001","90","","2497.14","0.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H31 Cl2 N O Ru S -","- C25 H31 Cl2 N O Ru S -","- C100 H124 Cl8 N4 O4 Ru4 S4 -","4","1","","Georgios C. Vougioukalakis; Robert H. Grubbs","Synthesis and Activity of Ruthenium Olefin Metathesis Catalysts Coordinated with Thiazol-2-ylidene Ligands","Journal of the American Chemical Society","2008","130","","2234","2245","10.1021/ja075849v","","","0.71073","MoKα","","0.0486","0.0334","","","0.0666","0.069","","","","","","1.261","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107432","12.5506","0.0004","15.6147","0.0004","14.3088","0.0004","90","","109.005","0.001","90","","2651.3","0.13","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H32 Cl2 N O Ru S -","- C27 H32 Cl2 N O Ru S -","- C108 H128 Cl8 N4 O4 Ru4 S4 -","4","1","","Georgios C. Vougioukalakis; Robert H. Grubbs","Synthesis and Activity of Ruthenium Olefin Metathesis Catalysts Coordinated with Thiazol-2-ylidene Ligands","Journal of the American Chemical Society","2008","130","","2234","2245","10.1021/ja075849v","","","0.71073","MoKα","","0.0563","0.035","","","0.0674","0.0706","","","","","","1.217","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107433","9.7492","0.0003","11.2812","0.0004","20.1232","0.0006","90","","90","","90","","2213.2","0.12","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C22 H25 Cl2 N O Ru S -","- C22 H25 Cl2 N O Ru S -","- C88 H100 Cl8 N4 O4 Ru4 S4 -","4","1","","Georgios C. Vougioukalakis; Robert H. Grubbs","Synthesis and Activity of Ruthenium Olefin Metathesis Catalysts Coordinated with Thiazol-2-ylidene Ligands","Journal of the American Chemical Society","2008","130","","2234","2245","10.1021/ja075849v","","","0.71073","MoKα","","0.0668","0.0426","","","0.0669","0.0707","","","","","","1.079","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107434","8.6637","0.0003","23.158","0.0007","10.7183","0.0003","90","","99.631","0.001","90","","2120.15","0.11","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H23 Cl2 N O Ru S -","- C21 H23 Cl2 N O Ru S -","- C84 H92 Cl8 N4 O4 Ru4 S4 -","4","1","","Georgios C. Vougioukalakis; Robert H. Grubbs","Synthesis and Activity of Ruthenium Olefin Metathesis Catalysts Coordinated with Thiazol-2-ylidene Ligands","Journal of the American Chemical Society","2008","130","","2234","2245","10.1021/ja075849v","","","0.71073","MoKα","","0.0685","0.0432","","","0.0799","0.0836","","","","","","1.278","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107435","12.299","0.002","16.117","0.003","16.873","0.003","97.363","0.003","101.48","0.003","112.119","0.002","2959.5","0.9","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C62.5 H76 N2 Si2 Ti2 -","- C62.5 H76 N2 Si2 Ti2 -","- C125 H152 N4 Si4 Ti4 -","2","1","","Neng Guo; Charlotte L. Stern; Tobin J. Marks","Bimetallic Effects in Homopolymerization of Styrene and Copolymerization of Ethylene and Styrenic Comonomers: Scope, Kinetics, and Mechanism","Journal of the American Chemical Society","2008","130","","2246","2261","10.1021/ja076407m","","","0.71073","MoKα","","0.0746","0.0655","","","0.1894","0.2005","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107436","18.9363","0.0001","19.191","0.0002","14.5019","0.0002","90","","102.587","0.0004","90","","5143.43","0.09","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H84 N2 O4 Zr -","- C51 H84 N2 O4 Zr -","- C204 H336 N8 O16 Zr4 -","4","1","","Shimrit Gendler; Ayellet L. Zelikoff; Jacob Kopilov; Israel Goldberg; Moshe Kol","Titanium and Zirconium Complexes of Robust Salophan Ligands. Coordination Chemistry and Olefin Polymerization Catalysis","Journal of the American Chemical Society","2008","130","","2144","2145","10.1021/ja077998j","","","0.71073","MoKα","","0.0559","0.042","","","0.1055","0.1145","","","","","","1.031","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107437","10.8402","0.0002","29.5584","0.0005","15.483","0.0003","90","","100.674","0.0008","90","","4875.2","0.15","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H70 Cl2 N2 O4 Zr -","- C46 H70 Cl2 N2 O4 Zr -","- C184 H280 Cl8 N8 O16 Zr4 -","4","1","","Shimrit Gendler; Ayellet L. Zelikoff; Jacob Kopilov; Israel Goldberg; Moshe Kol","Titanium and Zirconium Complexes of Robust Salophan Ligands. Coordination Chemistry and Olefin Polymerization Catalysis","Journal of the American Chemical Society","2008","130","","2144","2145","10.1021/ja077998j","","","0.71073","MoKα","","0.0922","0.0565","","","0.1389","0.1577","","","","","","1.047","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107438","15.798","0.005","15.555","0.005","28.662","0.005","90","","104.676","0.005","90","","6814","3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H86 N O19 V6 -","- C58 H84 N O19 V6 -","- C232 H336 N4 O76 V24 -","4","1","","Christophe Aronica; Guillaume Chastanet; Ekaterina Zueva; Serguei A. Borshch; Juan M. Clemente-Juan; Dominique Luneau","A Mixed-Valence Polyoxovanadate(III,IV) Cluster with a Calixarene Cap Exhibiting Ferromagnetic V(III)-V(IV) Interactions","Journal of the American Chemical Society","2008","130","","2365","2371","10.1021/ja078030q","","","0.71069","MoKα","","0.1596","0.0575","","0.1208","0.0664","0.0664","","","","","","1.143","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107439","28.815","0.005","15.726","0.005","15.904","0.005","90","","104.809","0.005","90","","6967","3","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C61 H100 N O19 V6 -","- C61 H99 N O19 V6 -","- C244 H396 N4 O76 V24 -","4","0.5","","Christophe Aronica; Guillaume Chastanet; Ekaterina Zueva; Serguei A. Borshch; Juan M. Clemente-Juan; Dominique Luneau","A Mixed-Valence Polyoxovanadate(III,IV) Cluster with a Calixarene Cap Exhibiting Ferromagnetic V(III)-V(IV) Interactions","Journal of the American Chemical Society","2008","130","","2365","2371","10.1021/ja078030q","","","0.71069","MoKα","","0.1385","0.055","","0.1016","0.0647","0.0647","","","","","","1.2611","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107440","28.805","0.005","15.638","0.005","15.833","0.005","90","","104.546","0.005","90","","6903","3","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C59 H96 N O19 V6 -","- C59 H95 N O19 V6 -","- C236 H380 N4 O76 V24 -","4","0.5","","Christophe Aronica; Guillaume Chastanet; Ekaterina Zueva; Serguei A. Borshch; Juan M. Clemente-Juan; Dominique Luneau","A Mixed-Valence Polyoxovanadate(III,IV) Cluster with a Calixarene Cap Exhibiting Ferromagnetic V(III)-V(IV) Interactions","Journal of the American Chemical Society","2008","130","","2365","2371","10.1021/ja078030q","","","0.71069","MoKα","","0.1152","0.0504","","0.0964","0.0594","0.0594","","","","","","1.1063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107441","28.885","0.005","15.613","0.005","15.789","0.005","90","","104.356","0.005","90","","6898","3","298","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C53 H85 N O19 V6 -","- C52 H80 N O19 V6 -","- C208 H320 N4 O76 V24 -","4","0.5","","Christophe Aronica; Guillaume Chastanet; Ekaterina Zueva; Serguei A. Borshch; Juan M. Clemente-Juan; Dominique Luneau","A Mixed-Valence Polyoxovanadate(III,IV) Cluster with a Calixarene Cap Exhibiting Ferromagnetic V(III)-V(IV) Interactions","Journal of the American Chemical Society","2008","130","","2365","2371","10.1021/ja078030q","","","0.71069","MoKα","","0.139","0.0738","","0.1221","0.0803","0.0803","","","","","","1.0715","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107442","13.0047","0.0008","19.9544","0.0012","24.4736","0.0015","90","","90","","90","","6350.9","0.7","100","2","100","2","","","","","","","","9","P b c a","-P 2ac 2ab","61","","","","- C26 H32 B9 Cl3 D N P Rh S -","- C26 H32 B9 Cl3 D N P Rh S -","- C208 H256 B72 Cl24 D8 N8 P8 Rh8 S8 -","8","1","","Álvaro Álvarez; Ramón Macías; María José Fabra; Fernando J. Lahoz; Luis A. Oro","Reversible Ethylene Dihydrogen Mediated 11-Vertex nido\ρightarrowcloso\ρightarrownido Conversion in a Metallathiaborane Cluster","Journal of the American Chemical Society","2008","130","","2148","2149","10.1021/ja078197j","","","0.71073","MoKα","","0.065","0.0512","","","0.1037","0.1081","","","","","","1.206","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107443","12.922","0.003","15.436","0.003","12.93","0.003","90","","109.481","0.003","90","","2431.4","0.9","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C43 H46 B9 Cl6 N P2 Rh S -","- C43 H46 B9 Cl6 N P2 Rh S -","- C86 H92 B18 Cl12 N2 P4 Rh2 S2 -","2","1","","Álvaro Álvarez; Ramón Macías; María José Fabra; Fernando J. Lahoz; Luis A. Oro","Reversible Ethylene Dihydrogen Mediated 11-Vertex nido\ρightarrowcloso\ρightarrownido Conversion in a Metallathiaborane Cluster","Journal of the American Chemical Society","2008","130","","2148","2149","10.1021/ja078197j","","","0.71073","MoKα","","0.0814","0.0644","","","0.1306","0.1387","","","","","","1.044","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107444","10.6012","0.0001","14.8549","0.0002","10.5616","0.0001","90","","90","","90","","1663.24","0.03","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H27 N O4 -","- C14 H27 N O4 -","- C56 H108 N4 O16 -","4","1","","Pixu Li; Cory D. Evans; Yongzhong Wu; Bin Cao; Ernest Hamel; Madeleine M. Joullié","Evolution of the Total Syntheses of Ustiloxin Natural Products and Their Analogues","Journal of the American Chemical Society","2008","130","","2351","2364","10.1021/ja710363p","","","0.71069","MoKα","","0.0776","0.0704","","0.2051","0.1977","","","","1.117","1.152","1.152","","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107445","12.1576","0.0014","8.1424","0.0008","13.3921","0.0015","90","","107.226","0.001","90","","1266.2","0.2","143","1","143","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H31 N O7 -","- C28 H31 N O7 -","- C56 H62 N2 O14 -","2","1","","Pixu Li; Cory D. Evans; Yongzhong Wu; Bin Cao; Ernest Hamel; Madeleine M. Joullié","Evolution of the Total Syntheses of Ustiloxin Natural Products and Their Analogues","Journal of the American Chemical Society","2008","130","","2351","2364","10.1021/ja710363p","","","0.71069","MoKα","","0.0321","0.0303","","","0.073","0.0744","","","","","","1.087","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107446","8.9919","0.0002","11.0151","0.0003","20.8011","0.0006","90","","90","","90","","2060.28","0.09","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H28 N2 O6 -","- C19 H28 N2 O6 -","- C76 H112 N8 O24 -","4","1","","Zhihua Chen; Hiroyuki Morimoto; Shigeki Matsunaga; Masakatsu Shibasaki","A Bench-Stable Homodinuclear Ni2-Schiff Base Complex for Catalytic Asymmetric Synthesis of α-Tetrasubstituted anti-α,β-Diamino Acid Surrogates","Journal of the American Chemical Society","2008","130","","2170","2171","10.1021/ja710398q","","","0.71075","MoKα","","","0.0243","","","","0.0635","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107447","12.3594","0.0014","8.5903","0.001","17.871","0.002","90","","91.863","0.003","90","","1896.4","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 Co F6 P -","- C18 H26 Co F6 P -","- C72 H104 Co4 F24 P4 -","4","1","","Ross D. Witherell; Kai E. O. Ylijoki; Jeffrey M. Stryker","Cobalt-Mediated η5-Pentadienyl/Alkyne [5 + 2] Cycloaddition. Synthesis and Characterization of Unbridged η2,η3-Coordinated Cycloheptadienyl Complexes","Journal of the American Chemical Society","2008","130","","2176","2177","10.1021/ja710568d","","","0.71073","MoKα","","0.0865","0.0617","","","0.1809","0.1929","","","","","","1.061","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107448","9.8585","0.001","11.2388","0.0011","23.172","0.002","90","","90","","90","","2567.4","0.4","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H36 B Co F4 Si -","- C26 H36 B Co F4 Si -","- C104 H144 B4 Co4 F16 Si4 -","4","1","","Ross D. Witherell; Kai E. O. Ylijoki; Jeffrey M. Stryker","Cobalt-Mediated η5-Pentadienyl/Alkyne [5 + 2] Cycloaddition. Synthesis and Characterization of Unbridged η2,η3-Coordinated Cycloheptadienyl Complexes","Journal of the American Chemical Society","2008","130","","2176","2177","10.1021/ja710568d","","","0.71073","MoKα","","0.0322","0.0313","","","0.0876","0.0884","","","","","","1.055","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107449","11.698","0.0002","13.7152","0.0003","8.2423","0.0002","90","","90","","90","","1322.4","0.05","160","1","160","1","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C34 H26 O2 S2 -","- C34 H26 O2 S2 -","- C68 H52 O4 S4 -","2","0.5","","Ronaldo Mariz; Xinjun Luan; Michele Gatti; Anthony Linden; Reto Dorta","A Chiral Bis-Sulfoxide Ligand in Late-Transition Metal Catalysis; Rhodium-Catalyzed Asymmetric Addition of Arylboronic Acids to Electron-Deficient Olefins","Journal of the American Chemical Society","2008","130","","2172","2173","10.1021/ja710665q","","","0.71073","MoKα","","0.0617","0.0457","","","0.1032","0.1118","","","","","","1.075","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107450","28.7957","0.0006","28.7957","0.0006","28.7957","0.0006","90","","90","","90","","23877.2","0.9","160","1","160","1","","","","","","","","6","I 21 3","I 2b 2c 3","199","","","","- C73.33 H62.67 Cl2 O5.33 Rh2 S4 -","- C68 H52 Cl2 O4 Rh2 S4 -","- C816 H624 Cl24 O48 Rh24 S48 -","12","0.5","","Ronaldo Mariz; Xinjun Luan; Michele Gatti; Anthony Linden; Reto Dorta","A Chiral Bis-Sulfoxide Ligand in Late-Transition Metal Catalysis; Rhodium-Catalyzed Asymmetric Addition of Arylboronic Acids to Electron-Deficient Olefins","Journal of the American Chemical Society","2008","130","","2172","2173","10.1021/ja710665q","","","0.71073","MoKα","","0.0527","0.0424","","","0.1065","0.1117","","","","","","1.041","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107451","8.3017","0.0007","8.6291","0.0007","32.591","0.003","90","","91.208","0.001","90","","2334.2","0.3","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Platinum complex","Platinum complex","","- C19 H30 N2 O8 Pt S -","- C19 H30 N2 O8 Pt S -","- C76 H120 N8 O32 Pt4 S4 -","4","1","","Julia R. Khusnutdinova; Laura L. Newman; Peter Y. Zavalij; Yiu-Fai Lam; Andrei N. Vedernikov","Direct C(sp3)-O Reductive Elimination of Olefin Oxides from PtIV-Oxetanes Prepared by Aerobic Oxidation of PtII Olefin Derivatives (Olefin = cis-Cyclooctene, Norbornene)","Journal of the American Chemical Society","2008","130","","2174","2175","10.1021/ja7107323","","","0.71073","MoKα","","0.0275","0.0232","","","0.0484","0.0496","","","","","","1","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107452","8.4315","0.0006","8.5602","0.0006","15.7898","0.0011","90","","99.113","0.001","90","","1125.25","0.14","220","2","220","2","","","","","","","","6","P 1 21 1","P 2yb","4","Pt-complex","Pt-complex","","- C19 H28 N2 O8 Pt S -","- C19 H28 N2 O8 Pt S -","- C38 H56 N4 O16 Pt2 S2 -","2","1","","Julia R. Khusnutdinova; Laura L. Newman; Peter Y. Zavalij; Yiu-Fai Lam; Andrei N. Vedernikov","Direct C(sp3)-O Reductive Elimination of Olefin Oxides from PtIV-Oxetanes Prepared by Aerobic Oxidation of PtII Olefin Derivatives (Olefin = cis-Cyclooctene, Norbornene)","Journal of the American Chemical Society","2008","130","","2174","2175","10.1021/ja7107323","","","0.71073","MoKα","","0.0154","0.0144","","","0.0344","0.0347","","","","","","0.998","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107453","10.112","0.002","10.838","0.002","20.948","0.004","81.12","0.03","79.24","0.03","84","0.03","2221.6","0.8","150","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H68 Br N6 Na O11 -","- C34 H60 Br N6 Na O11 -","- C68 H120 Br2 N12 Na2 O22 -","2","1","","Thelma Koullourou; Louise S. Natrajan; Hiren Bhavsar; Simon J.A. Pope; Jianghua Feng; Johanna Narvainen; Rachel Shaw; Emma Scales; Risto Kauppinen; Alan M. Kenwright; Stephen Faulkner","Synthesis and Spectroscopic Properties of a Prototype Single Molecule Dual Imaging Agent Comprising a Heterobimetallic Rhenium-Gadolinium Complex","Journal of the American Chemical Society","2008","130","","2178","2179","10.1021/ja710859p","","","0.69057","Synchrotron","","0.0842","0.0707","","","0.2014","0.2205","","","","","","0.991","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107454","10.2198","0.0019","24.877","0.005","11.625","0.002","90","","105.398","0.005","90","","2849.4","0.9","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H49 Cl P2 Rh -","- C28 H47 Cl P2 Rh -","- C112 H188 Cl4 P8 Rh4 -","4","1","","Jared C. Lewis; Ashley M. Berman; Robert G. Bergman; Jonathan A. Ellman","Rh(I)-Catalyzed Arylation of Heterocycles via C-H Bond Activation: Expanded Scope through Mechanistic Insight","Journal of the American Chemical Society","2008","130","","2493","2500","10.1021/ja0748985","","","0.775","synchrotron","","0.0892","0.0696","","","0.168","0.18","","","","","","1.057","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107455","10.634","0.002","11.825","0.002","11.639","0.002","90","","108.58","0.003","90","","1387.3","0.4","173.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H21 Cl P Rh -","- C12 H21 Cl P Rh -","- C48 H84 Cl4 P4 Rh4 -","4","1","","Jared C. Lewis; Ashley M. Berman; Robert G. Bergman; Jonathan A. Ellman","Rh(I)-Catalyzed Arylation of Heterocycles via C-H Bond Activation: Expanded Scope through Mechanistic Insight","Journal of the American Chemical Society","2008","130","","2493","2500","10.1021/ja0748985","","","0.7107","MoKα","","0.064","0.0355","","0.049","","0.0415","","","","","","1.13","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107456","11.0203","0.0006","14.2539","0.001","17.3967","0.0011","90","","101.395","0.004","90","","2678.8","0.3","150","1","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C36 H28 N2 O2 -","- C36 H28 N2 O2 -","- C144 H112 N8 O8 -","4","0.5","","Annette D. Allen; Jazmin Godoy; Nanyan Fu; Michelle Nagy; Sandra Spadaro; Thomas T. Tidwell; Sinisa Vukovic","Spiro-Aziridine and Bislactam Formation from Bisketene-Imine Cycloadditions","Journal of the American Chemical Society","2008","130","","2386","2387","10.1021/ja077623y","","","0.71073","MoKα","","0.0953","0.0493","","","0.1111","0.1323","","","","","","1.019","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107457","20.2175","0.001","10.5281","0.0008","10.801","0.0016","90","","92.888","0.003","90","","2296.1","0.4","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 N O2 Si -","- C26 H25 N O2 Si -","- C104 H100 N4 O8 Si4 -","4","1","","Annette D. Allen; Jazmin Godoy; Nanyan Fu; Michelle Nagy; Sandra Spadaro; Thomas T. Tidwell; Sinisa Vukovic","Spiro-Aziridine and Bislactam Formation from Bisketene-Imine Cycloadditions","Journal of the American Chemical Society","2008","130","","2386","2387","10.1021/ja077623y","","","0.71073","MoKα","","0.1711","0.0689","","","0.1405","0.1736","","","","","","0.981","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107458","15.7383","0.001","15.7383","0.001","13.9964","0.0012","90","","90","","90","","3466.8","0.4","100","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H56 N2 Ni P4 S2 Se2 -","- C24 H56 N2 Ni P4 S2 Se2 -","- C96 H224 N8 Ni4 P16 S8 Se8 -","4","0.25","","Arunkumar Panneerselvam; Mohammad A. Malik; Mohammad Afzaal; Paul O'Brien; Madeleine Helliwell","The Chemical Vapor Deposition of Nickel Phosphide or Selenide Thin Films from a Single Precursor","Journal of the American Chemical Society","2008","130","","2420","2421","10.1021/ja078202j","","","0.71073","MoKα","","0.0321","0.0253","","","0.0638","0.0684","","","","","","1.082","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107459","10.4903","0.0007","10.5136","0.0007","12.9337","0.0008","90","","107.703","0.004","90","","1358.92","0.16","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H13 Br O4 -","- C15 H13 Br O4 -","- C60 H52 Br4 O16 -","4","2","","Ravi P. Singh; Keith Bartelson; Yi Wang; Heng Su; Xiaojie Lu; Li Deng","Enantioselective Diels-Alder Reaction of Simple α,β-Unsaturated Ketones with a Cinchona Alkaloid Catalyst","Journal of the American Chemical Society","2008","130","","2422","2423","10.1021/ja078251w","","","0.71073","MoKα","","0.0557","0.0424","","0.0852","0.0778","0.0852","","","","","","1.0657","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107460","12.2732","0.0009","10.6002","0.0007","13.1907","0.0009","90","","95.895","0.003","90","","1707","0.2","120","","120","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H32 Br2 Cl2 O10 -","- C34 H32 Br2 Cl2 O10 -","- C68 H64 Br4 Cl4 O20 -","2","1","","Ravi P. Singh; Keith Bartelson; Yi Wang; Heng Su; Xiaojie Lu; Li Deng","Enantioselective Diels-Alder Reaction of Simple α,β-Unsaturated Ketones with a Cinchona Alkaloid Catalyst","Journal of the American Chemical Society","2008","130","","2422","2423","10.1021/ja078251w","","","0.71073","MoKα","","0.0707","0.0437","","0.0907","0.0715","0.0907","","","","","","0.8504","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107461","11.9709","0.0005","12.1176","0.0005","12.3692","0.0006","94.268","0.001","92.209","0.001","118.233","0.001","1570.85","0.12","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H8 B F20 N O4 Re -","- C32 H8 B F20 N O4 Re -","- C64 H16 B2 F40 N2 O8 Re2 -","2","1","","Daesung Chong; Derek R. Laws; Ayman Nafady; Paulo Jorge Costa; Arnold L. Rheingold; Maria José Calhorda; William E. Geiger","[Re(η5-C5H5)(CO)3]+ Family of 17-Electron Compounds: Monomer/Dimer Equilibria and Other Reactions","Journal of the American Chemical Society","2008","130","","2692","2703","10.1021/ja710513n","","","0.71073","MoKα","","0.0257","0.0241","","","0.0607","0.0616","","","","","","1.065","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107462","9.6263","0.0002","10.0188","0.0002","21.2036","0.0004","90","","90","","90","","2044.96","0.07","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","hydroxylamine methyl ester","","","- C23 H22 Br N O3 -","- C23 H22 Br N O3 -","- C92 H88 Br4 N4 O12 -","4","1","","Eric M. Phillips; Troy E. Reynolds; Karl A. Scheidt","Highly Diastereo- and Enantioselective Additions of Homoenolates to Nitrones Catalyzed by N-Heterocyclic Carbenes","Journal of the American Chemical Society","2008","130","","2416","2417","10.1021/ja710521m","","","0.71073","MoKα","","0.0367","0.0283","","","0.06","0.0614","","","","","","0.975","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107463","11.8412","0.0016","12.0344","0.0017","15.568","0.002","93.12","0.002","109.31","0.001","112.128","0.001","1898.4","0.4","141","2","141","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H62 Lu N P2 Si2 -","- C34 H62 Lu N P2 Si2 -","- C68 H124 Lu2 N2 P4 Si4 -","2","1","","Jason D. Masuda; Kimberly C. Jantunen; Oleg V. Ozerov; Kevin J. T. Noonan; Derek P. Gates; Brian L. Scott; Jaqueline L. Kiplinger","A Lanthanide Phosphinidene Complex: Synthesis, Structure, and Phospha-Wittig Reactivity","Journal of the American Chemical Society","2008","130","","2408","2409","10.1021/ja7105306","","","0.71073","MoKα","","0.0575","0.0409","","","0.0827","0.0882","","","","","","0.967","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107464","19.993","0.003","24.746","0.004","17.489","0.003","90","","110.892","0.002","90","","8084","2","141","2","141","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C84 H118 Lu2 N2 P6 -","- C70 H88 Lu2 N2 P6 -","- C280 H352 Lu8 N8 P24 -","4","1","","Jason D. Masuda; Kimberly C. Jantunen; Oleg V. Ozerov; Kevin J. T. Noonan; Derek P. Gates; Brian L. Scott; Jaqueline L. Kiplinger","A Lanthanide Phosphinidene Complex: Synthesis, Structure, and Phospha-Wittig Reactivity","Journal of the American Chemical Society","2008","130","","2408","2409","10.1021/ja7105306","","","0.71073","MoKα","","0.0645","0.0382","","","0.0796","0.0861","","","","","","0.985","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107465","8.547","0.0003","15.599","0.0008","14.702","0.0006","90","","103.188","0.003","90","","1908.44","0.14","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H17 Cl2 Fe N5 -","- C19 H17 Cl2 Fe N5 -","- C76 H68 Cl8 Fe4 N20 -","4","1","","Nasser K. Thallaj; Juliette Przybilla; Richard Welter; Dominique Mandon","A Ferrous Center as Reaction Site for Hydration of a Nitrile Group into a Carboxamide in Mild Conditions","Journal of the American Chemical Society","2008","130","","2414","2415","10.1021/ja710560g","","","0.71073","MoKα","","0.1616","0.121","","","0.1612","0.1714","","","","","","1.266","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107466","10.59","0.0003","12.578","0.0006","17.367","0.0007","90","","102.59","0.05","90","","2257.7","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Cl2 Fe N6 O -","- C21 H22 Cl2 Fe N6 O -","- C84 H88 Cl8 Fe4 N24 O4 -","4","1","","Nasser K. Thallaj; Juliette Przybilla; Richard Welter; Dominique Mandon","A Ferrous Center as Reaction Site for Hydration of a Nitrile Group into a Carboxamide in Mild Conditions","Journal of the American Chemical Society","2008","130","","2414","2415","10.1021/ja710560g","","","0.71073","MoKα","","0.0694","0.0425","","","0.1019","0.1123","","","","","","1.054","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107467","9.1882","0.0005","33.022","0.002","10.3371","0.0005","90","","100.31","0.005","90","","3085.8","0.3","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C48 H79 N12 O26 P3 -","- C48 H55 N12 O26 P3 -","- C96 H110 N24 O52 P6 -","2","1","","Carla Bazzicalupi; Andrea Bencini; Antonio Bianchi; Enrico Faggi; Claudia Giorgi; Samuele Santarelli; Barbara Valtancoli","Polyfunctional Binding of Thymidine 5'-Triphosphate with a Synthetic Polyammonium Receptor Containing Aromatic Groups. Crystal Structure of the Nucleotide-Receptor Adduct","Journal of the American Chemical Society","2008","130","","2440","2441","10.1021/ja7106977","","","0.71069","MoKα","","0.1202","0.07","","","0.1639","0.1756","","","","","","0.922","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107468","10.8114","0.0017","13.26","0.002","13.415","0.002","99.515","0.002","95.225","0.002","114.016","0.002","1705.5","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cu F12 N4 O6 -","- C28 H34 Cu F12 N4 O6 -","- C56 H68 Cu2 F24 N8 O12 -","2","1","","Sergey L. Veber; Matvey V. Fedin; Alexey I. Potapov; Ksenia Yu. Maryunina; Galina V. Romanenko; Renad Z. Sagdeev; Victor I. Ovcharenko; Daniella Goldfarb; Elena G. Bagryanskaya","High-Field EPR Reveals the Strongly Temperature-Dependent Exchange Interaction in ""Breathing"" Crystals Cu(hfac)2LR","Journal of the American Chemical Society","2008","130","","2444","2445","10.1021/ja710773u","","","0.71073","MoKα","","0.0475","0.0435","","","0.1155","0.1183","","","","","","1.073","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107469","10.9007","0.0017","13.296","0.002","13.41","0.002","99.156","0.002","95.855","0.002","113.21","0.002","1734.2","0.5","145","2","145","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cu F12 N4 O6 -","- C28 H34 Cu F12 N4 O6 -","- C56 H68 Cu2 F24 N8 O12 -","2","1","","Sergey L. Veber; Matvey V. Fedin; Alexey I. Potapov; Ksenia Yu. Maryunina; Galina V. Romanenko; Renad Z. Sagdeev; Victor I. Ovcharenko; Daniella Goldfarb; Elena G. Bagryanskaya","High-Field EPR Reveals the Strongly Temperature-Dependent Exchange Interaction in ""Breathing"" Crystals Cu(hfac)2LR","Journal of the American Chemical Society","2008","130","","2444","2445","10.1021/ja710773u","","","0.71073","MoKα","","0.0468","0.0423","","","0.1376","0.1449","","","","","","1.052","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107470","11.0009","0.0016","13.3437","0.0019","13.4475","0.0019","98.807","0.002","96.408","0.002","112.541","0.002","1770.1","0.4","175","2","175","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cu F12 N4 O6 -","- C28 H34 Cu F12 N4 O6 -","- C56 H68 Cu2 F24 N8 O12 -","2","1","","Sergey L. Veber; Matvey V. Fedin; Alexey I. Potapov; Ksenia Yu. Maryunina; Galina V. Romanenko; Renad Z. Sagdeev; Victor I. Ovcharenko; Daniella Goldfarb; Elena G. Bagryanskaya","High-Field EPR Reveals the Strongly Temperature-Dependent Exchange Interaction in ""Breathing"" Crystals Cu(hfac)2LR","Journal of the American Chemical Society","2008","130","","2444","2445","10.1021/ja710773u","","","0.71073","MoKα","","0.0604","0.0531","","","0.1461","0.1534","","","","","","0.95","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107471","11.144","0.003","13.333","0.003","13.454","0.003","98.467","0.004","96.838","0.004","112.28","0.004","1795.9","0.7","240","2","240","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cu F12 N4 O6 -","- C28 H34 Cu F12 N4 O6 -","- C56 H68 Cu2 F24 N8 O12 -","2","1","","Sergey L. Veber; Matvey V. Fedin; Alexey I. Potapov; Ksenia Yu. Maryunina; Galina V. Romanenko; Renad Z. Sagdeev; Victor I. Ovcharenko; Daniella Goldfarb; Elena G. Bagryanskaya","High-Field EPR Reveals the Strongly Temperature-Dependent Exchange Interaction in ""Breathing"" Crystals Cu(hfac)2LR","Journal of the American Chemical Society","2008","130","","2444","2445","10.1021/ja710773u","","","0.71073","MoKα","","0.0665","0.0557","","","0.1446","0.1526","","","","","","0.972","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107472","11.328","0.003","13.42","0.003","13.55","0.003","98.366","0.004","96.956","0.004","112.218","0.004","1851.4","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cu F12 N4 O6 -","- C28 H29 Cu F12 N4 O6 -","- C56 H58 Cu2 F24 N8 O12 -","2","1","","Sergey L. Veber; Matvey V. Fedin; Alexey I. Potapov; Ksenia Yu. Maryunina; Galina V. Romanenko; Renad Z. Sagdeev; Victor I. Ovcharenko; Daniella Goldfarb; Elena G. Bagryanskaya","High-Field EPR Reveals the Strongly Temperature-Dependent Exchange Interaction in ""Breathing"" Crystals Cu(hfac)2LR","Journal of the American Chemical Society","2008","130","","2444","2445","10.1021/ja710773u","","","0.71073","MoKα","","0.1014","0.0565","","","0.1468","0.1772","","","","","","0.945","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107473","14.091","0.001","6.769","0.0006","15.09","0.001","90","","97.922","0.001","90","","1425.58","0.19","163.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H23 N O4 S -","- C13 H23 N O4 S -","- C52 H92 N4 O16 S4 -","4","1","","Sirilata Yotphan; Robert G. Bergman; Jonathan A. Ellman","The Stereoselective Formation of Bicyclic Enamines with Bridgehead Unsaturation via Tandem C-H Bond Activation/Alkenylation/Electrocyclization","Journal of the American Chemical Society","2008","130","","2452","2453","10.1021/ja710981b","","","0.7107","MoKα","","0.0459","0.0375","","0.0607","","0.0574","","","","","","1.877","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107474","15.8848","0.0014","16.5788","0.0011","16.9656","0.0013","90.6916","0.0018","108.532","0.003","106.966","0.003","4024.7","0.6","173.1","","","","","","","","","","","9","P -1","-P 1","2","","","","- C85 H68 B Cl2 F24 Ge P Ru S -","- C85 H68 B Cl2 F24 Ge P Ru S -","- C170 H136 B2 Cl4 F48 Ge2 P2 Ru2 S2 -","2","1","","Tsuyoshi Matsumoto; Yukiko Nakaya; Naohisa Itakura; Kazuyuki Tatsumi","A Functional Hydrogenase Model: Reversible Interconversion of H2 and H2O by a Hydroxo/Sulfido-Bridged Dinuclear Ruthenium-Germanium Complex","Journal of the American Chemical Society","2008","130","","2458","2459","10.1021/ja711325f","","","0.7107","MoKα","","","0.0562","","","","0.13","","","","","","1.1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107475","10.8312","0.0018","11.206","0.0019","20.876","0.003","98.2174","0.0016","93.0858","0.0017","114.717","0.0016","2259.8","0.6","123.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C111 H114 Ge2 P2 Ru2 S2 -","- C111 H111 Ge2 P2 Ru2 S2 -","- C111 H111 Ge2 P2 Ru2 S2 -","1","0.5","","Tsuyoshi Matsumoto; Yukiko Nakaya; Naohisa Itakura; Kazuyuki Tatsumi","A Functional Hydrogenase Model: Reversible Interconversion of H2 and H2O by a Hydroxo/Sulfido-Bridged Dinuclear Ruthenium-Germanium Complex","Journal of the American Chemical Society","2008","130","","2458","2459","10.1021/ja711325f","","","0.7107","MoKα","","","0.0382","","","","0.108","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107476","7.1044","0.0005","7.1739","0.0005","16.6481","0.0012","98.214","0.004","92.598","0.005","107.335","0.004","798.17","0.1","243","0.2","243","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H36 F2 S2 Si2 -","- C34 H36 F2 S2 Si2 -","- C34 H36 F2 S2 Si2 -","1","0.5","","Sankar Subramanian; Sung Kyu Park; Sean R. Parkin; Vitaly Podzorov; Thomas N. Jackson; John E. Anthony","Chromophore Fluorination Enhances Crystallization and Stability of Soluble Anthradithiophene Semiconductors","Journal of the American Chemical Society","2008","130","","2706","2707","10.1021/ja073235k","","","1.54178","CuKα","","0.0755","0.056","","","0.1346","0.1466","","","","","","1.082","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107477","7.5766","0.0004","8.1796","0.0005","16.1503","0.001","100.846","0.003","92.621","0.003","98.79","0.002","968.6","0.1","150","0.2","150","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H48 F2 S2 Si2 -","- C40 H48 F2 S2 Si2 -","- C40 H48 F2 S2 Si2 -","1","0.5","","Sankar Subramanian; Sung Kyu Park; Sean R. Parkin; Vitaly Podzorov; Thomas N. Jackson; John E. Anthony","Chromophore Fluorination Enhances Crystallization and Stability of Soluble Anthradithiophene Semiconductors","Journal of the American Chemical Society","2008","130","","2706","2707","10.1021/ja073235k","","","0.71073","MoKα","","0.0797","0.0559","","","0.1339","0.1487","","","","","","1.079","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107478","10.448","0.0003","12.816","0.0004","32.848","0.0011","90","","90","","90","","4398.4","0.2","130","2","130","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","bmc-f-43-1","bmc-f-43-1","","- C45 H55 B F4 N2 O P2 Pd -","- C45 H55 B F4 N2 O P2 Pd -","- C180 H220 B4 F16 N8 O4 P8 Pd4 -","4","1","","Brian M. Cochran; Forrest E. Michael","Mechanistic Studies of a Palladium-Catalyzed Intramolecular Hydroamination of Unactivated Alkenes: Protonolysis of a Stable Palladium Alkyl Complex Is the Turnover-Limiting Step","Journal of the American Chemical Society","2008","130","","2786","2792","10.1021/ja0734997","","","0.71073","MoKα","","0.2049","0.0693","","","0.1164","0.1501","","","","","","0.996","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107479","20.34","0.006","7.644","0.002","14.309","0.004","90","","109.437","0.007","90","","2098","1","108","2","108","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H13 N2 O7 V -","- C6 H13 N2 O7 V -","- C48 H104 N16 O56 V8 -","8","2","","Curtis J. Schneider; James E. Penner-Hahn; Vincent L. Pecoraro","Elucidating the Protonation Site of Vanadium Peroxide Complexes and the Implications for Biomimetic Catalysis","Journal of the American Chemical Society","2008","130","","2712","2713","10.1021/ja077404c","","","0.71073","MoKα","","0.0729","0.0693","","","0.2152","0.2211","","","","","","1.083","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107480","12.0086","0.0004","15.2553","0.0005","27.7796","0.0011","90","","90","","68.174","0.002","4724.3","0.3","293","2","223","2","","","","","","","","7","P 1 1 21/n","-P 2n","14","","Phenyltris(1-mesityl-imidazol-2-ylidene)boratoiron(ii) chloride","","- C16.73 H18.91 B0.36 Cl0.36 Fe0.36 N2.18 O0.36 -","- C16.7273 H18.9091 B0.363636 Cl0.363636 Fe0.363636 N2.18182 O0.363636 -","- C184 H208 B4 Cl4 Fe4 N24 O4 -","11","2.75","","Ismael Nieto; Feizhi Ding; Ranko P. Bontchev; Haobin Wang; Jeremy M. Smith","Thermodynamics of Hydrogen Atom Transfer to a High-Valent Iron Imido Complex","Journal of the American Chemical Society","2008","130","","2716","2717","10.1021/ja0776834","","","0.71073","MoKα","","0.0744","0.0666","","","0.2159","0.2299","","","","","","1.113","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107481","11.0815","0.0009","13.1645","0.001","15.5303","0.0012","96.39","0.004","93.355","0.004","97.093","0.004","2228.3","0.3","223","2","293","2","","","","","","","","5","P -1","-P 1","2","","Cyclooctenephenyltris-(1-mesity-imidazol-2-ylidene)boratoiron(i)","","- C50 H58 B Fe N6 -","- C50 H58 B Fe N6 -","- C100 H116 B2 Fe2 N12 -","2","1","","Ismael Nieto; Feizhi Ding; Ranko P. Bontchev; Haobin Wang; Jeremy M. Smith","Thermodynamics of Hydrogen Atom Transfer to a High-Valent Iron Imido Complex","Journal of the American Chemical Society","2008","130","","2716","2717","10.1021/ja0776834","","","0.71073","MoKα","","0.0518","0.0422","","","0.1102","0.129","","","","","","1.199","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107482","12.8658","0.0005","14.168","0.0005","17.1575","0.0006","67.839","0.002","83.695","0.002","74.14","0.002","2786.14","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","1-Adamantyl-phenyltris(1-mesitylimidazol-2-ylidene)boratoiron(ii)","","- C37.33 H46 B0.67 Fe0.67 N4.67 O0.67 -","- C37.3333 H46 B0.666667 Fe0.666667 N4.66667 O0.666667 -","- C112 H138 B2 Fe2 N14 O2 -","3","1.5","","Ismael Nieto; Feizhi Ding; Ranko P. Bontchev; Haobin Wang; Jeremy M. Smith","Thermodynamics of Hydrogen Atom Transfer to a High-Valent Iron Imido Complex","Journal of the American Chemical Society","2008","130","","2716","2717","10.1021/ja0776834","","","0.71073","MoKα","","0.0756","0.0656","","","0.2147","0.23","","","","","","1.151","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107483","22.1839","0.0007","14.0327","0.0004","23.1256","0.0007","90","","114.901","0.002","90","","6529.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Adamantylimido-phenyltris(1-mesitylimidazol-2-ylidene)boratoiron(iv) tetraphenylborate.","","- C76 H79 B2 Fe N7 -","- C76 H79 B2 Fe N7 -","- C304 H316 B8 Fe4 N28 -","4","1","","Ismael Nieto; Feizhi Ding; Ranko P. Bontchev; Haobin Wang; Jeremy M. Smith","Thermodynamics of Hydrogen Atom Transfer to a High-Valent Iron Imido Complex","Journal of the American Chemical Society","2008","130","","2716","2717","10.1021/ja0776834","","","0.71073","MoKα","","0.0655","0.0491","","","0.1337","0.1539","","","","","","1.163","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107484","13.839","0.002","14.853","0.002","17.604","0.003","90","","90","","90","","3618.5","0.9","100","2","100","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C32 H42 Fe N6 O7 S2 -","- C32 H42 Fe N6 O7 S2 -","- C128 H168 Fe4 N24 O28 S8 -","4","0.5","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Peter D. Southon; John D. Cashion; Jean-François Létard; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Single-Crystal to Single-Crystal Structural Transformation and Photomagnetic Properties of a Porous Iron(II) Spin-Crossover Framework","Journal of the American Chemical Society","2008","130","","2869","2876","10.1021/ja077958f","","","0.71073","MoKα","","0.1059","0.0798","","","0.2268","0.2543","","","","","","1.05","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107485","14.796","0.002","14.796","0.002","17.399","0.004","90","","90","","90","","3809","1.1","173","2","375","2","","","","","","","","6","I 4/m c m","-I 4 2c","140","","","","- C26 H20 Fe N6 O4 S2 -","- C26 H20 Fe N6 O4 S2 -","- C104 H80 Fe4 N24 O16 S8 -","4","0.125","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Peter D. Southon; John D. Cashion; Jean-François Létard; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Single-Crystal to Single-Crystal Structural Transformation and Photomagnetic Properties of a Porous Iron(II) Spin-Crossover Framework","Journal of the American Chemical Society","2008","130","","2869","2876","10.1021/ja077958f","","","0.71073","MoKα","","0.102","0.0811","","","0.2118","0.2439","","","","","","1.206","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107486","13.875","0.002","15.083","0.002","17.97","0.003","90","","90","","90","","3760.7","1","200","2","200","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C32 H42 Fe N6 O7 S2 -","- C32 H42 Fe N6 O7 S2 -","- C128 H168 Fe4 N24 O28 S8 -","4","0.5","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Peter D. Southon; John D. Cashion; Jean-François Létard; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Single-Crystal to Single-Crystal Structural Transformation and Photomagnetic Properties of a Porous Iron(II) Spin-Crossover Framework","Journal of the American Chemical Society","2008","130","","2869","2876","10.1021/ja077958f","","","0.71073","MoKα","","0.0764","0.0624","","","0.2085","0.2301","","","","","","0.998","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107487","12.424","0.0013","20.853","0.002","17.974","0.0019","90","","94.01","0.002","90","","4645.3","0.8","158","2","158","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H68 N2 O5 Zr -","- C46 H68 N2 O5 Zr -","- C184 H272 N8 O20 Zr4 -","4","1","","Karen J. Blackmore; Neetu Lal; Joseph W. Ziller; Alan F. Heyduk","Catalytic Reactivity of a Zirconium(IV) Redox-Active Ligand Complex with 1,2-Diphenylhydrazine","Journal of the American Chemical Society","2008","130","","2728","2729","10.1021/ja710611v","","","0.71073","MoKα","","0.0877","0.0713","","","0.2122","0.2313","","","","","","1.095","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107488","22.584","0.005","9.846","0.002","18.559","0.004","90","","90","","90","","4126.8","1.5","163","2","163","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C42 H60 Cl2 N2 O4 Zr -","- C42 H60 Cl2 N2 O4 Zr -","- C168 H240 Cl8 N8 O16 Zr4 -","4","1","","Karen J. Blackmore; Neetu Lal; Joseph W. Ziller; Alan F. Heyduk","Catalytic Reactivity of a Zirconium(IV) Redox-Active Ligand Complex with 1,2-Diphenylhydrazine","Journal of the American Chemical Society","2008","130","","2728","2729","10.1021/ja710611v","","","0.71073","MoKα","","0.1005","0.0564","","","0.1331","0.1623","","","","","","1.039","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107489","12.5585","0.0008","10.5717","0.0007","21.191","0.0014","90","","98.341","0.001","90","","2783.7","0.3","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H37 F3 O9 P2 Pd -","- C20 H37 F3 O9 P2 Pd -","- C80 H148 F12 O36 P8 Pd4 -","4","1","","Li-Biao Han; Yutaka Ono; Shigeru Shimada","Palladium-Catalyzed Dehydrogenative Cis Double Phosphorylation of Alkynes with H-Phosphonate Leading to (Z)-Bisphosphoryl-1-alkenes","Journal of the American Chemical Society","2008","130","","2752","2753","10.1021/ja7108272","","","0.71069","MoKα","","","0.0309","","","","0.0698","","","","","","1.031","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107490","27.2026","0.0012","11.6441","0.0005","22.7334","0.001","90","","100.305","0.001","90","","7084.6","0.5","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H53 F3 O10 P2 Pd -","- C28 H16 F3 O10 P2 Pd -","- C224 H128 F24 O80 P16 Pd8 -","8","1","","Li-Biao Han; Yutaka Ono; Shigeru Shimada","Palladium-Catalyzed Dehydrogenative Cis Double Phosphorylation of Alkynes with H-Phosphonate Leading to (Z)-Bisphosphoryl-1-alkenes","Journal of the American Chemical Society","2008","130","","2752","2753","10.1021/ja7108272","","","0.71069","MoKα","","","0.0497","","","","0.1295","","","","","","1.069","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107491","5.0572","0.0007","11.6708","0.0014","13.3628","0.0015","113.92","0.005","94.895","0.005","96.313","0.005","709.22","0.16","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C14 H13 Br N O4 -","- C14 H13 Br N O4 -","- C28 H26 Br2 N2 O8 -","2","2","","Cisco Bee; Soo Bong Han; Abbas Hassan; Hiroki Iida; Michael J. Krische","Diastereo- and Enantioselective Hydrogenative Aldol Coupling of Vinyl Ketones: Design of Effective Monodentate TADDOL-Like Phosphonite Ligands","Journal of the American Chemical Society","2008","130","","2746","2747","10.1021/ja710862u","","","0.71073","MoKα","","0.1003","0.0759","","","0.176","0.1876","","","","","","1.34","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107492","10.553","0.0006","10.553","0.0006","50.011","0.002","90","","90","","90","","5569.5","0.5","153","2","153","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C47 H62 F3 O11 P2 Rh S3 -","- C47 H62 F3 O11 P2 Rh S3 -","- C188 H248 F12 O44 P8 Rh4 S12 -","4","0.5","","Cisco Bee; Soo Bong Han; Abbas Hassan; Hiroki Iida; Michael J. Krische","Diastereo- and Enantioselective Hydrogenative Aldol Coupling of Vinyl Ketones: Design of Effective Monodentate TADDOL-Like Phosphonite Ligands","Journal of the American Chemical Society","2008","130","","2746","2747","10.1021/ja710862u","","","0.71073","MoKα","","0.1445","0.1078","","","0.2592","0.274","","","","","","1.268","","","","has coordinates,has disorder","178820","2020-10-21","18:00:00",""
"4107493","7.3647","0.0003","9.5326","0.0005","15.7688","0.0007","90","","100.179","0.002","90","","1089.62","0.09","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H19 Br N2 O7 -","- C22 H19 Br N2 O7 -","- C44 H38 Br2 N4 O14 -","2","1","","Cisco Bee; Soo Bong Han; Abbas Hassan; Hiroki Iida; Michael J. Krische","Diastereo- and Enantioselective Hydrogenative Aldol Coupling of Vinyl Ketones: Design of Effective Monodentate TADDOL-Like Phosphonite Ligands","Journal of the American Chemical Society","2008","130","","2746","2747","10.1021/ja710862u","","","0.7107","MoKα","","0.035","0.0281","","","0.0552","0.058","","","","","","1.026","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107494","8.2677","0.0004","11.2246","0.0006","30.5196","0.0017","90","","90","","90","","2832.3","0.3","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C31 H48 O5 -","- C31 H48 O5 -","- C124 H192 O20 -","4","1","","Suwei Dong; Jianglong Zhu; John A. Porco","Enantioselective Synthesis of Bicyclo[2.2.2]octenones Using a Copper-Mediated Oxidative Dearomatization/[4 + 2] Dimerization Cascade1","Journal of the American Chemical Society","2008","130","","2738","2739","10.1021/ja711018z","","","0.71073","MoKα","","0.0515","0.0417","","","0.1001","0.1057","","","","","","1.043","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107495","11.8734","0.0015","17.225","0.002","22.814","0.003","90.536","0.002","103.247","0.002","108.671","0.002","4285.4","0.9","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- H18.8 K9.8 Na3 O80.3 P2 Pd W19 -","- K9.8 Na3 O80.3 P2 Pd W19 -","- K19.6 Na6 O160.6 P4 Pd2 W38 -","2","1","","Travis M. Anderson; Rui Cao; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Wade A. Neiwert; Shaoxiong Wu; Martin L. Kirk; Sushilla Knottenbelt; Ezra C. Depperman; Bineta Keita; Louis Nadjo; Djamaladdin G. Musaev; Keiji Morokuma; Craig L. Hill","A Palladium-Oxo Complex. Stabilization of This Proposed Catalytic Intermediate by an Encapsulating Polytungstate Ligand [J. Am. Chem.Soc.2005,127, 11948-11949].","Journal of the American Chemical Society","2008","130","","2877","2877","10.1021/ja711078v","","","0.71073","MoKα","","0.0502","0.0448","","","0.1391","0.1439","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107496","38.433","0.003","5.439","0.0004","18.8955","0.0015","90","","110.179","0.001","90","","3707.4","0.5","125","2","125","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C22 H24 O5 -","- C22 H24 O5 -","- C176 H192 O40 -","8","2","","Maolin Yu; Samuel J. Danishefsky","A Direct Route to Fluostatin C by a Fascinating Diels-Alder Reaction","Journal of the American Chemical Society","2008","130","","2783","2785","10.1021/ja7113757","","","0.71073","MoKα","","0.0874","0.0537","","","0.1252","0.1429","","","","","","1.023","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107497","12.671","0.0004","17.396","0.0003","21.867","0.0007","90","","90","","90","","4820","0.2","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Si3Se-bicyclo[1.1.0]butane","","- C36 H84 Se Si7 -","- C36 H84 Se Si7 -","- C144 H336 Se4 Si28 -","4","1","","Vladimir Ya. Lee; Shogo Miyazaki; Hiroyuki Yasuda; Akira Sekiguchi","Isomeric Metamorphosis: Si3E (E = S, Se, and Te) Bicyclo[1.1.0]butane and Cyclobutene","Journal of the American Chemical Society","2008","130","","2758","2759","10.1021/ja800111r","","","0.7107","MoKα","","0.063","0.0533","","","0.1436","0.15","","","","","","1.046","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107498","12.687","0.0003","17.482","0.0004","21.893","0.0006","90","","90","","90","","4855.7","0.2","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Si3Te-bicyclo[1.1.0]butane","","- C36 H84 Si7 Te -","- C36 H84 Si7 Te -","- C144 H336 Si28 Te4 -","4","1","","Vladimir Ya. Lee; Shogo Miyazaki; Hiroyuki Yasuda; Akira Sekiguchi","Isomeric Metamorphosis: Si3E (E = S, Se, and Te) Bicyclo[1.1.0]butane and Cyclobutene","Journal of the American Chemical Society","2008","130","","2758","2759","10.1021/ja800111r","","","0.7107","MoKα","","0.0375","0.0332","","","0.0871","0.0893","","","","","","1.013","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107499","20.007","0.0007","12.243","0.0004","23.723","0.0007","90","","123.58","0.002","90","","4841.1","0.3","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Si3Se-cyclobutene","","- C36 H84 Se Si7 -","- C36 H84 Se Si7 -","- C144 H336 Se4 Si28 -","4","1","","Vladimir Ya. Lee; Shogo Miyazaki; Hiroyuki Yasuda; Akira Sekiguchi","Isomeric Metamorphosis: Si3E (E = S, Se, and Te) Bicyclo[1.1.0]butane and Cyclobutene","Journal of the American Chemical Society","2008","130","","2758","2759","10.1021/ja800111r","","","0.7107","MoKα","","0.0761","0.0615","","","0.1705","0.1827","","","","","","1.051","","","","has coordinates","178820","2020-10-21","18:00:00",""
"4107500","8.9163","0.0003","20.8603","0.0007","11.1551","0.0005","90","","91.3879","0.0015","90","","2074.2","0.14","123.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H36 Co N10 O4 S2 -","- C46 H36 Co N10 O4 S2 -","- C92 H72 Co2 N20 O8 S4 -","2","0.5","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.0394","","","","0.1091","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107501","11.2616","0.0005","19.5979","0.0007","23.6461","0.0009","90","","90.573","0.0012","90","","5218.5","0.4","123.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H44 Co N10 O9 S2 -","- C54 H44 Co N10 O9 S2 -","- C216 H176 Co4 N40 O36 S8 -","4","1","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.0631","","","","0.1603","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107502","17.0307","0.0011","21.0325","0.0013","10.8981","0.0008","90","","129.732","0.0018","90","","3002.1","0.4","296.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tert-butylphenyl)-N-oxylamino}pyridine]di(thiocyanato-N)cobalt(II)","","- C62 H68 Co N10 O4 S2 -","- C62 H68 Co N10 O4 S2 -","- C124 H136 Co2 N20 O8 S4 -","2","0.5","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.058","","","","0.172","","","","","","1.077","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107503","10.1796","0.0008","12.5417","0.0009","20.2773","0.0015","75.475","0.002","83.843","0.002","83.886","0.002","2483.1","0.3","123.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C102 H152 Co N10 O6 S2 -","- C102 H152 Co N10 O6 S2 -","- C102 H152 Co N10 O6 S2 -","1","0.5","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.0863","","","","0.2415","","","","","","0.955","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107504","10.3678","0.0005","12.4883","0.0007","20.1384","0.0008","75.1828","0.0014","83.049","0.0011","84.746","0.0016","2497.2","0.2","296.1","","","","","","","","","","","5","P -1","-P 1","2","","6-tert-butylphenyl)-N-oxylamino}pyridine]di(isocyanato-N)cobalt(II)","","- C102 H152 Co N10 O8 -","- C102 H152 Co N10 O8 -","- C102 H152 Co N10 O8 -","1","0.5","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.0627","","","","0.2011","","","","","","1.14","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107505","9.99","0.0004","19.4317","0.0008","11.8283","0.0005","90","","116.326","0.0015","90","","2058","0.15","123.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H33 N2 O -","- C23 H33 N2 O -","- C92 H132 N8 O4 -","4","1","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.0924","","","","0.2685","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107506","18.2162","0.0006","10.8471","0.0005","22.0773","0.0008","90","","98.4008","0.001","90","","4315.5","0.3","123.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H21 N2 O -","- C29 H21 N2 O -","- C232 H168 N16 O8 -","8","2","","Shinji Kanegawa; Satoru Karasawa; Masataka Maeyama; Motohiro Nakano; Noboru Koga","Crystal Design of Monometallic Single-Molecule Magnets Consisting of Cobalt-Aminoxyl Heterospins","Journal of the American Chemical Society","2008","130","","3079","3094","10.1021/ja0767579","","","0.71075","MoKα","","","0.0525","","","","0.0971","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107507","10.2316","0.0001","10.2316","0.0001","34.3642","0.0006","90","","90","","90","","3597.44","0.08","296","2","296","2","","","","","","","","5","I 41/a m d :2","-I 4bd 2","141","","","","- C40 H60 N4 O128 Si64 -","- C45.44 H66.24 N4.16 O128 Si64 -","- C45.44 H66.24 N4.16 O128 Si64 -","1","0.03125","","Darren H. Brouwer; Gary D. Enright","Probing Local Structure in Zeolite Frameworks: Ultrahigh-Field NMR Measurements and Accurate First-Principles Calculations of Zeolite 29Si Magnetic Shielding Tensors","Journal of the American Chemical Society","2008","130","","3095","3105","10.1021/ja077430a","","","0.71073","MoKα","","0.0346","0.0271","","","0.0703","0.074","","","","","","1.047","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107508","38.945","0.004","24.649","0.002","17.3178","0.0015","90","","113.609","0.002","90","","15233","2","138","2","138","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C135 H100 F24 Mn4 N31 O4 P4 Re -","- C89.3333 H66.6667 F14.6227 Mn2.66667 N21.3333 O2.33333 P2.70933 Re0.666667 -","- C536 H400 F87.736 Mn16 N128 O14 P16.256 Re4 -","6","0.75","","Danna E. Freedman; David M. Jenkins; Anthony T. Iavarone; Jeffrey R. Long","A Redox-Switchable Single-Molecule Magnet Incorporating [Re(CN)7]3-","Journal of the American Chemical Society","2008","130","","2884","2885","10.1021/ja077527x","","","0.71073","MoKα","","0.1411","0.0806","","","0.2244","0.2585","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107509","38.414","0.013","24.631","0.008","17.267","0.006","90","","113.491","0.006","90","","14984","9","173","","173","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C129 H100 F30 Mn4 N30 O P5 Re -","- C130 H100 F22.01 Mn4 N32 O P4 Re -","- C520 H400 F88.04 Mn16 N128 O4 P16 Re4 -","4","0.5","","Danna E. Freedman; David M. Jenkins; Anthony T. Iavarone; Jeffrey R. Long","A Redox-Switchable Single-Molecule Magnet Incorporating [Re(CN)7]3-","Journal of the American Chemical Society","2008","130","","2884","2885","10.1021/ja077527x","","","0.71073","MoKα","","0.1643","0.1161","","","0.3038","0.3551","","","","","","1.359","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107510","4.1275","0.0003","4.1275","0.0003","4.2357","0.0004","90","","90","","120","","62.493","0.009","293","2","293","2","","","","","","","","3","P 6/m m m","-P 6 2","191","Ytterbium gallium silicide","Ytterbium gallium silicon","","- Ga1.13 Si0.87 Yb -","- Ga1.126 Si0.874 Yb -","- Ga1.126 Si0.874 Yb -","1","0.0416667","","Motoharu Imai; Akira Sato; Takeshi Aoyagi; Takashi Kimura; Yoshitaka Matsushita; Naohito Tsujii","Superconductivity in the AlB2-Type Ternary Rare-Earth Silicide YbGa1.1Si0.9","Journal of the American Chemical Society","2008","130","","2886","2887","10.1021/ja077669r","","","0.71073","MoKα","","0.0249","0.0249","","","0.0589","0.0589","","","","","","1.16","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107511","14.2841","0.0007","16.2847","0.0008","17.3657","0.0009","90","","100.91","0.001","90","","3966.5","0.3","90","2","90","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C46 H45 B2 Cl2 F2 N5 O -","- C46 H43 B2 Cl2 F2 N5 O -","- C184 H172 B8 Cl8 F8 N20 O4 -","4","1","","Amelia M. Albrett; Jeanet Conradie; Peter D. W. Boyd; George R. Clark; Abhik Ghosh; Penelope J. Brothers","Corrole as a Binucleating Ligand: Preparation, Molecular Structure and Density Functional Theory Study of Diboron Corroles","Journal of the American Chemical Society","2008","130","","2888","2889","10.1021/ja077785u","","","0.71073","MoKα","","0.1083","0.0764","","","0.1806","0.2069","","","","","","1.017","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107512","13.176","0.007","17.57","0.007","19.056","0.013","111.95","0.04","100.34","0.05","95.84","0.04","3956","4","20","1","20","1","","","","","","","","4","P -1","-P 1","2","[Fe(TPP)(2-MeHIm)]","","","- C100 H74 Fe2 N14 -","- C100 H74 Fe2 N14 -","- C200 H148 Fe4 N28 -","2","1","","Chuanjiang Hu; Bruce C. Noll; Paula M. B. Piccoli; Arthur J. Schultz; Charles E. Schulz; W. Robert Scheidt","Hydrogen Bonding Effects on the Electronic Configuration of Five-Coordinate High-Spin Iron(II) Porphyrinates","Journal of the American Chemical Society","2008","130","","3127","3136","10.1021/ja078222l","powder diffraction","neutron","","neutron","","0.185","0.165","","","","0.171","","","1.37","","","1.37","","","","has coordinates,has Fobs","178821","2020-10-21","18:00:00",""
"4107513","13.1854","0.0002","17.5883","0.0003","19.0189","0.0003","111.751","0.001","100.371","0.001","95.742","0.001","3962","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","[Fe(TPP)(2-MeHIm)]","","","- C100 H74 Fe2 N14 -","- C100 H74 Fe2 N14 -","- C200 H148 Fe4 N28 -","2","1","","Chuanjiang Hu; Bruce C. Noll; Paula M. B. Piccoli; Arthur J. Schultz; Charles E. Schulz; W. Robert Scheidt","Hydrogen Bonding Effects on the Electronic Configuration of Five-Coordinate High-Spin Iron(II) Porphyrinates","Journal of the American Chemical Society","2008","130","","3127","3136","10.1021/ja078222l","","","0.71073","MoKα","","0.0552","0.0368","","","0.0865","0.0944","","","","","","1.023","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107514","9.1056","0.0003","9.1056","0.0003","15.955","0.0012","90","","90","","120","","1145.63","0.1","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C8 H4 Cu O4.11 -","- C8 H4 Cu O4.11 -","- C48 H24 Cu6 O24.66 -","6","0.5","","Emily A. Nytko; Joel S. Helton; Peter Müller; Daniel G. Nocera","A Structurally Perfect S=1/2 Metal-Organic Hybrid Kagomé Antiferromagnet","Journal of the American Chemical Society","2008","130","","2922","2923","10.1021/ja709991u","","","0.71073","MoKα","","0.0235","0.0217","","","0.0621","0.0637","","","","","","1.101","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107515","7.0738","0.0006","10.8611","0.0008","12.079","0.0009","104.014","0.001","99.412","0.001","98.208","0.001","872.01","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H24 Cu6 O26 -","- C32 H24 Cu6 O26 -","- C32 H24 Cu6 O26 -","1","0.5","","Emily A. Nytko; Joel S. Helton; Peter Müller; Daniel G. Nocera","A Structurally Perfect S=1/2 Metal-Organic Hybrid Kagomé Antiferromagnet","Journal of the American Chemical Society","2008","130","","2922","2923","10.1021/ja709991u","","","0.71073","MoKα","","0.0512","0.0333","","","0.0699","0.0768","","","","","","1.021","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107516","9.1081","0.0002","9.1081","0.0002","15.9432","0.0005","90","","90","","120","","1145.41","0.05","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C8 H4 Cu O4 -","- C8 H4 Cu O4 -","- C48 H24 Cu6 O24 -","6","0.5","","Emily A. Nytko; Joel S. Helton; Peter Müller; Daniel G. Nocera","A Structurally Perfect S=1/2 Metal-Organic Hybrid Kagomé Antiferromagnet","Journal of the American Chemical Society","2008","130","","2922","2923","10.1021/ja709991u","","","0.71073","MoKα","","0.0217","0.0212","","","0.0667","0.0674","","","","","","1.098","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107517","8.8042","0.0001","24.7788","0.0003","17.0166","0.0003","90","","101.457","0.0002","90","","3638.33","0.09","173.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H46 Cl2 Ru2 S2 -","- C38 H46 Cl2 Ru2 S2 -","- C152 H184 Cl8 Ru8 S8 -","4","1","","Yoshihiro Yamauchi; Masahiro Yuki; Yoshiaki Tanabe; Yoshihiro Miyake; Youichi Inada; Sakae Uemura; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Vinylic Substitution Reactions with Nucleophiles via Butatrienylidene Intermediates","Journal of the American Chemical Society","2008","130","","2908","2909","10.1021/ja710013y","","","0.71069","MoKα","","","0.03","","","","0.0754","","","","","","1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107518","13.9616","0.0004","5.5553","0.0002","15.2886","0.0005","90","","92.1092","0.0014","90","","1184.99","0.07","173.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 O2 -","- C15 H12 O2 -","- C60 H48 O8 -","4","1","","Yoshihiro Yamauchi; Masahiro Yuki; Yoshiaki Tanabe; Yoshihiro Miyake; Youichi Inada; Sakae Uemura; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Vinylic Substitution Reactions with Nucleophiles via Butatrienylidene Intermediates","Journal of the American Chemical Society","2008","130","","2908","2909","10.1021/ja710013y","","","0.71069","MoKα","","","0.0369","","","","0.0622","","","","","","1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107519","14.0117","0.0002","7.9618","0.0002","27.913","0.0006","90","","90","","90","","3113.93","0.11","173.1","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H20 O2 -","- C19 H20 O2 -","- C152 H160 O16 -","8","1","","Yoshihiro Yamauchi; Masahiro Yuki; Yoshiaki Tanabe; Yoshihiro Miyake; Youichi Inada; Sakae Uemura; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Vinylic Substitution Reactions with Nucleophiles via Butatrienylidene Intermediates","Journal of the American Chemical Society","2008","130","","2908","2909","10.1021/ja710013y","","","0.71069","MoKα","","","0.0539","","","","0.0616","","","","","","1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107520","11.42","0.0002","24.7034","0.0005","13.1336","0.0002","90","","97.899","0.003","90","","3670","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H54 Cr N4 O -","- C40 H54 Cr N4 O -","- C160 H216 Cr4 N16 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0562","0.0383","","","0.0914","0.0999","","","","","","1.038","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107521","18.6955","0.0004","17.8857","0.0004","19.2902","0.0004","90","","90","","90","","6450.3","0.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C36 H44 Mn N4 -","- C36 H44 Mn N4 -","- C288 H352 Mn8 N32 -","8","2","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0482","0.0362","","","0.0739","0.0789","","","","","","1.012","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107522","9.4383","0.0003","18.625","0.0006","18.2581","0.0006","90","","100.527","0.003","90","","3155.54","0.18","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H44 Fe N4 -","- C36 H44 Fe N4 -","- C144 H176 Fe4 N16 -","4","2","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0627","0.0457","","","0.0976","0.1042","","","","","","1.03","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107523","9.3884","0.0003","18.4602","0.0006","18.3906","0.0006","90","","100.704","0.003","90","","3131.85","0.18","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H44 Co N4 -","- C36 H44 Co N4 -","- C144 H176 Co4 N16 -","4","2","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0456","0.0349","","","0.0777","0.082","","","","","","1.013","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107524","10.084","0.0003","18.8318","0.0005","17.5447","0.0004","90","","102.104","0.003","90","","3257.67","0.15","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 N4 Ni -","- C36 H44 N4 Ni -","- C144 H176 N16 Ni4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0485","0.0362","","","0.0904","0.0973","","","","","","1.028","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107525","18.5855","0.0004","17.939","0.0004","19.2006","0.0004","90","","90","","90","","6401.6","0.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C36 H44 N4 Zn -","- C36 H44 N4 Zn -","- C288 H352 N32 Zn8 -","8","2","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0638","0.0397","","","0.0743","0.0812","","","","","","1.034","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107526","12.7789","0.0004","29.4954","0.0009","18.8736","0.0006","90","","95.181","0.003","90","","7084.7","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B Cr F24 N4 O -","- C72 H64 B Cr F24 N4 O -","- C288 H256 B4 Cr4 F96 N16 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.1008","0.0603","","","0.1302","0.1508","","","","","","1.009","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107527","12.7681","0.0003","29.7624","0.0009","18.8399","0.0005","90","","94.691","0.003","90","","7135.4","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B F24 Mn N4 O -","- C72 H64 B F24 Mn N4 O -","- C288 H256 B4 F96 Mn4 N16 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0787","0.0541","","","0.1296","0.1457","","","","","","1.007","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107528","12.7624","0.0002","29.4794","0.0004","18.9134","0.0003","90","","95.431","0.003","90","","7083.81","0.19","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B F24 Fe N4 O -","- C72 H64 B F24 Fe N4 O -","- C288 H256 B4 F96 Fe4 N16 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0582","0.0515","","","0.1309","0.137","","","","","","1.021","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107529","12.8349","0.0002","29.9514","0.0005","18.9948","0.0003","90","","94.795","0.003","90","","7276.5","0.2","220","2","220","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B F24 Fe N4 O -","- C72 H64 B F24 Fe N4 O -","- C288 H256 B4 F96 Fe4 N16 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0834","0.0646","","","0.1656","0.1807","","","","","","1.022","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107530","12.7059","0.0004","29.3218","0.0011","18.9079","0.0005","90","","95.674","0.003","90","","7009.8","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B Co F24 N4 O -","- C72 H64 B Co F24 N4 O -","- C288 H256 B4 Co4 F96 N16 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0773","0.0504","","","0.1103","0.1231","","","","","","1.031","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107531","12.7517","0.0005","29.4819","0.0011","18.8847","0.0008","90","","95.573","0.003","90","","7066","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B F24 N4 Ni O -","- C72 H64 B F24 N4 Ni O -","- C288 H256 B4 F96 N16 Ni4 O4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0783","0.056","","","0.1254","0.1379","","","","","","1.036","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107532","12.8399","0.0004","29.4188","0.0007","18.7498","0.0004","90","","95.159","0.003","90","","7053.8","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H64 B F24 N4 O Zn -","- C72 H64 B F24 N4 O Zn -","- C288 H256 B4 F96 N16 O4 Zn4 -","4","1","","Connie C. Lu; Eckhard Bill; Thomas Weyhermüller; Eberhard Bothe; Karl Wieghardt","Neutral Bis(α-iminopyridine)metal Complexes of the First-Row Transition Ions (Cr, Mn, Fe, Co, Ni, Zn) and Their Monocationic Analogues: Mixed Valency Involving a Redox Noninnocent Ligand System","Journal of the American Chemical Society","2008","130","","3181","3197","10.1021/ja710663n","","","0.71073","MoKα","","0.0794","0.0501","","","0.1095","0.1231","","","","","","1.007","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107533","11.6501","0.0015","21.343","0.003","18.28","0.002","90","","99.423","0.002","90","","4484","1","141","2","141","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H44 I2 N2 O2 P2 U -","- C46 H34 I2 N2 O2 P2 U -","- C184 H136 I8 N8 O8 P8 U4 -","4","1","","Liam P. Spencer; Ping Yang; Brian L. Scott; Enrique R. Batista; James M. Boncella","Imido Exchange in Bis(imido) Uranium(VI) Complexes with Aryl Isocyanates","Journal of the American Chemical Society","2008","130","","2930","2931","10.1021/ja7107454","","","0.71073","MoKα","","0.0864","0.0578","","","0.1464","0.1601","","","","","","1.336","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107534","10.7202","0.0019","11.445","0.002","12.29","0.002","97.471","0.002","112.773","0.002","101.48","0.002","1326.3","0.4","141","2","141","2","","","","","","","","8","P -1","-P 1","2","","","","- C55 H54 Cl2 I2 N2 O2 P2 U -","- C54 H52 I2 N2 O2 P2 U -","- C54 H52 I2 N2 O2 P2 U -","1","0.5","","Liam P. Spencer; Ping Yang; Brian L. Scott; Enrique R. Batista; James M. Boncella","Imido Exchange in Bis(imido) Uranium(VI) Complexes with Aryl Isocyanates","Journal of the American Chemical Society","2008","130","","2930","2931","10.1021/ja7107454","","","0.71073","MoKα","","0.0605","0.0419","","","0.1101","0.1413","","","","","","0.893","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107535","5.9037","0.0006","12.2672","0.0002","17.4319","0.001","90","","90","","90","","1262.45","0.15","150","1","150","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H11 Cl O3 -","- C15 H11 Cl O3 -","- C60 H44 Cl4 O12 -","4","1","","Zengming Shen; Hasan A. Khan; Vy M. Dong","Rh-Catalyzed Carbonyl Hydroacylation: An Enantioselective Approach to Lactones","Journal of the American Chemical Society","2008","130","","2916","2917","10.1021/ja7109025","","","0.71073","MoKα","","0.062","0.04","","","0.0904","0.1021","","","","","","1.045","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107536","13.735","0.003","5.6069","0.0011","16.015","0.003","90","","93.98","0.03","90","","1230.4","0.4","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O3 -","- C14 H18 O3 -","- C56 H72 O12 -","4","1","","Yang Li; Datong Song; Vy M. Dong","Palladium-Catalyzed Olefin Dioxygenation","Journal of the American Chemical Society","2008","130","","2962","2964","10.1021/ja711029u","","","0.71073","MoKα","","0.1159","0.0727","","","0.1778","0.2172","","","","","","1.026","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107537","11.5021","0.0005","13.2108","0.0009","20.0315","0.0013","99.997","0.005","91.157","0.004","114.8","0.005","2706.4","0.3","278","1","278","1","","","","","","","","5","P -1","-P 1","2","","","","- C24 H58 Co7 Cs2 O49 -","- C24 H16 Co7 Cs2 O49 -","- C48 H32 Co14 Cs4 O98 -","2","1","","Javier Campo; Larry R. Falvello; Isabel Mayoral; Fernando Palacio; Tatiana Soler; Milagros Tomás","Reversible Single-Crystal-to-Single-Crystal Cross-Linking of a Ribbon of Cobalt Citrate Cubanes To Form a 2D Net","Journal of the American Chemical Society","2008","130","","2932","2933","10.1021/ja711040s","","","0.71073","MoKα","","0.122","0.0584","","","0.1456","0.1576","","","","","","0.973","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107538","11.405","0.0005","13.0515","0.0009","18.4855","0.0009","101.734","0.005","95.682","0.004","115.79","0.005","2370.3","0.3","303","1","303","1","","","","","","","","5","P -1","-P 1","2","","","","- C48 H86 Co14 Cs4 O83 -","- C48 H32 Co14 Cs4 O83 -","- C48 H32 Co14 Cs4 O83 -","1","0.5","","Javier Campo; Larry R. Falvello; Isabel Mayoral; Fernando Palacio; Tatiana Soler; Milagros Tomás","Reversible Single-Crystal-to-Single-Crystal Cross-Linking of a Ribbon of Cobalt Citrate Cubanes To Form a 2D Net","Journal of the American Chemical Society","2008","130","","2932","2933","10.1021/ja711040s","","","0.71073","MoKα","","0.1377","0.086","","","0.1944","0.2174","","","","","","1.095","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107539","12.352","0.003","18.73","0.005","13.332","0.004","90","","107.041","0.01","90","","2949","1.4","296.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C24 H45 B Cl N O P2 Pd -","- C24 H45 B Cl N O P2 Pd -","- C96 H180 B4 Cl4 N4 O4 P8 Pd4 -","4","1","","Masaki Daini; Akihiko Yamamoto; Michinori Suginome","Palladium-Catalyzed trans- and cis-Carboboration of Alkynes Tethered to Chloroborane with Organozirconium Reagents: Ligand-Dependent Complementary Stereoselectivity","Journal of the American Chemical Society","2008","130","","2918","2919","10.1021/ja711160h","","","0.71075","MoKα","","","0.0248","","","","0.0266","","","","","","2.319","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107540","25.278","0.006","25.278","0.006","86.34","0.04","90","","90","","120","","47778","3","150","2","150","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","bis[di{(\±)-2,7,12-trimethoxy-3,8,13-tris (4-[4'-methyl-2,2'-bipyridyl]benzyloxy) -10,15-dihydro-5H-tribenzo[a,d,g]cyclononene}trinitrodizinc(II)] nitrate dimethylsulfoxide clathrate","","- C120 H108 N18 O30 Zn3 -","- C120 H108 N15 O21 Zn3 -","- C1440 H1296 N180 O252 Zn36 -","12","0.333333","","Aleema Westcott; Julie Fisher; Lindsay P. Harding; Pierre Rizkallah; Michaele J. Hardie","Self-Assembly of a 3-D Triply Interlocked Chiral [2]Catenane","Journal of the American Chemical Society","2008","130","","2950","2951","10.1021/ja8002149","","","0.7972","synchrotron","","0.1522","0.1","","","0.2731","0.3044","","","","","","1.023","","","","has coordinates","270822","2021-11-23","08:35:34",""
"4107541","8.7677","0.0012","11.3403","0.0015","13.3801","0.0019","65.288","0.015","88.908","0.017","76.609","0.016","1171.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(BDT-TTP)2[Re6S5Cl9]","bis (2,5-bis(1,3-dithiol-2-ylidene)-1,3,4,6-tetrathiapentalenium) penta-μ~eq~3-sulfido-tri-μ~eq~3-chloro-hexachloro-octahedro- hexarhenate(III)","","- C20 H8 Cl9 Re6 S21 -","- C20 H8 Cl8 Re6 S22 -","- C20 H8 Cl8 Re6 S22 -","1","0.5","","Sandrine Perruchas; Kamal Boubekeur; Enric Canadell; Yohji Misaki; Pascale Auban-Senzier; Claude Pasquier; Patrick Batail","Modulating the Framework Negative Charge Density in the System [BDT-TTP.+]/[Re6S5Cl91-]/[Re6(S/Se)6Cl82-]/[Re6S7Cl73-]: Templating by Isosteric Cluster Anions of Identical Symmetry and Shape, Variations of Incommensurate Band Filling, and Electronic Structure in 2D Metals","Journal of the American Chemical Society","2008","130","","3335","3348","10.1021/ja074774s","","","0.71073","MoKα","","0.0512","0.0421","","","0.0983","0.1007","","","","","","0.956","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107542","11.3494","0.0009","12.6428","0.0009","22.2207","0.0018","94.097","0.009","100.051","0.01","114.099","0.008","2829.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21.33 H10 Cl4.67 Re2 S16 Se2 -","- C21.3333 H10 Cl4.66667 Re2 S16 Se2 -","- C64 H30 Cl14 Re6 S48 Se6 -","3","1.5","","Sandrine Perruchas; Kamal Boubekeur; Enric Canadell; Yohji Misaki; Pascale Auban-Senzier; Claude Pasquier; Patrick Batail","Modulating the Framework Negative Charge Density in the System [BDT-TTP.+]/[Re6S5Cl91-]/[Re6(S/Se)6Cl82-]/[Re6S7Cl73-]: Templating by Isosteric Cluster Anions of Identical Symmetry and Shape, Variations of Incommensurate Band Filling, and Electronic Structure in 2D Metals","Journal of the American Chemical Society","2008","130","","3335","3348","10.1021/ja074774s","","","0.71073","MoKα","","0.0875","0.038","","","0.0729","0.0804","","","","","","0.777","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107543","11.4947","0.0011","12.7948","0.0011","22.1584","0.0018","94.162","0.01","100.039","0.01","114.313","0.01","2886.3","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H30 Cl14 Re6 S42 Se12 -","- C64 H30 Cl14 Re6 S42 Se12 -","- C64 H30 Cl14 Re6 S42 Se12 -","1","0.5","","Sandrine Perruchas; Kamal Boubekeur; Enric Canadell; Yohji Misaki; Pascale Auban-Senzier; Claude Pasquier; Patrick Batail","Modulating the Framework Negative Charge Density in the System [BDT-TTP.+]/[Re6S5Cl91-]/[Re6(S/Se)6Cl82-]/[Re6S7Cl73-]: Templating by Isosteric Cluster Anions of Identical Symmetry and Shape, Variations of Incommensurate Band Filling, and Electronic Structure in 2D Metals","Journal of the American Chemical Society","2008","130","","3335","3348","10.1021/ja074774s","","","0.71073","MoKα","","0.0881","0.0373","","","0.0785","0.0875","","","","","","0.785","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107544","11.5401","0.0012","13.4522","0.0014","22.28","0.002","74.815","0.012","80.498","0.012","81.427","0.013","3271.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(BDT-TTP)7(Re6S6Cl8)0.5(Re6S7Cl7)0.5(CH2Cl2)","heptakis (2,5-bis(1,3-dithiol-2-ylidene)-1,3,4,6-tetrathiapentalenium) hemi (hexa-μ~eq~3-sulfido-di-μ~eq~3-chloro-hexachloro-octahedro- hexarhenate(III)) hemi (hepta-μ~eq~3-sulfido-mono-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III)) dichloromethane solvate","","- C71 H30 Cl8 Re6 S64 -","- C71.02 H30.04 Cl8 Re6 S64 -","- C71.02 H30.04 Cl8 Re6 S64 -","1","0.5","","Sandrine Perruchas; Kamal Boubekeur; Enric Canadell; Yohji Misaki; Pascale Auban-Senzier; Claude Pasquier; Patrick Batail","Modulating the Framework Negative Charge Density in the System [BDT-TTP.+]/[Re6S5Cl91-]/[Re6(S/Se)6Cl82-]/[Re6S7Cl73-]: Templating by Isosteric Cluster Anions of Identical Symmetry and Shape, Variations of Incommensurate Band Filling, and Electronic Structure in 2D Metals","Journal of the American Chemical Society","2008","130","","3335","3348","10.1021/ja074774s","","","0.71073","MoKα","","0.0753","0.0395","","","0.1004","0.1063","","","","","","0.944","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107545","11.565","0.0012","13.4175","0.0015","22.334","0.002","74.967","0.012","80.415","0.012","81.408","0.013","3279.7","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(BDT-TTP)7(Re6Se6Cl8)0.35(Re6S7Cl7)0.65(CH2Cl2)","heptakis (2,5-bis(1,3-dithiol-2-ylidene)-1,3,4,6-tetrathiapentalenium) hemi (hexa-μ~eq~3-selenido-di-μ~eq~3-chloro-hexachloro-octahedro- hexarhenate(III)) hemi (hepta-μ~eq~3-sulfido-mono-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III)) dichloromethane solvate","","- C71 H30 Cl14 Re6 S56 Se2 -","- C71 H30 Cl13.68 Re6 S56 Se2.298 -","- C71 H30 Cl13.68 Re6 S56 Se2.298 -","1","0.5","","Sandrine Perruchas; Kamal Boubekeur; Enric Canadell; Yohji Misaki; Pascale Auban-Senzier; Claude Pasquier; Patrick Batail","Modulating the Framework Negative Charge Density in the System [BDT-TTP.+]/[Re6S5Cl91-]/[Re6(S/Se)6Cl82-]/[Re6S7Cl73-]: Templating by Isosteric Cluster Anions of Identical Symmetry and Shape, Variations of Incommensurate Band Filling, and Electronic Structure in 2D Metals","Journal of the American Chemical Society","2008","130","","3335","3348","10.1021/ja074774s","","","0.71073","MoKα","","0.089","0.0445","","","0.1174","0.1275","","","","","","0.893","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107546","12.6684","0.0011","13.9149","0.0013","21.533","0.002","73.653","0.011","81.648","0.011","78.566","0.01","3553.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(BDT-TTP)8[Re6S7Cl7].4(CH2Cl2)","octakis (2,5-bis(1,3-dithiol-2-ylidene)-1,3,4,6-tetrathiapentalenium) hepta-μ~eq~3-sulfido-mono-μ~eq~3-chloro-hexachloro-octahedro- hexarhenate(III) tetrakis dichloromethane solvate","","- C84 H40 Cl15 Re6 S71 -","- C84 H40 Cl14 Re6 S72 -","- C84 H40 Cl14 Re6 S72 -","1","0.5","","Sandrine Perruchas; Kamal Boubekeur; Enric Canadell; Yohji Misaki; Pascale Auban-Senzier; Claude Pasquier; Patrick Batail","Modulating the Framework Negative Charge Density in the System [BDT-TTP.+]/[Re6S5Cl91-]/[Re6(S/Se)6Cl82-]/[Re6S7Cl73-]: Templating by Isosteric Cluster Anions of Identical Symmetry and Shape, Variations of Incommensurate Band Filling, and Electronic Structure in 2D Metals","Journal of the American Chemical Society","2008","130","","3335","3348","10.1021/ja074774s","","","0.71073","MoKα","","0.0708","0.0484","","","0.1449","0.1521","","","","","","1.078","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107547","10.044","0.0001","14.0914","0.0001","14.4291","0.0002","67.055","0.001","87.208","0.001","84.651","0.001","1872.27","0.04","295","2","295","2","","","","","","","","7","P -1","-P 1","2","3","","","- C36 H32 F10 Ir N6 O P -","- C36 H32 F10 Ir N6 O P -","- C72 H64 F20 Ir2 N12 O2 P2 -","2","1","","Hai-Ching Su; Hsiao-Fan Chen; Fu-Chuan Fang; Chih-Che Liu; Chung-Chih Wu; Ken-Tsung Wong; Yi-Hung Liu; Shie-Ming Peng","Solid-State White Light-Emitting Electrochemical Cells Using Iridium-Based Cationic Transition Metal Complexes","Journal of the American Chemical Society","2008","130","","3413","3419","10.1021/ja076051e","","","0.71073","MoKα","","0.0388","0.0339","","","0.0893","0.0955","","","","","","1.092","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107548","13.91","0.0002","13.0166","0.0002","19.9665","0.0004","90","","107.872","0.001","90","","3440.7","0.1","295","2","295","2","","","","","","","","6","C 1 c 1","C -2yc","9","4","","","- C40 H28 F6 Ir N4 P -","- C40 H28 F6 Ir N4 P -","- C160 H112 F24 Ir4 N16 P4 -","4","1","","Hai-Ching Su; Hsiao-Fan Chen; Fu-Chuan Fang; Chih-Che Liu; Chung-Chih Wu; Ken-Tsung Wong; Yi-Hung Liu; Shie-Ming Peng","Solid-State White Light-Emitting Electrochemical Cells Using Iridium-Based Cationic Transition Metal Complexes","Journal of the American Chemical Society","2008","130","","3413","3419","10.1021/ja076051e","","","0.71073","MoKα","","0.0531","0.0417","","","0.0989","0.1162","","","","","","1.14","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107549","7.4797","0.0004","11.3176","0.0005","19.4469","0.0008","90","","102.229","0.003","90","","1608.87","0.13","296.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 N O2 S -","- C18 H23 N O2 S -","- C72 H92 N4 O8 S4 -","4","1","","Takanori Shibata; Yu-ki Tahara; Kohei Tamura; Kohei Endo","Enantioselective Syntheses of Various Chiral Multicyclic Compounds with Quaternary Carbon Stereocenters by Catalytic Intramolecular Cycloaddition","Journal of the American Chemical Society","2008","130","","3451","3457","10.1021/ja0762083","","","1.54187","CuKα","","","0.0647","","","","0.1599","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107550","11.9248","0.0018","18.516","0.003","19.469","0.003","63.644","0.004","76.885","0.003","71.259","0.003","3629.6","1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","[Cu(PNP)-(PNP)Cu]2+","","","- C68 H96 B2 Cl2 Cu2 F8 N2 P4 -","- C68 H96 B2 Cl2 Cu2 F8 N2 P4 -","- C136 H192 B4 Cl4 Cu4 F16 N4 P8 -","2","1","","Seth B. Harkins; Neal P. Mankad; Alexander J. M. Miller; Robert K. Szilagyi; Jonas C. Peters","Probing the Electronic Structures of [Cu2(μ-XR2)]n+ Diamond Cores as a Function of the Bridging X Atom (X = N or P) and Charge (n= 0, 1, 2)","Journal of the American Chemical Society","2008","130","","3478","3485","10.1021/ja076537v","","","0.71073","MoKα","","0.1866","0.0928","","","0.2405","0.298","","","","","","0.961","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107551","23.078","0.002","18.2536","0.0018","19.151","0.002","90","","94.816","0.002","90","","8039","1.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","{(PNP-2)Cu}2","","","- C80 H136 Cu2 N2 O2 P4 -","- C80 H136 Cu2 N2 O2 P4 -","- C320 H544 Cu8 N8 O8 P16 -","4","1","","Seth B. Harkins; Neal P. Mankad; Alexander J. M. Miller; Robert K. Szilagyi; Jonas C. Peters","Probing the Electronic Structures of [Cu2(μ-XR2)]n+ Diamond Cores as a Function of the Bridging X Atom (X = N or P) and Charge (n= 0, 1, 2)","Journal of the American Chemical Society","2008","130","","3478","3485","10.1021/ja076537v","","x-ray","0.71073","MoKα","","0.1644","0.0594","","","0.1007","0.1209","","","","","","1.006","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107552","19.101","0.003","21.849","0.003","20.734","0.005","90","","90.717","0.014","90","","8652","3","100","2","100","2","","","","","","","","8","C 1 c 1","C -2yc","9","[{(PNP2)Cu}2][SbF6]2, 2 CH2Cl2","","","- C74 H124 Cl4 Cu2 F12 N2 P4 Sb2 -","- C74 H124 Cl4 Cu2 F12 N2 P4 Sb2 -","- C296 H496 Cl16 Cu8 F48 N8 P16 Sb8 -","4","1","","Seth B. Harkins; Neal P. Mankad; Alexander J. M. Miller; Robert K. Szilagyi; Jonas C. Peters","Probing the Electronic Structures of [Cu2(μ-XR2)]n+ Diamond Cores as a Function of the Bridging X Atom (X = N or P) and Charge (n= 0, 1, 2)","Journal of the American Chemical Society","2008","130","","3478","3485","10.1021/ja076537v","","x-ray","0.71073","MoKα","","0.1041","0.0532","","","0.0963","0.1085","","","","","","1.179","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107553","15.8951","0.0008","14.5628","0.0008","18.0542","0.001","90","","92.806","0.002","90","","4174.1","0.4","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","{(PNP)Cu}2{SbF6}","","","- C72 H120 Cl Cu2 F6 N2 P4 Sb -","- C74 H124 Cl4 Cu1.9744 F6 N2.061 P4 Sb -","- C148 H248 Cl8 Cu3.9488 F12 N4.122 P8 Sb2 -","2","1","","Seth B. Harkins; Neal P. Mankad; Alexander J. M. Miller; Robert K. Szilagyi; Jonas C. Peters","Probing the Electronic Structures of [Cu2(μ-XR2)]n+ Diamond Cores as a Function of the Bridging X Atom (X = N or P) and Charge (n= 0, 1, 2)","Journal of the American Chemical Society","2008","130","","3478","3485","10.1021/ja076537v","","","0.71073","MoKα","","0.0915","0.0615","","","0.0913","0.0949","","","","","","1.581","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107554","6.1938","0.0008","10.7636","0.0014","19.644","0.003","90","","91.99","0.003","90","","1308.8","0.3","143","1","143","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H38 O7 -","- C27 H38 O7 -","- C54 H76 O14 -","2","1","","Hongmei Li; Patrick J. Carroll; Patrick J. Walsh","Generation and Tandem Reactions of 1-Alkenyl-1,1-Heterobimetallics: Practical and Versatile Reagents for Organic Synthesis","Journal of the American Chemical Society","2008","130","","3521","3531","10.1021/ja077664u","","","0.71069","MoKα","","0.0556","0.0351","","","0.0606","0.0711","","","","","","0.769","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107555","8.7021","0.0015","9.4331","0.0015","10.3597","0.0018","90","","105.999","0.004","90","","817.5","0.2","143","1","143","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C38 H44 O6 -","2","1","","Hongmei Li; Patrick J. Carroll; Patrick J. Walsh","Generation and Tandem Reactions of 1-Alkenyl-1,1-Heterobimetallics: Practical and Versatile Reagents for Organic Synthesis","Journal of the American Chemical Society","2008","130","","3521","3531","10.1021/ja077664u","","","0.71069","MoKα","","0.0437","0.0302","","","0.0596","0.0636","","","","","","0.859","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107556","6.4508","0.0013","14.332","0.003","38.051","0.008","90","","90","","90","","3517.9","1.3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H21 Br N2 O -","- C21 H21 Br N2 O -","- C168 H168 Br8 N16 O8 -","8","2","","Robert T. Yu; Tomislav Rovis","Asymmetric Synthesis of Bicyclic Amidines via Rhodium-Catalyzed [2+2+2] Cycloaddition of Carbodiimides","Journal of the American Chemical Society","2008","130","","3262","3263","10.1021/ja710065h","","","0.71073","MoKα","","0","0.0705","","","0.1039","0.1405","","","","","","0.923","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107557","18.888","0.003","13.641","0.002","21.276","0.004","90","","113.504","0.002","90","","5027","1.4","123.2","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C55 H75 Cl Fe2 N P2 Rh -","- C55 H75 Cl Fe2 N P2 Rh -","- C220 H300 Cl4 Fe8 N4 P8 Rh4 -","4","1","","Denise A. Colby; Robert G. Bergman; Jonathan A. Ellman","Synthesis of Dihydropyridines and Pyridines from Imines and Alkynes via C-H Activation","Journal of the American Chemical Society","2008","130","","3645","3651","10.1021/ja7104784","","","0.7107","MoKα","","0.0866","0.0404","","0.053","","0.0433","","","","","","1.27","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107558","9.0412","0.0002","14.243","0.0003","15.6092","0.0004","90","","105.103","0.001","90","","1940.63","0.08","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H33 N O W -","- C19 H33 N O W -","- C76 H132 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.0222","0.0178","","","0.0411","0.0423","","","","","","1.08","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107559","8.9209","0.0005","18.9252","0.0009","11.3669","0.0006","90","","90.286","0.003","90","","1919.05","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H33 N O W -","- C19 H33 N O W -","- C76 H132 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.0316","0.0232","","","0.0495","0.0526","","","","","","1.038","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107560","8.1936","0.0004","15.3514","0.0008","14.9078","0.0007","90","","90.02","0.001","90","","1875.15","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H30 N O P W -","- C17 H30 N O P W -","- C68 H120 N4 O4 P4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.0284","0.0216","","","0.051","0.0536","","","","","","1.014","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107561","11.7746","0.0016","9.4294","0.0013","14.829","0.002","90","","99.83","0.007","90","","1622.3","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H27 N O W -","- C16 H27 N O W -","- C64 H108 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.032","0.0211","","","0.0457","0.0498","","","","","","1.064","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107562","9.2125","0.0008","14.4236","0.0012","14.8434","0.0003","90","","107.809","0.004","90","","1877.8","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H31 N O2 W -","- C19 H31 N O2 W -","- C76 H124 N4 O8 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.0309","0.0256","","","0.0665","0.0694","","","","","","1.059","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107563","10.2949","0.0009","12.0055","0.0013","13.5878","0.0014","90","","98.512","0.005","90","","1660.9","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H27 N O W -","- C18 H27 N O W -","- C72 H108 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.0215","0.0186","","","0.0446","0.0464","","","","","","1.063","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107564","30.129","0.003","9.0268","0.0009","17.0499","0.0013","90","","108.735","0.003","90","","4391.3","0.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H37 N O1.5 W -","- C22 H37 N O1.5 W -","- C176 H296 N8 O12 W8 -","8","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.053","0.0322","","","0.0726","0.0827","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107565","8.7093","0.0003","13.8379","0.0005","15.7822","0.0006","90","","90","","90","","1902.05","0.12","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H29 N O W -","- C21 H29 N O W -","- C84 H116 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter M. Graham; Christopher J. Semiao; Scott P. Semproni; Simon J. Kim; Peter Legzdins","Facile and Selective Aliphatic C-H Bond Activation at Ambient Temperatures Initiated by Cp*W(NO)(CH2CMe3)(η3-CH2CHCHMe)","Journal of the American Chemical Society","2008","130","","3652","3663","10.1021/ja710606v","","","0.71073","MoKα","","0.0364","0.0273","","","0.0553","0.0581","","","","","","1.087","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107566","19.183","0.006","11.709","0.004","14.676","0.003","90","","110.738","0.008","90","","3082.9","1.6","128","2","128","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 Cl N Ni O P2 -","- C30 H48 Cl N Ni O P2 -","- C120 H192 Cl4 N4 Ni4 O4 P8 -","4","1","","Debashis Adhikari; Susanne Mossin; Falguni Basuli; John C. Huffman; Robert K. Szilagyi; Karsten Meyer; Daniel J. Mindiola","Structural, Spectroscopic, and Theoretical Elucidation of a Redox-Active Pincer-Type Ancillary Applied in Catalysis","Journal of the American Chemical Society","2008","130","","3676","3682","10.1021/ja7108486","","","0.71073","MoKα","","0.0549","0.0334","","","0.0646","0.0695","","","","","","0.82","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107567","16.1813","0.0017","11.1442","0.001","15.5555","0.0016","90","","106.818","0.002","90","","2685.1","0.5","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 Cl N Ni P2 -","- C26 H40 Cl N Ni P2 -","- C104 H160 Cl4 N4 Ni4 P8 -","4","1","","Debashis Adhikari; Susanne Mossin; Falguni Basuli; John C. Huffman; Robert K. Szilagyi; Karsten Meyer; Daniel J. Mindiola","Structural, Spectroscopic, and Theoretical Elucidation of a Redox-Active Pincer-Type Ancillary Applied in Catalysis","Journal of the American Chemical Society","2008","130","","3676","3682","10.1021/ja7108486","","","0.71073","MoKα","","0.0594","0.0376","","","0.0786","0.0845","","","","","","0.891","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107568","10.9057","0.0009","18.8042","0.0015","14.79","0.0011","90","","92.51","0.002","90","","3030.1","0.4","132","2","132","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C27 H40 Cl F3 N Ni O3 P2 S -","- C27 H40 Cl F3 N Ni O3 P2 S -","- C108 H160 Cl4 F12 N4 Ni4 O12 P8 S4 -","4","1","","Debashis Adhikari; Susanne Mossin; Falguni Basuli; John C. Huffman; Robert K. Szilagyi; Karsten Meyer; Daniel J. Mindiola","Structural, Spectroscopic, and Theoretical Elucidation of a Redox-Active Pincer-Type Ancillary Applied in Catalysis","Journal of the American Chemical Society","2008","130","","3676","3682","10.1021/ja7108486","","","0.71073","MoKα","","0.0618","0.0338","","","0.0626","0.068","","","","","","0.806","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107569","8.0105","0.0007","10.8432","0.0009","13.9873","0.0012","108.915","0.001","97.109","0.001","101.647","0.001","1101.94","0.16","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H20 Cl N O4 -","- C26 H20 Cl N O4 -","- C52 H40 Cl2 N2 O8 -","2","1","","Johanna R. Perkins; Rich G. Carter","Synthesis of Programmable Tetra-ortho-Substituted Biaryl Compounds Using Diels-Alder Cycloadditions/Cycloreversions of Disubstituted Alkynyl Stannanes","Journal of the American Chemical Society","2008","130","","3290","3291","10.1021/ja7113486","","","0.71073","MoKα","","0.0542","0.0461","","","0.1119","0.1181","","","","","","1.034","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107570","4.03533","0.00004","4.03533","0.00004","8.7409","0.00009","90","","90","","90","","142.336","0.002","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- As Fe La O -","- As Fe La O -","- As2 Fe2 La2 O2 -","2","0.125","","Yoichi Kamihara; Takumi Watanabe; Masahiro Hirano; Hideo Hosono","Iron-Based Layered Superconductor La[O1-xFx]FeAs (x = 0.05-0.12) with Tc = 26 K","Journal of the American Chemical Society","2008","130","","3296","3297","10.1021/ja800073m","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107571","12.6342","0.001","11.5762","0.0009","14.1871","0.0011","90","","113.475","0.001","90","","1903.2","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H50 B2 N4 -","- C42 H50 B2 N4 -","- C84 H100 B4 N8 -","2","0.5","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Yaoming Xie; Chaitanya S. Wannere; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","Planar, Twisted, and Trans-Bent: Conformational Flexibility of Neutral Diborenes","Journal of the American Chemical Society","2008","130","","3298","3299","10.1021/ja800257j","","","0.71073","MoKα","","0.1108","0.0683","","","0.2029","0.2393","","","","","","1.031","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107572","8.5126","0.0006","13.0601","0.0009","17.4722","0.0012","87.714","0.001","85.218","0.001","84.179","0.001","1924.8","0.2","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H50 B2 N4 -","- C42 H50 B2 N4 -","- C84 H100 B4 N8 -","2","1","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Yaoming Xie; Chaitanya S. Wannere; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","Planar, Twisted, and Trans-Bent: Conformational Flexibility of Neutral Diborenes","Journal of the American Chemical Society","2008","130","","3298","3299","10.1021/ja800257j","","","0.71073","MoKα","","0.0962","0.0631","","","0.1782","0.2075","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107573","12.7212","0.0019","11.4045","0.0017","14.332","0.002","90","","114.377","0.002","90","","1893.9","0.5","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H50 B2 N4 -","- C42 H50 B2 N4 -","- C84 H100 B4 N8 -","2","0.5","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Yaoming Xie; Chaitanya S. Wannere; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","Planar, Twisted, and Trans-Bent: Conformational Flexibility of Neutral Diborenes","Journal of the American Chemical Society","2008","130","","3298","3299","10.1021/ja800257j","","","0.71073","MoKα","","0.1136","0.0692","","","0.1982","0.2393","","","","","","1.027","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107574","32.1297","0.0019","10.7328","0.0006","23.9977","0.0015","90","","102.22","0.001","90","","8087.9","0.8","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H52 B2 N4 -","- C42 H52 B2 N4 -","- C336 H416 B16 N32 -","8","1","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Yaoming Xie; Chaitanya S. Wannere; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","Planar, Twisted, and Trans-Bent: Conformational Flexibility of Neutral Diborenes","Journal of the American Chemical Society","2008","130","","3298","3299","10.1021/ja800257j","","","0.71073","MoKα","","0.127","0.0607","","","0.1527","0.1999","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107575","9.285","0.0003","10.324","0.0003","17.401","0.0006","73.611","0.001","78.185","0.002","82.979","0.001","1562.66","0.09","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H17 Co2 O7 -","- C14 H17.5 Co2 O7 -","- C56 H70 Co8 O28 -","4","2","","Jacob Overgaard; Henrik F. Clausen; Jamie A. Platts; Bo B. Iversen","Experimental and Theoretical Charge Density Study of Chemical Bonding in a Co Dimer Complex","Journal of the American Chemical Society","2008","130","","3834","3843","10.1021/ja076152c","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107576","9.3125","0.0003","10.3768","0.0003","17.4885","0.0006","73.477","0.001","78.215","0.002","83.078","0.001","1582.53","0.09","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 Co2 O7 -","- C14 H12 Co2 O7 -","- C56 H48 Co8 O28 -","4","2","","Jacob Overgaard; Henrik F. Clausen; Jamie A. Platts; Bo B. Iversen","Experimental and Theoretical Charge Density Study of Chemical Bonding in a Co Dimer Complex","Journal of the American Chemical Society","2008","130","","3834","3843","10.1021/ja076152c","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107577","13.009","0.002","13.146","0.002","19.688","0.004","80.526","0.003","86.782","0.003","74.29","0.002","3196.7","0.9","150","2","150","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H100 O Si4 Y4 -","- C52 H100 O Si4 Y4 -","- C104 H200 O2 Si8 Y8 -","2","1","","Muhammed Yousufuddin; Matthias J. Gutmann; Jens Baldamus; Olivier Tardif; Zhaomin Hou; Sax A. Mason; Garry J. McIntyre; Robert Bau","Neutron Diffraction Studies on a 4-Coordinate Hydrogen Atom in an Yttrium Cluster","Journal of the American Chemical Society","2008","130","","3888","3891","10.1021/ja076520c","","neutron","","white-beam","","0.1534","0.1094","","","0.2347","0.2501","","","","","","1.494","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107578","12.988","0.002","13.134","0.002","19.626","0.003","80.443","0.011","86.673","0.01","74.379","0.01","3179.2","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H100 O Si4 Y4 -","- C52 H100 O Si4 Y4 -","- C104 H200 O2 Si8 Y8 -","2","1","","Muhammed Yousufuddin; Matthias J. Gutmann; Jens Baldamus; Olivier Tardif; Zhaomin Hou; Sax A. Mason; Garry J. McIntyre; Robert Bau","Neutron Diffraction Studies on a 4-Coordinate Hydrogen Atom in an Yttrium Cluster","Journal of the American Chemical Society","2008","130","","3888","3891","10.1021/ja076520c","","neutron","","neutron","","0.0885","0.0885","","","0.224","0.224","","","","","","1.025","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107579","32.461","0.007","4.1267","0.0008","20.067","0.004","90","","107.58","0.03","90","","2562.6","1","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 N2 -","- C18 H10 N2 -","- C144 H80 N16 -","8","2","","Lang Jiang; Yanyan Fu; Hongxiang Li; Wenping Hu","Single-Crystalline, Size, and Orientation Controllable Nanowires and Ultralong Microwires of Organic Semiconductor with Strong Photoswitching Property","Journal of the American Chemical Society","2008","130","","3937","3941","10.1021/ja077600j","","","0.71073","MoKα","","0.0807","0.0677","","","0.1458","0.1532","","","","","","1.143","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107580","11.3316","0.001","14.4199","0.0013","21.2689","0.0019","90","","101.789","0.001","90","","3402","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H36 N3 O3 Si -","- C45 H36 N3 O3 Si -","- C180 H144 N12 O12 Si4 -","4","1","","Sushanta K. Pal; Mikhail E. Itkis; Fook S. Tham; Robert W. Reed; Richard T. Oakley; Robert C. Haddon","Trisphenalenyl-Based Neutral Radical Molecular Conductor","Journal of the American Chemical Society","2008","130","","3942","3951","10.1021/ja077771o","","","0.71073","MoKα","","0.0914","0.0543","","","0.1357","0.1568","","","","","","1.024","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107581","11.4019","0.0016","14.563","0.002","21.455","0.003","90","","102.095","0.002","90","","3483.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H36 N3 O3 Si -","- C45 H36 N3 O3 Si -","- C180 H144 N12 O12 Si4 -","4","1","","Sushanta K. Pal; Mikhail E. Itkis; Fook S. Tham; Robert W. Reed; Richard T. Oakley; Robert C. Haddon","Trisphenalenyl-Based Neutral Radical Molecular Conductor","Journal of the American Chemical Society","2008","130","","3942","3951","10.1021/ja077771o","","","0.71073","MoKα","","0.0818","0.0481","","","0.1179","0.1396","","","","","","1.031","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107582","11.3113","0.0017","15.823","0.003","17.556","0.003","82.735","0.003","75.471","0.003","77.532","0.004","2961.2","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C75 H65 B N6 O3 Si -","- C75 H65 B N6 O3 Si -","- C150 H130 B2 N12 O6 Si2 -","2","1","","Sushanta K. Pal; Mikhail E. Itkis; Fook S. Tham; Robert W. Reed; Richard T. Oakley; Robert C. Haddon","Trisphenalenyl-Based Neutral Radical Molecular Conductor","Journal of the American Chemical Society","2008","130","","3942","3951","10.1021/ja077771o","","","0.71073","MoKα","","0.1257","0.0804","","","0.1975","0.2221","","","","","","1.037","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107583","11.042","0.002","12.246","0.002","13.931","0.003","90","","90","","90","","1883.8","0.6","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 Br N O5 -","- C20 H20 Br N O5 -","- C80 H80 Br4 N4 O20 -","4","1","","Stephen K. Jackson; Avedis Karadeolian; Alex B. Driega; Michael A. Kerr","Stereodivergent Methodology for the Synthesis of Complex Pyrrolidines","Journal of the American Chemical Society","2008","130","","4196","4201","10.1021/ja710289k","","","0.71073","MoKα","","0.0426","0.0337","","","0.0739","0.0784","","","","","","1.047","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107584","7.6974","0.0011","8.6969","0.0008","10.5278","0.0011","101.214","0.01","96.25","0.013","113.316","0.012","621.2","0.15","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 O2 S2 -","- C14 H12 O2 S2 -","- C28 H24 O4 S4 -","2","1","","Edward L. Clennan; Chen Liao","Role of Sulfide Radical Cations in Electron Transfer Promoted Molecular Oxygenations at Sulfur","Journal of the American Chemical Society","2008","130","","4057","4068","10.1021/ja710301s","","","0.71073","MoKα","","0.0403","0.0364","","","0.1015","0.105","","","","","","1.074","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107585","9.2865","0.0019","9.557","0.002","11.18","0.002","76.516","0.003","68.717","0.003","79.799","0.003","894.4","0.3","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H15 B F2 I N3 O -","- C17 H15 B F2 I N3 O -","- C34 H30 B2 F4 I2 N6 O2 -","2","1","","Liangxing Wu; Kevin Burgess","Syntheses of Highly Fluorescent GFP-Chromophore Analogues","Journal of the American Chemical Society","2008","130","","4089","4096","10.1021/ja710388h","","","0.71073","MoKα","","0.0379","0.0327","","","0.0778","0.0804","","","","","","1.075","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107586","7.0047","0.0007","21.173","0.002","24.097","0.002","90","","95.857","0.005","90","","3555.2","0.6","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 B F2 N4 O4.28 -","- C17 H15 B F2 N4 O4.27 -","- C136 H120 B8 F16 N32 O34.16 -","8","2","","Liangxing Wu; Kevin Burgess","Syntheses of Highly Fluorescent GFP-Chromophore Analogues","Journal of the American Chemical Society","2008","130","","4089","4096","10.1021/ja710388h","","","1.54178","CuKα","","0.1332","0.0651","","","0.1671","0.2069","","","","","","0.968","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107587","17.62","0.0006","6.4103","0.0002","15.8821","0.0006","90","","111.721","0.002","90","","1666.5","0.1","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 B F2 I N3 O -","- C17 H15 B F2 I N3 O -","- C68 H60 B4 F8 I4 N12 O4 -","4","1","","Liangxing Wu; Kevin Burgess","Syntheses of Highly Fluorescent GFP-Chromophore Analogues","Journal of the American Chemical Society","2008","130","","4089","4096","10.1021/ja710388h","","","1.54178","CuKα","","0.0355","0.0339","","","0.0875","0.0884","","","","","","1.041","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107588","7.2703","0.0004","14.6609","0.0009","15.5558","0.0009","76.599","0.005","86.107","0.003","86.382","0.003","1607.29","0.17","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H15 B F2 N4 O3 -","- C17 H15 B F2 N4 O3 -","- C68 H60 B4 F8 N16 O12 -","4","2","","Liangxing Wu; Kevin Burgess","Syntheses of Highly Fluorescent GFP-Chromophore Analogues","Journal of the American Chemical Society","2008","130","","4089","4096","10.1021/ja710388h","","","1.54178","CuKα","","0.0502","0.0403","","","0.1041","0.1077","","","","","","1.007","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107589","13.426","0.002","19.555","0.002","13.641","0.002","90","","90.277","0.002","90","","3581.3","0.8","301","1","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 N7 O15 Tb -","- C30 H36 N7 O15 Tb -","- C120 H144 N28 O60 Tb4 -","4","1","","Ga-Lai Law; Ka-Leung Wong; Cornelia Wing-Yin Man; Wing-Tak Wong; Sai-Wah Tsao; Michael Hon-Wah Lam; Paul Kwan-Sing Lam","Emissive Terbium Probe for Multiphoton in Vitro Cell Imaging","Journal of the American Chemical Society","2008","130","","3714","3715","10.1021/ja710418d","","","0.71073","MoKα","","","0.032","","","","0.033","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107590","18.761","0.004","18.761","0.004","18.761","0.004","90","","90","","90","","6603","2","298","2","298","2","","","","","","","","7","I m -3 m","-I 4 2 3","229","","","","- C1.5 H0.5 In0.125 K0.16 N0.58 Na0.045 O1.36 -","- C1.5 H0.5 In0.125 K0.16 N0.58 Na0.045 O1.36 -","- C144 H48 In12 K15.36 N55.68 Na4.32 O130.56 -","96","1","","Dorina F. Sava; Victor Ch. Kravtsov; Farid Nouar; Lukasz Wojtas; Jarrod F. Eubank; Mohamed Eddaoudi","Quest for Zeolite-like Metal-Organic Frameworks: On Pyrimidinecarboxylate Bis-Chelating Bridging Ligands","Journal of the American Chemical Society","2008","130","","3768","3770","10.1021/ja710616j","","","0.71073","MoKα","","0.0462","0.0436","","","0.1252","0.1277","","","","","","1.173","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107591","30.07","0.007","30.07","0.007","30.07","0.007","90","","90","","90","","27189","11","100","2","100","2","","","","","","","","5","I m -3 m","-I 4 2 3","229","","","","- C5.7 H3 Cd0.5 N2.35 O4.68 -","- C5.7 H3 Cd0.5 N2.35 O4.67992 -","- C547.2 H288 Cd48 N225.6 O449.272 -","96","1","","Dorina F. Sava; Victor Ch. Kravtsov; Farid Nouar; Lukasz Wojtas; Jarrod F. Eubank; Mohamed Eddaoudi","Quest for Zeolite-like Metal-Organic Frameworks: On Pyrimidinecarboxylate Bis-Chelating Bridging Ligands","Journal of the American Chemical Society","2008","130","","3768","3770","10.1021/ja710616j","","","0.71073","MoKα","","0.1024","0.0771","","","0.19","0.2053","","","","","","1.123","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107592","12.1454","0.0003","12.1454","0.0003","27.8101","0.0016","90","","90","","90","","4102.3","0.3","293","2","293","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C44.5 H12.5 Cl1.5 F20 O4 S2 -","- C44.5 H8 Cl1.52 F20 O4 S2 -","- C178 H32 Cl6.08 F80 O16 S8 -","4","0.25","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Planar Meso Pentafluorophenyl Core Modified Isophlorins","Journal of the American Chemical Society","2008","130","","3718","3719","10.1021/ja710664y","","","0.71073","MoKα","","0.0635","0.0593","","","0.1938","0.2017","","","","","","1.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107593","19.8252","0.0005","19.8252","0.0005","24.8223","0.0009","90","","90","","120","","8449","0.4","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C44 H8 F20 O4 -","- C44 H8 F20 O4 -","- C396 H72 F180 O36 -","9","0.5","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Planar Meso Pentafluorophenyl Core Modified Isophlorins","Journal of the American Chemical Society","2008","130","","3718","3719","10.1021/ja710664y","","","0.71073","MoKα","","0.0514","0.0359","","","0.0877","0.1041","","","","","","1.046","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107594","15.3492","0.0003","17.765","0.0004","34.5444","0.0007","90","","90.028","0.001","90","","9419.5","0.3","120","2","120","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","dmc4abr","","","- C48 H60 Br4 Cl4 -","- C48 H60 Br4 Cl4 -","- C384 H480 Br32 Cl32 -","8","1","","Maria H. Filby; Sara Jane Dickson; Nelsi Zaccheroni; Luca Prodi; Sara Bonacchi; Marco Montalti; Martin J. Paterson; Terry D. Humphries; Claudio Chiorboli; Jonathan W. Steed","Induced Fit Interanion Discrimination by Binding-Induced Excimer Formation","Journal of the American Chemical Society","2008","130","","4105","4113","10.1021/ja711012d","","","0.71073","MoKα","","0.1365","0.0642","","","0.1291","0.1537","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107595","31.0675","0.0008","18.4074","0.0005","39.2606","0.0009","90","","99.287","0.001","90","","22157.7","1","98","2","98","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Chlorodiphenylsilyldisilene","1-Chloro(diphenyl)silyl-1,2,2-tris(2',4',6'-triisopropylphenyl)disilene","","- C233 H328 Cl4 Si12 -","- C233 H328 Cl4 Si12 -","- C932 H1312 Cl16 Si48 -","4","1","","Kai Abersfelder; David Scheschkewitz","Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane","Journal of the American Chemical Society","2008","130","","4114","4121","10.1021/ja711169w","","","0.71073","MoKα","","0.072","0.0508","","","0.1226","0.1376","","","","","","1.054","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107596","14.135","0.001","17.7858","0.0013","20.6446","0.0015","69.997","0.001","75.569","0.001","89.749","0.002","4704.4","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","Tip3Me2-Chlorocyclotrisilan","rac-1-Chloro-1,2,2-tris(2,4,6-triisopropylpheny)-3,3-methyl- cyclotrisilan","","- C47 H75 Cl Si3 -","- C47 H75 Cl Si3 -","- C188 H300 Cl4 Si12 -","4","2","","Kai Abersfelder; David Scheschkewitz","Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane","Journal of the American Chemical Society","2008","130","","4114","4121","10.1021/ja711169w","","","0.71073","MoKα","","0.0794","0.0645","","","0.1419","0.1483","","","","","","1.123","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107597","10.874","0.0005","15.4908","0.0008","34.2768","0.0017","90","","90","","90","","5773.8","0.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Tip3Ph2-Chlorocyclotrisilan","[S]-1-Chlor-1,2,2-tris(2',4',6'-triisopropylphenyl)-3,3-diphenylcyclotrisilan","","- C61 H87 Cl O Si3 -","- C61 H87 Cl O Si3 -","- C244 H348 Cl4 O4 Si12 -","4","1","","Kai Abersfelder; David Scheschkewitz","Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane","Journal of the American Chemical Society","2008","130","","4114","4121","10.1021/ja711169w","","","0.71073","MoKα","","0.0684","0.0671","","","0.1542","0.1548","","","","","","1.307","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107598","12.9877","0.0009","13.6085","0.001","19.7857","0.0014","99.423","0.002","100.153","0.002","112.956","0.001","3063.6","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Tip3Ph2-Cyclotrisilanid","rac-1,2,2-Tris(2,4,6-triisopropylpheny)-3,3-phenylcyclotrisilanid","","- C64 H96 Li O Si3 -","- C64 H96 Li O Si3 -","- C128 H192 Li2 O2 Si6 -","2","1","","Kai Abersfelder; David Scheschkewitz","Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane","Journal of the American Chemical Society","2008","130","","4114","4121","10.1021/ja711169w","","","0.71073","MoKα","","0.0661","0.0524","","","0.1235","0.1307","","","","","","1.031","","","","has coordinates,has disorder","178821","2020-10-21","18:00:00",""
"4107599","13.0569","0.0004","16.6258","0.0004","17.0696","0.0005","84.847","0.001","86.065","0.001","85.138","0.001","3670.28","0.18","97","2","97","2","","","","","","","","6","P -1","-P 1","2","SSIP-Diphenylcyclotrisilanide","[Lithum(Cryptand-2.1.1)][3,3-Diphenyl-1,2,2-(2',4',6'- triisopropylphenyl)cyclotrisilan-1-ide]","","- C78 H115 Li N2 O4 Si3 -","- C78 H115 Li N2 O4 Si3 -","- C156 H230 Li2 N4 O8 Si6 -","2","1","","Kai Abersfelder; David Scheschkewitz","Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane","Journal of the American Chemical Society","2008","130","","4114","4121","10.1021/ja711169w","","","0.71073","MoKα","","0.044","0.0364","","","0.0854","0.0901","","","","","","1.025","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107600","13.3185","0.0008","15.7123","0.0009","18.0837","0.0011","78.6948","0.0014","75.7526","0.0013","76.4736","0.0013","3527.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","Trisilaindane","rac-trans-1-Chloro-1-Phenyl-2,2,3-tris(2',4',6'- triisopropylphenyl)-1,2,3-trisilaindane","","- C75 H115 Cl Si3 -","- C75 H115 Cl Si3 -","- C150 H230 Cl2 Si6 -","2","1","","Kai Abersfelder; David Scheschkewitz","Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane","Journal of the American Chemical Society","2008","130","","4114","4121","10.1021/ja711169w","","","0.71073","MoKα","","0.0856","0.0696","","","0.158","0.166","","","","","","1.107","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107601","9.432","0.003","21.511","0.005","7.7569","0.0019","90","","90","","90","","1573.8","0.7","120","2","120","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C8 H14 O2 -","- C8 H14 O2 -","- C64 H112 O16 -","8","1","","Maksim Royzen; Glenn P. A. Yap; Joseph M. Fox","A Photochemical Synthesis of Functionalized trans-Cyclooctenes Driven by Metal Complexation","Journal of the American Chemical Society","2008","130","","3760","3761","10.1021/ja8001919","","","0.71073","MoKα","","0.0556","0.0453","","","0.1286","0.1403","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107602","6.945","0.002","7.426","0.002","10.987","0.003","85.366","0.003","86.896","0.004","63.74","0.003","506.4","0.2","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C10 H16 O3 -","- C10 H16 O3 -","- C20 H32 O6 -","2","1","","Maksim Royzen; Glenn P. A. Yap; Joseph M. Fox","A Photochemical Synthesis of Functionalized trans-Cyclooctenes Driven by Metal Complexation","Journal of the American Chemical Society","2008","130","","3760","3761","10.1021/ja8001919","","","0.71073","MoKα","","0.0745","0.0669","","","0.1691","0.1774","","","","","","1.007","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107603","6.891","0.005","11.639","0.008","10.71","0.007","90","","94.203","0.01","90","","856.7","1","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H11 N O2 -","- C9 H11 N O2 -","- C36 H44 N4 O8 -","4","1","","Maksim Royzen; Glenn P. A. Yap; Joseph M. Fox","A Photochemical Synthesis of Functionalized trans-Cyclooctenes Driven by Metal Complexation","Journal of the American Chemical Society","2008","130","","3760","3761","10.1021/ja8001919","","","0.71073","MoKα","","0.0889","0.0774","","","0.2076","0.2201","","","","","","1.061","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107604","34.476","0.003","19.8768","0.0017","14.8594","0.0008","90","","90","","90","","10182.7","1.4","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Ge39.56 N16 O118 Si12.44 -","- Ge39.564 N16 O118 Si12.436 -","- Ge79.128 N32 O236 Si24.872 -","2","0.125","","Kirsten E. Christensen; Charlotte Bonneau; Mikaela Gustafsson; Lei Shi; Junliang Sun; Jekabs Grins; Kjell Jansson; Isabelle Sbille; Bao-Lian Su; Xiadong Zou","An Open-Framework Silicogermanate with 26-Ring Channels Built from Seven-Coordinated (Ge,Si)10(O,OH)28 Clusters","Journal of the American Chemical Society","2008","130","","3758","3759","10.1021/ja8002556","","x-ray","0.907","synchrotron","","0.0701","0.0563","","","0.1496","0.159","","","","","","1.046","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107605","16.1114","0.0005","17.3313","0.0006","18.581","0.0006","106.269","0.002","105.494","0.002","90.959","0.002","4776.1","0.3","99","2","99","2","","","","","","","","5","P -1","-P 1","2","","","","- C176 H230 Au25 N S18 -","- C176 H230 Au25 N S18 -","- C176 H230 Au25 N S18 -","1","0.5","","Michael W. Heaven; Amala Dass; Peter S. White; Kennedy M. Holt; Royce W. Murray","Crystal Structure of the Gold Nanoparticle [N(C8H17)4][Au25(SCH2CH2Ph)18]","Journal of the American Chemical Society","2008","130","","3754","3755","10.1021/ja800561b","","","0.71073","MoKα","","0.0687","0.0415","","","0.0962","0.1132","","","","","","1.054","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107606","8.6134","0.0003","16.7404","0.0006","12.0404","0.0004","90","","90","","90","","1736.13","0.1","120","2","120","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C12 H24 Cl3 Fe P Si -","- C12 H22 Cl3 Fe P Si -","- C48 H88 Cl12 Fe4 P4 Si4 -","4","0.5","","Dmitry V. Gutsulyak; Lyudmila G. Kuzmina; Judith A. K. Howard; Sergei F. Vyboishchikov; Georgii I. Nikonov","Cp(Pri2MeP)FeH2SiR3: Nonclassical Iron Silyl Dihydride","Journal of the American Chemical Society","2008","130","","3732","3733","10.1021/ja800983n","","","0.71073","MoKα","","0.0573","0.0381","","","0.0892","0.0946","","","","","","1.067","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107607","11.6589","0.0003","12.7671","0.0003","12.0791","0.0004","90","","94.963","0.001","90","","1791.24","0.09","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H27 Cl2 Fe P Si -","- C13 H27 Cl2 Fe P Si -","- C52 H108 Cl8 Fe4 P4 Si4 -","4","1","","Dmitry V. Gutsulyak; Lyudmila G. Kuzmina; Judith A. K. Howard; Sergei F. Vyboishchikov; Georgii I. Nikonov","Cp(Pri2MeP)FeH2SiR3: Nonclassical Iron Silyl Dihydride","Journal of the American Chemical Society","2008","130","","3732","3733","10.1021/ja800983n","","","0.71073","MoKα","","0.055","0.0344","","","0.0704","0.0754","","","","","","0.977","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107608","7.6579","0.0002","10.7787","0.0002","13.3012","0.0003","74.476","0.002","85.09","0.002","89.894","0.002","1053.72","0.04","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C13 H27 Br F6 Fe N8 O P -","- C13 H27 Br F6 Fe N8 O P -","- C26 H54 Br2 F12 Fe2 N16 O2 P2 -","2","1","","Maria Schlangen; Johannes Neugebauer; Markus Reiher; Detlef Schröder; Jesús Pitarch López; Marco Haryono; Frank W. Heinemann; Andreas Grohmann; Helmut Schwarz","Gas-Phase C-H and N-H Bond Activation by a High Valent Nitrido-Iron Dication and NH-Transfer to Activated Olefins","Journal of the American Chemical Society","2008","130","","4285","4294","10.1021/ja075617w","","","0.71073","MoKα","","0.0586","0.0404","","","0.0909","0.0971","","","","","","1.087","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107609","11.0057","0.001","11.7715","0.0011","16.1248","0.0015","78.922","0.002","79.575","0.002","75.362","0.002","1964.2","0.3","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C85 H128 N8 Zr2 -","- C85 H128 N8 Zr2 -","- C85 H128 N8 Zr2 -","1","0.5","","Nicole A. Ketterer; Hongjun Fan; Karen J. Blackmore; Xiaofan Yang; Joseph W. Ziller; Mu-Hyun Baik; Alan F. Heyduk","π.-π. Bonding Interactions Generated by Halogen Oxidation of Zirconium(IV) Redox-Active Ligand Complexes","Journal of the American Chemical Society","2008","130","","4364","4374","10.1021/ja077337m","","","0.71073","MoKα","","0.0312","0.0268","","","0.068","0.0714","","","","","","1.055","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107610","29.745","0.005","14.043","0.002","20.461","0.003","90","","122.277","0.002","90","","7226.1","1.9","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H60 N4 O Zr -","- C36 H60 N4 O Zr -","- C288 H480 N32 O8 Zr8 -","8","1","","Nicole A. Ketterer; Hongjun Fan; Karen J. Blackmore; Xiaofan Yang; Joseph W. Ziller; Mu-Hyun Baik; Alan F. Heyduk","π.-π. Bonding Interactions Generated by Halogen Oxidation of Zirconium(IV) Redox-Active Ligand Complexes","Journal of the American Chemical Society","2008","130","","4364","4374","10.1021/ja077337m","","","0.71073","MoKα","","0.0555","0.0314","","","0.0673","0.0778","","","","","","1.053","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107611","9.9356","0.0008","14.7888","0.0012","13.7171","0.0012","90","","100.961","0.001","90","","1978.8","0.3","163","2","163","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H62 Cl2 N4 O Zr -","- C36 H62 Cl2 N4 O Zr -","- C72 H124 Cl4 N8 O2 Zr2 -","2","1","","Nicole A. Ketterer; Hongjun Fan; Karen J. Blackmore; Xiaofan Yang; Joseph W. Ziller; Mu-Hyun Baik; Alan F. Heyduk","π.-π. Bonding Interactions Generated by Halogen Oxidation of Zirconium(IV) Redox-Active Ligand Complexes","Journal of the American Chemical Society","2008","130","","4364","4374","10.1021/ja077337m","","","0.71073","MoKα","","0.0233","0.0221","","","0.0563","0.057","","","","","","1.054","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107612","10.049","0.0009","14.7969","0.0013","13.7501","0.0012","90","","101.533","0.002","90","","2003.3","0.3","163","2","163","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H62 Br2 N4 O Zr -","- C36 H62 Br2 N4 O Zr -","- C72 H124 Br4 N8 O2 Zr2 -","2","1","","Nicole A. Ketterer; Hongjun Fan; Karen J. Blackmore; Xiaofan Yang; Joseph W. Ziller; Mu-Hyun Baik; Alan F. Heyduk","π.-π. Bonding Interactions Generated by Halogen Oxidation of Zirconium(IV) Redox-Active Ligand Complexes","Journal of the American Chemical Society","2008","130","","4364","4374","10.1021/ja077337m","","","0.71073","MoKα","","0.0399","0.0368","","","0.1043","0.1066","","","","","","1.08","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107613","11.7217","0.001","17.3104","0.0015","20.0003","0.0017","90","","100.315","0.002","90","","3992.6","0.6","158","2","158","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H62 Cl0.7 I1.3 N4 O Zr -","- C36 H62 Cl0.7 I1.3 N4 O Zr -","- C144 H248 Cl2.8 I5.2 N16 O4 Zr4 -","4","1","","Nicole A. Ketterer; Hongjun Fan; Karen J. Blackmore; Xiaofan Yang; Joseph W. Ziller; Mu-Hyun Baik; Alan F. Heyduk","π.-π. Bonding Interactions Generated by Halogen Oxidation of Zirconium(IV) Redox-Active Ligand Complexes","Journal of the American Chemical Society","2008","130","","4364","4374","10.1021/ja077337m","","","0.71073","MoKα","","0.0518","0.039","","","0.1017","0.1097","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107614","9.817","0.004","12.992","0.005","14.271","0.005","90","","90","","90","","1820.2","1.2","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 Br2 P Rh -","- C17 H22 Br2 P Rh -","- C68 H88 Br8 P4 Rh4 -","4","1","","Marius V. Câmpian; Eric Clot; Odile Eisenstein; Ulrike Helmstedt; Naseralla Jasim; Robin N. Perutz; Adrian C. Whitwood; David Williamson","Stereochemical Nonrigidity of a Chiral Rhodium Boryl Hydride Complex: A σ-Borane Complex as Transition State for Isomerization","Journal of the American Chemical Society","2008","130","","4375","4385","10.1021/ja077357o","","","0.71073","MoKα","","0.0243","0.0225","","","0.0511","0.0515","","","","","","1.011","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107615","5.025","0.003","7.676","0.004","13.931","0.008","74.067","0.009","89.448","0.011","75.687","0.008","499.7","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Compound_1_4_Pressed_to_3GPa","","","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","1","0.5","","Christopher Wilhelm; Stephen A. Boyd; Samrat Chawda; Frank W. Fowler; Nancy S. Goroff; Gary P. Halada; Clare P. Grey; Joseph W. Lauher; Liang Luo; C. David Martin; John B. Parise; Cathy Tarabrella; Jeffrey A. Webb","Pressure-Induced Polymerization of Diiodobutadiyne in Assembled Cocrystals","Journal of the American Chemical Society","2008","130","","4415","4420","10.1021/ja0782910","","","0.71073","MoKα","","0.0811","0.0405","","","0.0977","0.1415","","","","","","0.975","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107616","6.3978","0.0013","8.4177","0.0017","17.485","0.004","83.29","0.03","84.99","0.03","70.12","0.03","878.3","0.4","173","2","173","2","","","100","","","","organic synthesis","5","P -1","-P 1","2","6-5-5 product","N-tosyl-5-aza-9-hydroxy-1-methyltricyclo[7.3.0.02,7]dodecan-12-one","","- C19 H25 N O4 S -","- C19 H25 N O4 S -","- C38 H50 N2 O8 S2 -","2","1","","Lei Jiao; Changxia Yuan; Zhi-Xiang Yu","Tandem Rh(I)-Catalyzed [(5+2)+1] Cycloaddition/Aldol Reaction for the Construction of Linear Triquinane Skeleton: Total Syntheses of (\±)-Hirsutene and (\±)-1-Desoxyhypnophilin","Journal of the American Chemical Society","2008","130","","4421","4430","10.1021/ja7100449","","x-ray","0.71073","MoKα","","0.0633","0.0505","","","0.1164","0.1221","","","","","","1.124","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107617","8.059","0.002","14.32","0.004","11.9","0.004","90","","105.66","0.03","90","","1322.3","0.7","90","2","90","2","","","","","","","","6","P 1 21 1","P 2yb","4","[Mn(PaPy~2~Q)(OH)]ClO~4~ . CH~3~CN","hydroxo(N,N-bis(2-pyridylmethyl)amine-N-ethyl-2-quinoline-2- carboxamido)manganese(III) perchlorate acetonitrile solvate","","- C26 H26 Cl Mn N6 O6 -","- C26 H26 Cl Mn N6 O6 -","- C52 H52 Cl2 Mn2 N12 O12 -","2","1","","Aura A. Eroy-Reveles; Yvonne Leung; Christine M. Beavers; Marilyn M. Olmstead; Pradip K. Mascharak","Near-Infrared Light Activated Release of Nitric Oxide from Designed Photoactive Manganese Nitrosyls: Strategy, Design, and Potential as NO Donors","Journal of the American Chemical Society","2008","130","","4447","4458","10.1021/ja710265j","","","0.71073","MoKα","","0.0393","0.0326","","","0.0681","0.0702","","","","","","0.986","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107618","7.193","0.003","14.147","0.006","14.691","0.006","63.558","0.006","77.297","0.006","81.994","0.006","1304.3","0.9","90","2","90","2","","","","","","","","6","P -1","-P 1","2","[Mn(PaPy~2~Q)(NO)]ClO~4~ CH~3~OH","(N,N-bis(2-pyridylmethyl)amine-N-ethyl-2-quinoline-2- carboxamido)nitrosylmanganese(II) perchlorate methanol solvate","","- C25 H26 Cl Mn N6 O7 -","- C25 H26 Cl Mn N6 O6.997 -","- C50 H52 Cl2 Mn2 N12 O13.994 -","2","1","","Aura A. Eroy-Reveles; Yvonne Leung; Christine M. Beavers; Marilyn M. Olmstead; Pradip K. Mascharak","Near-Infrared Light Activated Release of Nitric Oxide from Designed Photoactive Manganese Nitrosyls: Strategy, Design, and Potential as NO Donors","Journal of the American Chemical Society","2008","130","","4447","4458","10.1021/ja710265j","","","0.71073","MoKα","","0.0785","0.0525","","","0.1314","0.1464","","","","","","1.006","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107619","23.855","0.007","16.442","0.006","19.947","0.004","90","","110.39","0.015","90","","7333","4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H50 Cl5 N2 P Ru -","- C32 H50 Cl5 N2 P Ru -","- C256 H400 Cl40 N16 P8 Ru8 -","8","1","","Edwin F. van der Eide; Patricio E. Romero; Warren E. Piers","Generation and Spectroscopic Characterization of Ruthenacyclobutane and Ruthenium Olefin Carbene Intermediates Relevant to Ring Closing Metathesis Catalysis","Journal of the American Chemical Society","2008","130","","4485","4491","10.1021/ja710364e","","","0.71073","MoKα","","0.0854","0.043","","","0.0952","0.1133","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107620","7.249","0.003","8.065","0.003","25.055","0.01","90","","90","","90","","1464.8","1","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","TF09-126","(R)-ethyl 1-[1-(4-bromophenyl)vinyl]-2-oxocyclopentanecarboxylate","","- C16 H17 Br O3 -","- C16 H17 Br O3 -","- C64 H68 Br4 O12 -","4","1","","Taisuke Fujimoto; Kohei Endo; Hayato Tsuji; Masaharu Nakamura; Eiichi Nakamura","Construction of a Chiral Quaternary Carbon Center by Indium-Catalyzed Asymmetric α-Alkenylation of β-Ketoesters","Journal of the American Chemical Society","2008","130","","4492","4496","10.1021/ja710408f","","","0.7107","MoKα","","0.0233","0.0211","","","0.0467","0.0472","","","","","","1.009","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107621","11.549","0.0002","21.146","0.0004","18.496","0.0004","90","","98.478","0.001","90","","4467.64","0.15","173","2","173","2","","","","","","","","7","P 1 21 1","P 2yb","4","Compound_7a","Potassium 18-Crown-6 [(2-(Fluorodimethylsilyl)phenyl]fluorodimesitylborate","","- C42 H64 B F2 K O7 Si -","- C42 H64 B F2 K O7 Si -","- C168 H256 B4 F8 K4 O28 Si4 -","4","2","","Atsushi Kawachi; Atsushi Tani; Junpei Shimada; Yohsuke Yamamoto","Synthesis of B/Si Bidentate Lewis Acids, o-(Fluorosilyl)(dimesitylboryl)benzenes, and Their Fluoride Ion Affinity","Journal of the American Chemical Society","2008","130","","4222","4223","10.1021/ja710615r","","","0.71069","MoKα","","0.0686","0.053","","","0.1408","0.1683","","","","","","1.193","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107622","11.758","0.0003","13.378","0.0003","16.445","0.0004","93.092","0.001","92.385","0.001","103.553","0.001","2507.16","0.11","173","2","173","2","","","","","","","","8","P -1","-P 1","2","Compound_7b","Potassium [2.2.2]Cryptand [(2-(Fluorodimethylsilyl)phenyl]fluorodimesitylborate","","- C48 H76 B F2 K N2 O7 Si -","- C48 H68 B F2 K N2 O7 Si -","- C96 H136 B2 F4 K2 N4 O14 Si2 -","2","1","","Atsushi Kawachi; Atsushi Tani; Junpei Shimada; Yohsuke Yamamoto","Synthesis of B/Si Bidentate Lewis Acids, o-(Fluorosilyl)(dimesitylboryl)benzenes, and Their Fluoride Ion Affinity","Journal of the American Chemical Society","2008","130","","4222","4223","10.1021/ja710615r","","","0.71069","MoKα","","0.0731","0.0605","","","0.1663","0.1781","","","","","","1.089","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107623","16.941","0.0002","16.524","0.0003","19.877","0.0003","90","","100.718","0.001","90","","5467.16","0.15","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Compound_8a","Potassium 18-Crown-6 [(2-(Fluorodiphenylsilyl)phenyl]fluorodimesitylborate","","- C56 H76 B F2 K O8 Si -","- C56 H76 B F2 K O8 Si -","- C224 H304 B4 F8 K4 O32 Si4 -","4","1","","Atsushi Kawachi; Atsushi Tani; Junpei Shimada; Yohsuke Yamamoto","Synthesis of B/Si Bidentate Lewis Acids, o-(Fluorosilyl)(dimesitylboryl)benzenes, and Their Fluoride Ion Affinity","Journal of the American Chemical Society","2008","130","","4222","4223","10.1021/ja710615r","","","0.71069","MoKα","","0.0946","0.0787","","","0.2128","0.2271","","","","","","1.07","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107624","14.465","0.0002","14.469","0.0003","14.75","0.0004","75.282","0.001","65.59","0.001","88.493","0.001","2708.02","0.1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","Compound_8b","Potassium [2.2.2]Cryptand [(2-(Fluorodiphenylsilyl)phenyl]fluorodimesitylborate","","- C54 H74 B F2 K N2 O7 Si -","- C54 H74 B F2 K N2 O7 Si -","- C108 H148 B2 F4 K2 N4 O14 Si2 -","2","1","","Atsushi Kawachi; Atsushi Tani; Junpei Shimada; Yohsuke Yamamoto","Synthesis of B/Si Bidentate Lewis Acids, o-(Fluorosilyl)(dimesitylboryl)benzenes, and Their Fluoride Ion Affinity","Journal of the American Chemical Society","2008","130","","4222","4223","10.1021/ja710615r","","","0.71069","MoKα","","0.0859","0.0633","","","0.1821","0.2177","","","","","","1.161","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107625","9.9865","0.0008","15.9335","0.0008","13.252","0.002","90","","95.115","0.009","90","","2100.3","0.4","298","","","","","","","","","","Local laboratory","6","P 1 21 1","P 2yb","4","","","","- C47 H48 Fe N6 O4 P -","- C47 H48 Fe N6 O4 P -","- C94 H96 Fe2 N12 O8 P2 -","2","1","","Victor Polshin; Delia-Laura Popescu; Andreas Fischer; Arani Chanda; David C. Horner; Evan S. Beach; Jennifer Henry; Yong-Li Qian; Colin P. Horwitz; Gabor Lente; Istvan Fabian; Eckard Münck; Emile L. Bominaar; Alexander D. Ryabov; Terrence J. Collins","Attaining Control by Design over the Hydrolytic Stability of Fe-TAML Oxidation Catalysts","Journal of the American Chemical Society","2008","130","","4497","4506","10.1021/ja7106383","","","0.71073","MoKα","","0.0572","0.04","","","0.0817","0.0922","","","","","","1.109","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107626","20.9742","0.0007","20.9742","0.0007","20.9742","0.0007","90","","90","","90","","9226.9","0.5","293.1","","","","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C30 H57 Cr2 N21 Ni3 O3 -","- C30 H57 Cr2 N21 Ni3 O3 -","- C240 H456 Cr16 N168 Ni24 O24 -","8","0.333333","","Masaaki Ohba; Wakako Kaneko; Susumu Kitagawa; Takuho Maeda; Masaki Mito","Pressure Response of Three-Dimensional Cyanide-Bridged Bimetallic Magnets","Journal of the American Chemical Society","2008","130","","4475","4484","10.1021/ja7110509","","","0.7107","MoKα","","","0.031","","","","0.0932","","","","","","0.775","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107627","24.505","0.007","11.323","0.004","14.81","0.004","90","","120.69","0.02","90","","3534","2","296.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Cr2 Mn3 N18 O4 -","- C18 H32 Cr2 Mn3 N18 O4 -","- C72 H128 Cr8 Mn12 N72 O16 -","4","0.5","","Masaaki Ohba; Wakako Kaneko; Susumu Kitagawa; Takuho Maeda; Masaki Mito","Pressure Response of Three-Dimensional Cyanide-Bridged Bimetallic Magnets","Journal of the American Chemical Society","2008","130","","4475","4484","10.1021/ja7110509","","","0.7107","MoKα","","","0","","","","0.042","","","","","","1.7","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107628","24.044","0.008","14.343","0.004","16.688","0.005","90","","100.552","0.004","90","","5658","3","243.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 Fe2 N21 Ni3 O6 -","- C30 H51 Fe2 N21 Ni3 O6 -","- C120 H204 Fe8 N84 Ni12 O24 -","4","0.5","","Masaaki Ohba; Wakako Kaneko; Susumu Kitagawa; Takuho Maeda; Masaki Mito","Pressure Response of Three-Dimensional Cyanide-Bridged Bimetallic Magnets","Journal of the American Chemical Society","2008","130","","4475","4484","10.1021/ja7110509","","","0.7107","MoKα","","","0.0489","","","","0.1352","","","","","","0.998","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107629","9.1089","0.0013","13.2614","0.0018","19.958","0.003","90","","90","","90","","2410.9","0.6","100","1","100","1","","","","","","","see text","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H25 N O2 -","- C34.002 H25.005 N O2 -","- C136.008 H100.02 N4 O8 -","4","1","","Dirk Pijper; Mahthild G. M. Jongejan; Auke Meetsma; Ben L. Feringa","Light-Controlled Supramolecular Helicity of a Liquid Crystalline Phase Using a Helical Polymer Functionalized with a Single Chiroptical Molecular Switch","Journal of the American Chemical Society","2008","130","","4541","4552","10.1021/ja711283c","","","0.71073","MoKα","","0.0586","0.0461","","","0.0954","0.0997","","","","","","1.068","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107630","21.61","0.011","8.084","0.004","17.322","0.009","90","","93.796","0.008","90","","3019","3","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","DBSB","1,4-bis(1,1-dimethyl-2-phenylbenzosilol-3-yl)benzene","","- C38 H34 Si2 -","- C38 H34 Si2 -","- C152 H136 Si8 -","4","0.5","","Laurean Ilies; Hayato Tsuji; Yoshiharu Sato; Eiichi Nakamura","Modular Synthesis of Functionalized Benzosiloles by Tin-Mediated Cyclization of (o-Alkynylphenyl)silane","Journal of the American Chemical Society","2008","130","","4240","4241","10.1021/ja800636g","","","0.7107","MoKα","","0.0414","0.0397","","","0.1442","0.146","","","","","","1.3","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107631","8.2634","0.0005","19.8367","0.0011","15.4497","0.0008","90","","99.276","0.003","90","","2499.4","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 B2 Cr N4 -","- C28 H32 B2 Cr N4 -","- C112 H128 B8 Cr4 N16 -","4","1","","Holger Braunschweig; Thomas Kupfer","Stoichiometric and Homogeneous-Catalytic Diboration of the NN Double Bond of Azobenzene","Journal of the American Chemical Society","2008","130","","4242","4243","10.1021/ja8006879","","","0.71073","MoKα","","0.0572","0.0457","","","0.1287","0.1347","","","","","","1.076","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107632","10.4239","0.0002","19.349","0.0006","13.3476","0.0004","90","","111.623","0.0015","90","","2502.66","0.12","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H23 F3 N2 O9 S -","- C22 H23 F3 N2 O9 S -","- C88 H92 F12 N8 O36 S4 -","4","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0682","0.049","","","0.1306","0.1446","","","","","","0.998","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107633","10.8981","0.0007","15.3217","0.0011","15.2817","0.0007","90","","91.537","0.004","90","","2550.8","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H23 F3 N2 O8 S -","- C25 H23 F3 N2 O8 S -","- C100 H92 F12 N8 O32 S4 -","4","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.099","0.0545","","","0.1362","0.1579","","","","","","1.02","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107634","10.8836","0.0003","11.24","0.0002","13.2769","0.0004","103.065","0.002","95.015","0.002","114.689","0.002","1406.85","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H24 F3 O9 P S -","- C27 H24 F3 O9 P S -","- C54 H48 F6 O18 P2 S2 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0623","0.0525","","","0.1461","0.1535","","","","","","1.038","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107635","8.9593","0.0003","9.1325","0.0002","9.2993","0.0003","111.338","0.002","95.541","0.002","105.76","0.002","665.68","0.04","173","2","173","2","","","","","","","","6","P 1","P 1","1","","","","- C22 H25 F3 N2 O13 S -","- C22 H25 F3 N2 O13 S -","- C22 H25 F3 N2 O13 S -","1","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0672","0.061","","","0.1532","0.1585","","","","","","1.055","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107636","20.4728","0.0004","8.5835","0.0002","29.1325","0.0001","90","","92.479","0.001","90","","5114.61","0.16","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H23 F3 N2 O8 S -","- C25 H23 F3 N2 O8 S -","- C200 H184 F24 N16 O64 S8 -","8","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0753","0.0455","","","0.1296","0.149","","","","","","1.001","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107637","8.7141","0.0002","11.1733","0.0002","13.1992","0.0002","94.562","0.001","98.25","0.001","112.007","0.001","1166.66","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H21 F3 N2 O8 S -","- C21 H21 F3 N2 O8 S -","- C42 H42 F6 N4 O16 S2 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0596","0.0513","","","0.1364","0.1435","","","","","","0.982","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107638","8.3354","0.0002","9.2642","0.0002","10.9692","0.0003","102.129","0.001","90.355","0.001","104.302","0.001","800.96","0.03","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H15 N O5 -","- C19 H15 N O5 -","- C38 H30 N2 O10 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0481","0.042","","","0.1154","0.1212","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107639","6.745","0.0003","16.1834","0.0006","11.4015","0.0004","90","","103.069","0.002","90","","1212.32","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 O5 S -","- C13 H10 O5 S -","- C52 H40 O20 S4 -","4","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0639","0.0387","","","0.0873","0.0975","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107640","9.17","0.001","14.29","0.001","15.693","0.002","90","","91.415","0.006","90","","2055.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 F3 N2 O9 S -","- C16 H19 F3 N2 O9 S -","- C64 H76 F12 N8 O36 S4 -","4","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0576","0.0391","","","0.0846","0.0916","","","","","","1.046","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107641","7.2486","0.0002","16.2609","0.0004","19.8121","0.0004","90","","90.936","0.002","90","","2334.92","0.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 F3 N2 O8 S -","- C21 H21 F3 N2 O8 S -","- C84 H84 F12 N8 O32 S4 -","4","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0949","0.0843","","","0.1846","0.1936","","","","","","1.163","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107642","8.6061","0.0004","15.3022","0.0008","15.7738","0.0007","90","","100.44","0.003","90","","2042.9","0.17","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H36 F6 N4 O16 S2 -","- C36 H36 F6 N4 O16 S2 -","- C72 H72 F12 N8 O32 S4 -","2","0.5","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0941","0.0466","","","0.1073","0.1226","","","","","","0.979","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107643","9.3648","0.0003","9.4521","0.0002","11.0705","0.0003","84.428","0.002","74.511","0.001","75.71","0.0014","914.61","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H15 F3 N2 O9 S -","- C13 H15 F3 N2 O9 S -","- C26 H30 F6 N4 O18 S2 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.052","0.0392","","","0.1009","0.1084","","","","","","1.048","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107644","7.2405","0.0003","16.4816","0.0007","19.2279","0.0007","90","","90","","90","","2294.56","0.16","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C19 H19 F3 N2 O8 S2 -","- C19 H19 F3 N2 O8 S2 -","- C76 H76 F12 N8 O32 S8 -","4","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0754","0.044","","","0.0981","0.11","","","","","","0.992","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107645","8.5359","0.0002","11.0776","0.0003","13.1438","0.0004","86.221","0.001","89.665","0.002","68.304","0.002","1152.06","0.06","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H19 F3 N2 O8 S2 -","- C19 H19 F3 N2 O8 S2 -","- C38 H38 F6 N4 O16 S4 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0795","0.0522","","","0.1484","0.1701","","","","","","0.995","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107646","7.7518","0.0002","10.6175","0.0003","12.0977","0.0003","89.307","0.002","73.177","0.002","76.567","0.002","925.38","0.04","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H18 O6 S -","- C20 H18 O6 S -","- C40 H36 O12 S2 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0557","0.0399","","","0.1022","0.1107","","","","","","1.063","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107647","8.7138","0.0002","13.5579","0.0005","10.428","0.0003","90","","103.066","0.002","90","","1200.08","0.06","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H20 F4 N2 O8 S -","- C21 H20 F4 N2 O8 S -","- C42 H40 F8 N4 O16 S2 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0765","0.072","","","0.2124","0.2171","","","","","","1.802","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107648","8.8845","0.0003","9.7575","0.0005","10.9169","0.0008","113.488","0.004","98.016","0.004","101.479","0.003","825.03","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H16 N2 O4 -","- C19 H16 N2 O4 -","- C38 H32 N4 O8 -","2","1","","Robert Weiss; Matthias Bess; Stefan M. Huber; Frank W. Heinemann","Nucleophilic β-Oniovinylation: Concept, Mechanism, Scope, and Applications","Journal of the American Chemical Society","2008","130","","4610","4617","10.1021/ja071316a","","","0.71073","MoKα","","0.0518","0.0384","","","0.0875","0.0945","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107649","13.654","0.003","22.228","0.004","15.352","0.003","90","","103.99","0.003","90","","4521.1","1.6","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C41 H47 Cl2 F6 Mn2 N8 O4 P -","- C41 H47 Cl2 F6 Mn2 N8 O4 P -","- C164 H188 Cl8 F24 Mn8 N32 O16 P4 -","4","1","","Monica Soler; James K. McCusker","Distinguishing between Dexter and Rapid Sequential Electron Transfer in Covalently Linked Donor-Acceptor Assemblies","Journal of the American Chemical Society","2008","130","","4708","4724","10.1021/ja077096i","","","0.71073","MoKα","","0.1608","0.0713","","","0.1464","0.198","","","","","","1.034","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107650","13.2571","0.0016","22.498","0.003","14.956","0.0018","90","","99.742","0.002","90","","4396.4","1","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H48 F6 N9 O4 P Zn2 -","- C42 H48 F6 N9 O4 P Zn2 -","- C168 H192 F24 N36 O16 P4 Zn8 -","4","1","","Monica Soler; James K. McCusker","Distinguishing between Dexter and Rapid Sequential Electron Transfer in Covalently Linked Donor-Acceptor Assemblies","Journal of the American Chemical Society","2008","130","","4708","4724","10.1021/ja077096i","","","0.71073","MoKα","","0.0849","0.039","","","0.0671","0.0741","","","","","","0.984","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107651","19.696","0.004","8.3139","0.0016","14.012","0.003","90","","96.275","0.002","90","","2280.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H41 N5 Pd -","- C19 H41 N5 Pd -","- C76 H164 N20 Pd4 -","4","1","","Stefan Erhardt; Vladimir V. Grushin; Alison H. Kilpatrick; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Mechanisms of Catalyst Poisoning in Palladium-Catalyzed Cyanation of Haloarenes. Remarkably Facile C-N Bond Activation in the [(Ph3P)4Pd]/[Bu4N]+CN-System","Journal of the American Chemical Society","2008","130","","4828","4845","10.1021/ja078298h","","","0.71073","MoKα","","0.0297","0.0235","","","0.0551","0.0585","","","","","","1.056","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107652","11.55","0.003","8.4259","0.0019","38.732","0.008","90","","96.543","0.004","90","","3744.8","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H47 K N O9 P Pd -","- C35 H47 K N O9 P Pd -","- C140 H188 K4 N4 O36 P4 Pd4 -","4","1","","Stefan Erhardt; Vladimir V. Grushin; Alison H. Kilpatrick; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Mechanisms of Catalyst Poisoning in Palladium-Catalyzed Cyanation of Haloarenes. Remarkably Facile C-N Bond Activation in the [(Ph3P)4Pd]/[Bu4N]+CN-System","Journal of the American Chemical Society","2008","130","","4828","4845","10.1021/ja078298h","","","0.71073","MoKα","","0.1056","0.0536","","","0.1112","0.1313","","","","","","1.057","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107653","12.025","0.003","20.71","0.004","14.224","0.003","90","","123.98","0.014","90","","2937.4","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H20 N2 -","- C9 H20 N2 -","- C108 H240 N24 -","12","3","","Stefan Erhardt; Vladimir V. Grushin; Alison H. Kilpatrick; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Mechanisms of Catalyst Poisoning in Palladium-Catalyzed Cyanation of Haloarenes. Remarkably Facile C-N Bond Activation in the [(Ph3P)4Pd]/[Bu4N]+CN-System","Journal of the American Chemical Society","2008","130","","4828","4845","10.1021/ja078298h","","","0.71073","MoKα","","0.094","0.0622","","","0.1677","0.1945","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107654","9.1134","0.0008","9.7354","0.0008","10.2226","0.0009","110.877","0.001","93.084","0.001","108.097","0.001","791.57","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H30 N2 P2 Pd -","- C38 H30 N2 P2 Pd -","- C38 H30 N2 P2 Pd -","1","0.5","","Stefan Erhardt; Vladimir V. Grushin; Alison H. Kilpatrick; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Mechanisms of Catalyst Poisoning in Palladium-Catalyzed Cyanation of Haloarenes. Remarkably Facile C-N Bond Activation in the [(Ph3P)4Pd]/[Bu4N]+CN-System","Journal of the American Chemical Society","2008","130","","4828","4845","10.1021/ja078298h","","","0.71073","MoKα","","0.0269","0.0249","","","0.0621","0.0631","","","","","","1.074","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107655","44.861","0.006","44.861","0.006","10.203","0.002","90","","90","","120","","17783","5","293","2","293","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C252 H300 N24 O18 Zn6 -","- C252 H252 N24 O18 Zn6 -","- C756 H756 N72 O54 Zn18 -","3","0.333333","","Gao Li; Weibin Yu; Yong Cui","A Homochiral Nanotubular Crystalline Framework of Metallomacrocycles for Enantioselective Recognition and Separation","Journal of the American Chemical Society","2008","130","","4582","4583","10.1021/ja078317n","","","0.71073","MoKα","","0.0483","0.0423","","","0.1182","0.1227","","","","","","1.065","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107656","45.037","0.0019","45.037","0.0019","10.3862","0.0009","90","","90","","120","","18244.3","1.9","273","2","273","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C258 H324 N24 O18 Zn6 -","- C258 H252 N24 O18 Zn6 -","- C774 H756 N72 O54 Zn18 -","3","0.333333","","Gao Li; Weibin Yu; Yong Cui","A Homochiral Nanotubular Crystalline Framework of Metallomacrocycles for Enantioselective Recognition and Separation","Journal of the American Chemical Society","2008","130","","4582","4583","10.1021/ja078317n","","","0.71073","MoKα","","0.1262","0.0646","","","0.1462","0.1802","","","","","","1.001","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107657","8.721","0.004","10.414","0.004","13.992","0.005","90","","90","","90","","1270.8","0.9","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H17 N3 O6 -","- C12 H17 N3 O6 -","- C48 H68 N12 O24 -","4","1","","S. M. Abdur Rahman; Sayori Seki; Satoshi Obika; Haruhisa Yoshikawa; Kazuyuki Miyashita; Takeshi Imanishi","Design, Synthesis, and Properties of 2',4'-BNANC: A Bridged Nucleic Acid Analogue","Journal of the American Chemical Society","2008","130","","4886","4896","10.1021/ja710342q","","","0.71075","MoKα","","","0.0291","","","","0.0699","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107658","11.03","0.005","16.207","0.008","16.613","0.008","97.695","0.008","91.885","0.008","98.247","0.009","2909","2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C140 H134 N8 O4 P2 Pd Zn2 -","- C140 H134 N8 O4 P2 Pd Zn2 -","- C140 H134 N8 O4 P2 Pd Zn2 -","1","0.5","","Yoshihiro Matano; Kazuaki Matsumoto; Yoshihide Nakao; Hidemitsu Uno; Shigeyoshi Sakaki; Hiroshi Imahori","Regioselective β-Metalation of meso-Phosphanylporphyrins. Structure and Optical Properties of Porphyrin Dimers Linked by Peripherally Fused Phosphametallacycles","Journal of the American Chemical Society","2008","130","","4588","4589","10.1021/ja710542e","","","0.7107","MoKα","","0.0998","0.0691","","","0.169","0.1971","","","","","","1.064","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107659","9.5352","0.0003","6.865","0.0002","15.2561","0.0005","90","","100.276","0.001","90","","982.63","0.05","100","2","100","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C20 H23 Cl O5 -","- C20 H23 Cl O5 -","- C40 H46 Cl2 O10 -","2","1","","Petteri Elsner; Luca Bernardi; Giorgio Dela Salla; Jacob Overgaard; Karl Anker Jørgensen","Organocatalytic Asymmetric Conjugate Addition to Allenic Esters and Ketones","Journal of the American Chemical Society","2008","130","","4897","4905","10.1021/ja710689c","","x-ray","0.71073","MoKα","","0.0402","0.0326","","","0.0668","0.0691","","","","","","1.063","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107660","6.4832","0.0004","10.6951","0.0007","10.6979","0.0005","90","","94.28","0.002","90","","739.71","0.08","100","2","100","2","","","","","","","synthesis as described","3","P 1 21 1","P 2yb","4","","","","- C15 H22 O4 -","- C15 H22 O4 -","- C30 H44 O8 -","2","1","","Petteri Elsner; Luca Bernardi; Giorgio Dela Salla; Jacob Overgaard; Karl Anker Jørgensen","Organocatalytic Asymmetric Conjugate Addition to Allenic Esters and Ketones","Journal of the American Chemical Society","2008","130","","4897","4905","10.1021/ja710689c","","x-ray","0.71073","MoKα","","0.0272","0.0245","","","0.0586","0.06","","","","","","1.081","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107661","16.1259","0.0012","15.8846","0.0012","15.5062","0.0011","90","","107.968","0.001","90","","3778.2","0.5","187","2","187","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H47 Cl2 N2 O2 Y -","- C39 H47 Cl2 N2 O2 Y -","- C156 H188 Cl8 N8 O8 Y4 -","4","1","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0875","0.048","","","0.1076","0.1217","","","","","","0.997","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107662","11.3444","0.0012","14.4914","0.0016","21.45","0.002","90","","100.859","0.002","90","","3463.2","0.6","187","2","187","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H47 Cl2 N2 O2 Y -","- C36 H47 Cl2 N2 O2 Y -","- C144 H188 Cl8 N8 O8 Y4 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0554","0.042","","","0.1051","0.1099","","","","","","0.973","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107663","19.9611","0.0013","16.7865","0.0011","23.8821","0.0016","90","","90","","90","","8002.3","0.9","187","2","187","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C40 H55 Cl2 N2 O2 Y -","- C40 H55 Cl2 N2 O2 Y -","- C320 H440 Cl16 N16 O16 Y8 -","8","1","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.1012","0.0445","","","0.0968","0.1074","","","","","","0.839","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107664","11.2551","0.0007","14.6513","0.0009","21.5504","0.0014","90","","100.983","0.001","90","","3488.6","0.4","187","2","187","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H47 Cl2 N2 Nd O2 -","- C36 H47 Cl2 N2 Nd O2 -","- C144 H188 Cl8 N8 Nd4 O8 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0321","0.0291","","","0.0694","0.071","","","","","","1.08","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107665","16.5628","0.0004","16.5628","0.0004","16.0229","0.0007","90","","90","","90","","4395.5","0.2","187","2","187","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C44 H63 Cl2 Gd N2 O4 -","- C44 H63 Cl2 Gd N2 O4 -","- C176 H252 Cl8 Gd4 N8 O16 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0262","0.0236","","","0.053","0.0542","","","","","","1.058","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107666","11.2671","0.0005","14.6123","0.0007","21.5165","0.001","90","","100.977","0.001","90","","3477.6","0.3","185","2","185","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H47 Cl2 N2 O2 Sm -","- C36 H47 Cl2 N2 O2 Sm -","- C144 H188 Cl8 N8 O8 Sm4 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0225","0.0212","","","0.0516","0.0522","","","","","","1.078","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107667","11.2867","0.0009","14.5619","0.0012","21.4788","0.0018","90","","100.874","0.001","90","","3466.8","0.5","187","2","187","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H43 Cl2 N2 O2 Tb -","- C36 H45 Cl2 N2 O2 Tb -","- C144 H180 Cl8 N8 O8 Tb4 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0371","0.0323","","","0.0756","0.0774","","","","","","1.025","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107668","16.5158","0.001","16.5158","0.001","16.0486","0.0013","90","","90","","90","","4377.6","0.5","273","2","273","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C44 H63 Cl2 Dy N2 O4 -","- C44 H63 Cl2 Dy N2 O4 -","- C176 H252 Cl8 Dy4 N8 O16 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0264","0.0236","","","0.0528","0.0539","","","","","","1.066","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107669","11.4405","0.0007","14.3832","0.0009","21.408","0.0014","90","","100.886","0.001","90","","3459.3","0.4","187","2","187","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H47 Cl2 N2 O2 Yb -","- C36 H47 Cl2 N2 O2 Yb -","- C144 H188 Cl8 N8 O8 Yb4 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0449","0.036","","","0.079","0.0815","","","","","","0.983","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107670","16.4433","0.0004","16.4433","0.0004","16.0756","0.0008","90","","90","","90","","4346.6","0.3","187","2","187","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C44 H63 Cl2 Lu N2 O4 -","- C44 H63 Cl2 Lu N2 O4 -","- C176 H252 Cl8 Lu4 N8 O16 -","4","0.5","","Wei Gao; Dongmei Cui","Highlycis-1,4 Selective Polymerization of Dienes with Homogeneous Ziegler-Natta Catalysts Based on NCN-Pincer Rare Earth Metal Dichloride Precursors","Journal of the American Chemical Society","2008","130","","4984","4991","10.1021/ja711146t","","","0.71073","MoKα","","0.0165","0.0155","","","0.038","0.0385","","","","","","1.071","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107671","11.5076","0.0012","11.5693","0.0012","15.9984","0.0016","87.713","0.001","69.63","0.001","60.151","0.001","1708.4","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H48 Si2 Zr -","- C37 H48 Si2 Zr -","- C74 H96 Si4 Zr2 -","2","1","","Adam D. Miller; Jennifer L. McBee; T. Don Tilley","Mechanism of Reversible Alkyne Coupling at Zirconocene: Ancillary Ligand Effects","Journal of the American Chemical Society","2008","130","","4992","4999","10.1021/ja800025u","","","0.71073","MoKα","","0.0443","0.0403","","","0.1065","0.1079","","","","","","1.166","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107672","7.5068","0.0018","11.123","0.003","21.788","0.005","78.214","0.004","83.497","0.004","77.487","0.004","1734.1","0.7","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C77 H84 Si4 Zr2 -","- C77 H84 Si4 Zr2 -","- C77 H84 Si4 Zr2 -","1","0.5","","Adam D. Miller; Jennifer L. McBee; T. Don Tilley","Mechanism of Reversible Alkyne Coupling at Zirconocene: Ancillary Ligand Effects","Journal of the American Chemical Society","2008","130","","4992","4999","10.1021/ja800025u","","","0.71073","MoKα","","0.0617","0.0402","","","0.0825","0.0852","","","","","","0.821","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107673","5.1416","0.0005","6.2569","0.0006","13.042","0.001","95.776","0.006","96.975","0.006","98.148","0.006","409.28","0.06","173","0.1","293","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C6 H3 Cl F5 N -","- C6 H3 Cl F5 N -","- C12 H6 Cl2 F10 N2 -","2","1","","Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow","Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations","Journal of the American Chemical Society","2008","130","","4600","4601","10.1021/ja800219g","","x-ray","0.71073","MoKα","","0.0559","0.047","","","0.1038","0.1081","","","","","","1.185","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107674","10.5952","0.0003","8.1236","0.0002","13.3024","0.0006","90","","108.961","0.002","90","","1082.83","0.06","173","0.1","173","0.1","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Br F5 N -","- C9 H7 Br F5 N -","- C36 H28 Br4 F20 N4 -","4","1","","Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow","Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations","Journal of the American Chemical Society","2008","130","","4600","4601","10.1021/ja800219g","","x-ray","0.71073","MoKα","","0.0412","0.0278","","","0.0562","0.0622","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107675","9.9783","0.0006","8.5453","0.0005","14.147","0.0008","90","","106.66","0.006","90","","1155.64","0.12","173","0.1","173","0.1","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 F5 I N -","- C9 H7 F5 I N -","- C36 H28 F20 I4 N4 -","4","1","","Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow","Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations","Journal of the American Chemical Society","2008","130","","4600","4601","10.1021/ja800219g","","x-ray","0.71073","MoKα","","0.0446","0.0282","","","0.0526","0.0582","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107676","9.3108","0.0002","10.8341","0.0002","10.3856","0.0002","90","","95.51","0.001","90","","1042.8","0.04","153","0.1","153","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 Cl F5 N2 -","- C8 H6 Cl F5 N2 -","- C32 H24 Cl4 F20 N8 -","4","1","","Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow","Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations","Journal of the American Chemical Society","2008","130","","4600","4601","10.1021/ja800219g","","x-ray","0.71073","MoKα","","0.0322","0.0288","","","0.071","0.0733","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107677","7.424","0.0003","7.424","0.0003","19.255","0.0006","90","","90","","90","","1061.25","0.07","173","0.1","173","0.1","","","","","","","synthesis as described","5","P 41","P 4w","76","","","","- C8 H6 Br F5 N2 -","- C8 H6 Br F5 N2 -","- C32 H24 Br4 F20 N8 -","4","1","","Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow","Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations","Journal of the American Chemical Society","2008","130","","4600","4601","10.1021/ja800219g","","x-ray","0.71073","MoKα","","0.0394","0.0337","","","0.069","0.0722","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107678","8.2351","0.0002","13.4969","0.0004","20.5816","0.0006","90","","91.395","0.002","90","","2286.93","0.11","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H19 Br F5 O P -","- C25 H19 Br F5 O P -","- C100 H76 Br4 F20 O4 P4 -","4","1","","Markus Albrecht; Claudia Wessel; Marita de Groot; Kari Rissanen; Arne Lüchow","Structural Versatility of Anion-π Interactions in Halide Salts with Pentafluorophenyl Substituted Cations","Journal of the American Chemical Society","2008","130","","4600","4601","10.1021/ja800219g","","x-ray","0.71073","MoKα","","0.044","0.0351","","","0.0788","0.0837","","","","","","1.088","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107679","36.988","","12.456","","22.121","","90","","93.44","","90","","10173.3","","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Cs5 H15 O46 Ru2 Si W10 -","- Cs5 O46 Ru2 Si W10 -","- Cs40 O368 Ru16 Si8 W80 -","8","1","","Andrea Sartorel; Mauro Carraro; Gianfranco Scorrano; Rita De Zorzi; Silvano Geremia; Neal D. McDaniel; Stefan Bernhard; Marcella Bonchio","Polyoxometalate Embedding of a Tetraruthenium(IV)-oxo-core by Template-Directed Metalation of [γ-SiW10O36]8-: A Totally Inorganic Oxygen-Evolving Catalyst","Journal of the American Chemical Society","2008","130","","5006","5007","10.1021/ja077837f","","","0.71073","MoKα","","0.0953","0.0717","","","0.2128","0.2368","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107680","12.99","0.0009","16.0879","0.0013","6.1202","0.0004","90","","92.373","0.005","90","","1277.91","0.16","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 F3 N3 O3 S -","- C12 H8 F3 N3 O3 S -","- C48 H32 F12 N12 O12 S4 -","4","1","","M. Sinan; M. Panda; A. Ghosh; K. Dhara; P. E. Fanwick; D. J. Chattopadhyay; S. Goswami","Mild Synthesis of a Family of Planar Triazinium Cations via Proton-Assisted Cyclization of Pyridyl Containing Azo Compounds and Studies on DNA Intercalation","Journal of the American Chemical Society","2008","130","","5185","5193","10.1021/ja710211u","","","0.71073","MoKα","","0.1038","0.0772","","","0.1563","0.1673","","","","","","1.168","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107681","10.3608","0.0019","25.392","0.005","22.38","0.004","90","","90","","90","","5887.8","1.9","100","2","100","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C68 H66 N8 O12 -","- C68 H66 N8 O12 -","- C272 H264 N32 O48 -","4","0.5","","Shifa Zhu; Joshua V. Ruppel; Hongjian Lu; Lukasz Wojtas; X. Peter Zhang","Cobalt-Catalyzed Asymmetric Cyclopropanation with Diazosulfones: Rigidification and Polarization of Ligand Chiral Environment via Hydrogen Bonding and Cyclization","Journal of the American Chemical Society","2008","130","","5042","5043","10.1021/ja7106838","","","0.71073","MoKα","","0.05","0.0418","","","0.093","0.0964","","","","","","1.096","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107682","7.6379","0.0017","11.269","0.003","15.319","0.003","90","","90","","90","","1318.5","0.5","133","2","133","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H16 O2 S -","- C16 H16 O2 S -","- C64 H64 O8 S4 -","4","1","","Shifa Zhu; Joshua V. Ruppel; Hongjian Lu; Lukasz Wojtas; X. Peter Zhang","Cobalt-Catalyzed Asymmetric Cyclopropanation with Diazosulfones: Rigidification and Polarization of Ligand Chiral Environment via Hydrogen Bonding and Cyclization","Journal of the American Chemical Society","2008","130","","5042","5043","10.1021/ja7106838","","","0.71073","MoKα","","0.0296","0.0286","","","0.0755","0.0765","","","","","","1.037","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107683","16.369","0.002","18.632","0.003","19.616","0.003","90","","90","","90","","5982.6","1.5","141","2","141","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","","","- C32 H47 Br N U -","- C32 H47 Br N U -","- C256 H376 Br8 N8 U8 -","8","1","","Christopher R. Graves; Ping Yang; Stosh A. Kozimor; Anthony E. Vaughn; David L. Clark; Steven D. Conradson; Eric J. Schelter; Brian L. Scott; J. D. Thompson; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Organometallic Uranium(V)-Imido Halide Complexes: From Synthesis to Electronic Structure and Bonding","Journal of the American Chemical Society","2008","130","","5272","5285","10.1021/ja711010h","","","0.71073","MoKα","","0.1264","0.1124","","","0.3655","0.3696","","","","","","2.71","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107684","11.8607","0.0011","17.2023","0.0017","32.273","0.003","90","","90","","90","","6584.7","1.1","141","2","141","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C36 H55 N O U -","- C36 H55 N O U -","- C288 H440 N8 O8 U8 -","8","1","","Christopher R. Graves; Ping Yang; Stosh A. Kozimor; Anthony E. Vaughn; David L. Clark; Steven D. Conradson; Eric J. Schelter; Brian L. Scott; J. D. Thompson; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Organometallic Uranium(V)-Imido Halide Complexes: From Synthesis to Electronic Structure and Bonding","Journal of the American Chemical Society","2008","130","","5272","5285","10.1021/ja711010h","","","0.71073","MoKα","","0.0896","0.0399","","","0.0656","0.078","","","","","","1.004","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107685","9.862","0.004","13.817","0.006","12.801","0.005","90","","97.573","0.006","90","","1729.1","1.2","141","2","141","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C38 H59 F N U -","- C38 H59 F N U -","- C76 H118 F2 N2 U2 -","2","0.5","","Christopher R. Graves; Ping Yang; Stosh A. Kozimor; Anthony E. Vaughn; David L. Clark; Steven D. Conradson; Eric J. Schelter; Brian L. Scott; J. D. Thompson; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Organometallic Uranium(V)-Imido Halide Complexes: From Synthesis to Electronic Structure and Bonding","Journal of the American Chemical Society","2008","130","","5272","5285","10.1021/ja711010h","","","0.71073","MoKα","","0.1027","0.0511","","","0.0833","0.1","","","","","","0.701","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107686","11.24","0.002","13.272","0.003","13.89","0.003","88.584","0.003","86.627","0.003","74.635","0.003","1994.5","0.7","141","2","141","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H73 Br N U -","- C38 H59 Br N U -","- C76 H118 Br2 N2 U2 -","2","1","","Christopher R. Graves; Ping Yang; Stosh A. Kozimor; Anthony E. Vaughn; David L. Clark; Steven D. Conradson; Eric J. Schelter; Brian L. Scott; J. D. Thompson; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Organometallic Uranium(V)-Imido Halide Complexes: From Synthesis to Electronic Structure and Bonding","Journal of the American Chemical Society","2008","130","","5272","5285","10.1021/ja711010h","","","0.71073","MoKα","","0.0683","0.0485","","","0.1","0.1067","","","","","","0.95","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107687","10.2796","0.0006","18.7063","0.0011","16.1905","0.0009","90","","106.656","0.001","90","","2982.7","0.3","141","2","141","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H47 Cl N U -","- C32 H47 Cl N U -","- C128 H188 Cl4 N4 U4 -","4","1","","Christopher R. Graves; Ping Yang; Stosh A. Kozimor; Anthony E. Vaughn; David L. Clark; Steven D. Conradson; Eric J. Schelter; Brian L. Scott; J. D. Thompson; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Organometallic Uranium(V)-Imido Halide Complexes: From Synthesis to Electronic Structure and Bonding","Journal of the American Chemical Society","2008","130","","5272","5285","10.1021/ja711010h","","","0.71073","MoKα","","0.0556","0.0395","","","0.0976","0.1033","","","","","","1.367","","","","has coordinates,has disorder","178822","2020-10-21","18:00:00",""
"4107688","6.6794","0.0003","9.7679","0.0005","20.0851","0.0009","90","","90","","90","","1310.43","0.11","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O4 S -","- C13 H17 N O4 S -","- C52 H68 N4 O16 S4 -","4","1","","Aaron R. Thornton; Simon B. Blakey","Catalytic Metallonitrene/Alkyne Metathesis: A Powerful Cascade Process for the Synthesis of Nitrogen-Containing Molecules","Journal of the American Chemical Society","2008","130","","5020","5021","10.1021/ja7111788","","","1.54178","CuKα","","0.0217","0.0217","","","0.0573","0.0573","","","","","","1.079","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107689","27.957","0.007","7.6891","0.0017","11.327","0.002","90","","98.949","0.013","90","","2405.3","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H17 N O4 S -","- C10 H17 N O4 S -","- C80 H136 N8 O32 S8 -","8","1","","Aaron R. Thornton; Simon B. Blakey","Catalytic Metallonitrene/Alkyne Metathesis: A Powerful Cascade Process for the Synthesis of Nitrogen-Containing Molecules","Journal of the American Chemical Society","2008","130","","5020","5021","10.1021/ja7111788","","","1.54178","CuKα","","0.2518","0.1341","","","0.2789","0.3531","","","","","","1.14","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107690","7.3392","0.0002","9.704","0.0002","12.7562","0.0003","100.181","0.001","98.924","0.001","99.436","0.001","866.09","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H21 N O4 S -","- C19 H21 N O4 S -","- C38 H42 N2 O8 S2 -","2","1","","Aaron R. Thornton; Simon B. Blakey","Catalytic Metallonitrene/Alkyne Metathesis: A Powerful Cascade Process for the Synthesis of Nitrogen-Containing Molecules","Journal of the American Chemical Society","2008","130","","5020","5021","10.1021/ja7111788","","","1.54178","CuKα","","0.0334","0.0328","","","0.0913","0.0918","","","","","","1.051","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107691","14.9","0.002","14.9","0.002","38.795","0.005","90","","90","","90","","8613","2","123.2","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C47 H53 N O10 -","- C47 H50 N O10 -","- C376 H400 N8 O80 -","8","0.5","","Tomoki Ogoshi; Suguru Kanai; Shuhei Fujinami; Tada-aki Yamagishi; Yoshiaki Nakamoto","para-Bridged Symmetrical Pillar[5]arenes: Their Lewis Acid Catalyzed Synthesis and Host-Guest Property","Journal of the American Chemical Society","2008","130","","5022","5023","10.1021/ja711260m","","","0.7107","MoKα","","","0.0459","","","","0.0635","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107692","10.614","0.006","15.276","0.009","22.765","0.013","97.618","0.009","94.054","0.009","100.371","0.009","3582","4","193","2","193","2","","","","","","","","9","P -1","-P 1","2","","","","- C123 H114 B2 Cl18 F8 Fe4 O6 P8 S4 -","- C123 H114 B2 Cl18 F8 Fe4 O6 P8 S4 -","- C123 H114 B2 Cl18 F8 Fe4 O6 P8 S4 -","1","0.5","","Aaron K. Justice; Mark J. Nilges; Thomas B. Rauchfuss; Scott R. Wilson; Luca De Gioia; Giuseppe Zampella","Diiron Dithiolato Carbonyls Related to the HoxCO State of [FeFe]-Hydrogenase","Journal of the American Chemical Society","2008","130","","5293","5301","10.1021/ja7113008","","","0.71073","MoKα","","0.0836","0.0594","","","0.1778","0.1936","","","","","","1.038","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107693","10.5296","0.0009","16.4228","0.0014","19.2603","0.0016","88.476","0.006","74.783","0.005","86.22","0.005","3206.7","0.5","193","2","193","2","","","","","","","","8","P -1","-P 1","2","","","","- C60 H54 Cl6 F6 Fe2 O3 P5 S2 -","- C60 H54 Cl6 F6 Fe2 O3 P5 S2 -","- C120 H108 Cl12 F12 Fe4 O6 P10 S4 -","2","1","","Aaron K. Justice; Mark J. Nilges; Thomas B. Rauchfuss; Scott R. Wilson; Luca De Gioia; Giuseppe Zampella","Diiron Dithiolato Carbonyls Related to the HoxCO State of [FeFe]-Hydrogenase","Journal of the American Chemical Society","2008","130","","5293","5301","10.1021/ja7113008","","","0.71073","MoKα","","0.1456","0.0829","","","0.2139","0.2573","","","","","","1.041","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107694","19.3707","0.0004","19.3707","0.0004","32.1948","0.0006","90","","90","","90","","12080.3","0.4","93.1","","","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C51 H87 N O38 -","- C51 H54 N O38 -","- C408 H432 N8 O304 -","8","1","","Kazuhiro Yamauchi; Yoshinori Takashima; Akihito Hashidzume; Hiroyasu Yamaguchi; Akira Harada","Switching between Supramolecular Dimer and Nonthreaded Supramolecular Self-Assembly of Stilbene Amide-α-Cyclodextrin by Photoirradiation","Journal of the American Chemical Society","2008","130","","5024","5025","10.1021/ja7113135","","","1.54187","CuKα","","","0.1193","","","","0.3416","","","","","","1.202","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107695","8.8454","0.0002","11.7317","0.0002","28.2835","0.0008","90","","90","","90","","2935.02","0.12","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C40 H29 N O3 -","- C40 H29 N O3 -","- C160 H116 N4 O12 -","4","1","","Andrei V. Malkov; Pedro Ramírez-López; Lada Biedermannová; Lubomír Rulíšek; Lenka Dufková; Martin Kotora; Fujiang Zhu; Pavel Kočovský","On the Mechanism of Asymmetric Allylation of Aldehydes with Allyltrichlorosilanes Catalyzed by QUINOX, a Chiral IsoquinolineN-Oxide","Journal of the American Chemical Society","2008","130","","5341","5348","10.1021/ja711338q","","","1.54184","CuKα","","0.0399","0.0279","","","0.0541","0.0566","","","","","","0.822","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107696","8.4376","0.0003","11.0277","0.0004","12.2187","0.0004","67.767","0.001","87.205","0.001","75.778","0.001","1018.9","0.06","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H28 N2 O6 -","- C22 H28 N2 O6 -","- C44 H56 N4 O12 -","2","1","","Amy B. Dounay; Philip G. Humphreys; Larry E. Overman; Aaron D. Wrobleski","Total Synthesis of the Strychnos Alkaloid (+)-Minfiensine: Tandem Enantioselective Intramolecular Heck-Iminium Ion Cyclization","Journal of the American Chemical Society","2008","130","","5368","5377","10.1021/ja800163v","","","0.71073","MoKα","","0.0541","0.0392","","","0.0873","0.0967","","","","","","1.012","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107697","9.1441","0.001","11.2146","0.0012","13.2384","0.0014","90","","106.311","0.002","90","","1302.9","0.2","163","2","163","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H31 Br N2 O6 -","- C28 H31 Br N2 O6 -","- C56 H62 Br2 N4 O12 -","2","1","","Amy B. Dounay; Philip G. Humphreys; Larry E. Overman; Aaron D. Wrobleski","Total Synthesis of the Strychnos Alkaloid (+)-Minfiensine: Tandem Enantioselective Intramolecular Heck-Iminium Ion Cyclization","Journal of the American Chemical Society","2008","130","","5368","5377","10.1021/ja800163v","","","0.71073","MoKα","","0.0359","0.0293","","","0.0647","0.0681","","","","","","1.027","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107698","8.327","0.0009","13.7521","0.0015","14.4796","0.0016","90","","90","","90","","1658.1","0.3","163","2","163","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 N2 O3 -","- C20 H22 N2 O3 -","- C80 H88 N8 O12 -","4","1","","Amy B. Dounay; Philip G. Humphreys; Larry E. Overman; Aaron D. Wrobleski","Total Synthesis of the Strychnos Alkaloid (+)-Minfiensine: Tandem Enantioselective Intramolecular Heck-Iminium Ion Cyclization","Journal of the American Chemical Society","2008","130","","5368","5377","10.1021/ja800163v","","","0.71073","MoKα","","0.0354","0.0314","","","0.0774","0.0809","","","","","","1.053","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107699","7.0806","0.0007","12.8663","0.0013","18.7817","0.0019","90","","90","","90","","1711","0.3","163","2","163","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H24 N2 O3 -","- C20 H24 N2 O3 -","- C80 H96 N8 O12 -","4","1","","Amy B. Dounay; Philip G. Humphreys; Larry E. Overman; Aaron D. Wrobleski","Total Synthesis of the Strychnos Alkaloid (+)-Minfiensine: Tandem Enantioselective Intramolecular Heck-Iminium Ion Cyclization","Journal of the American Chemical Society","2008","130","","5368","5377","10.1021/ja800163v","","","0.71073","MoKα","","0.0336","0.0313","","","0.0815","0.0839","","","","","","1.075","","","","has coordinates","178822","2020-10-21","18:00:00",""
"4107700","19.114","0.005","20.233","0.005","25.671","0.005","109.406","0.005","99.042","0.005","92.413","0.005","9200","4","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","FeC60C6H4COOH5_THF","","- C280 H100 Fe2 O20 -","- C245 H132 Fe2 O32 -","- C490 H264 Fe4 O64 -","2","1","","Yutaka Matsuo; Katsuhiko Kanaizuka; Keiko Matsuo; Yu-Wu Zhong; Takahiro Nakae; Eiichi Nakamura","Photocurrent-Generating Properties of Organometallic Fullerene Molecules on an Electrode","Journal of the American Chemical Society","2008","130","","5016","5017","10.1021/ja800481d","","x-ray","0.71069","MoKα","","0.2116","0.1276","","","0.343","0.413","","","","","","1.264","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107701","8.822","0.0002","11.8739","0.0002","25.7218","0.0008","85.304","0.002","80.747","0.001","85.016","0.001","2642.96","0.11","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H62 N4 O21 -","- C54 H62 N4 O21 -","- C108 H124 N8 O42 -","2","1","","Catherine Hulot; Gaëlle Blond; Jean Suffert","Synthesis of [4.6.4.6]Fenestradienes and [4.6.4.6]Fenestrenes Based on an 8π-6π-Cyclization-Oxidation Cascade","Journal of the American Chemical Society","2008","130","","5046","5047","10.1021/ja800691c","","","0.71073","MoKα","","0.0951","0.0509","","","0.1224","0.1431","","","","","","1.047","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107702","12.6737","0.0001","12.6737","0.0001","61.6213","0.0008","90","","90","","90","","9897.78","0.17","153.1","","","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- Cs8 O95.25 Si2 W20 Zr4 -","- Cs7.96 O97 Si2 W20 Zr4 -","- Cs31.84 O388 Si8 W80 Zr16 -","4","0.5","","Yuji Kikukawa; Syuhei Yamaguchi; Kazutaka Tsuchida; Yoshinao Nakagawa; Kazuhiro Uehara; Kazuya Yamaguchi; Noritaka Mizuno","Synthesis and Catalysis of Di- and Tetranuclear Metal Sandwich-Type Silicotungstates [(γ-SiW10O36)2M2(μ-OH)2]10- and [(γ-SiW10O36)2M4(μ4-O)(μ-OH)6]8- (M = Zr or Hf)","Journal of the American Chemical Society","2008","130","","5472","5478","10.1021/ja078313i","","","0.71069","MoKα","","","0.0762","","","","0.2304","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107703","25.3315","0.0008","22.6699","0.0007","18.5533","0.0006","90","","123.9","0.0012","90","","8843.3","0.5","153.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Cs10 O78 Si2 W20 Zr2 -","- Cs10 O78 Si2 W20 Zr2 -","- Cs40 O312 Si8 W80 Zr8 -","4","0.5","","Yuji Kikukawa; Syuhei Yamaguchi; Kazutaka Tsuchida; Yoshinao Nakagawa; Kazuhiro Uehara; Kazuya Yamaguchi; Noritaka Mizuno","Synthesis and Catalysis of Di- and Tetranuclear Metal Sandwich-Type Silicotungstates [(γ-SiW10O36)2M2(μ-OH)2]10- and [(γ-SiW10O36)2M4(μ4-O)(μ-OH)6]8- (M = Zr or Hf)","Journal of the American Chemical Society","2008","130","","5472","5478","10.1021/ja078313i","","","0.71069","MoKα","","","0.0739","","","","0.2701","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107704","12.6813","0.0001","12.6813","0.0001","61.5483","0.0009","90","","90","","90","","9897.91","0.18","153.1","","","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- Cs8 Hf4 O97 Si2 W20 -","- Cs7.98 Hf4 O97 Si2 W20 -","- Cs31.92 Hf16 O388 Si8 W80 -","4","0.5","","Yuji Kikukawa; Syuhei Yamaguchi; Kazutaka Tsuchida; Yoshinao Nakagawa; Kazuhiro Uehara; Kazuya Yamaguchi; Noritaka Mizuno","Synthesis and Catalysis of Di- and Tetranuclear Metal Sandwich-Type Silicotungstates [(γ-SiW10O36)2M2(μ-OH)2]10- and [(γ-SiW10O36)2M4(μ4-O)(μ-OH)6]8- (M = Zr or Hf)","Journal of the American Chemical Society","2008","130","","5472","5478","10.1021/ja078313i","","","0.71073","MoKα","","","0.0835","","","","0.2133","","","","","","1.064","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4107705","25.3847","0.0016","22.6121","0.0014","18.8703","0.0011","90","","124.046","0.003","90","","8974.9","1","153.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Cs10 Hf2 O86 Si2 W20 -","- Cs10.01 Hf2 O86 Si2 W20 -","- Cs40.04 Hf8 O344 Si8 W80 -","4","0.5","","Yuji Kikukawa; Syuhei Yamaguchi; Kazutaka Tsuchida; Yoshinao Nakagawa; Kazuhiro Uehara; Kazuya Yamaguchi; Noritaka Mizuno","Synthesis and Catalysis of Di- and Tetranuclear Metal Sandwich-Type Silicotungstates [(γ-SiW10O36)2M2(μ-OH)2]10- and [(γ-SiW10O36)2M4(μ4-O)(μ-OH)6]8- (M = Zr or Hf)","Journal of the American Chemical Society","2008","130","","5472","5478","10.1021/ja078313i","","","0.71069","MoKα","","","0.0644","","","","0.211","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107706","10.303","0.0002","10.9384","0.0002","14.1351","0.0003","93.0804","0.0006","109.592","0.0007","114.887","0.0009","1325.56","0.05","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H47 N5 O2 -","- C25 H47 N5 O2 -","- C50 H94 N10 O4 -","2","1","","Tom F. A. de Greef; G. B. W. L. Ligthart; Martin Lutz; Anthony L. Spek; E. W. Meijer; Rint P. Sijbesma","The Mechanism of Ureido-Pyrimidinone:2,7-Diamido-Naphthyridine Complexation and the Presence of Kinetically Controlled Pathways in Multicomponent Hydrogen-Bonded Systems","Journal of the American Chemical Society","2008","130","","5479","5486","10.1021/ja709971y","","","0.71073","MoKα","","0.0769","0.0474","","","0.1129","0.1266","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107707","10.37","0.004","11.147","0.005","16.958","0.006","81.84","0.02","71.978","0.016","86.48","0.02","1844.9","1.3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H122 Co N2 O8 -","- C74 H122 Co N2 O8 -","- C74 H122 Co N2 O8 -","1","0.5","","Daisuke Kiriya; Ho-Chol Chang; Susumu Kitagawa","Molecule-Based Valence Tautomeric Bistability Synchronized with a Macroscopic Crystal-Melt Phase Transition","Journal of the American Chemical Society","2008","130","","5515","5522","10.1021/ja711268u","","","0.7107","MoKα","","0.0614","0.0564","","","0.1554","0.1623","","","","","","1.064","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107708","10.3238","0.0019","11.0821","0.0019","20.529","0.003","72.571","0.007","75.31","0.009","85.763","0.01","2167.6","0.6","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C86 H146 Co N2 O8 -","- C86 H146 Co N2 O8 -","- C86 H146 Co N2 O8 -","1","0.5","","Daisuke Kiriya; Ho-Chol Chang; Susumu Kitagawa","Molecule-Based Valence Tautomeric Bistability Synchronized with a Macroscopic Crystal-Melt Phase Transition","Journal of the American Chemical Society","2008","130","","5515","5522","10.1021/ja711268u","","","0.7107","MoKα","","0.0581","0.0569","","","0.1546","0.1563","","","","","","1.05","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107709","10.239","0.005","11.233","0.007","23.234","0.013","85.803","0.013","77.468","0.015","86.421","0.013","2599","3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C106 H186 Co N2 O8 -","- C106 H186 Co N2 O8 -","- C106 H186 Co N2 O8 -","1","0.5","","Daisuke Kiriya; Ho-Chol Chang; Susumu Kitagawa","Molecule-Based Valence Tautomeric Bistability Synchronized with a Macroscopic Crystal-Melt Phase Transition","Journal of the American Chemical Society","2008","130","","5515","5522","10.1021/ja711268u","","","0.7107","MoKα","","0.0771","0.0648","","","0.1679","0.1836","","","","","","1.045","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107710","8.1971","0.0016","12.382","0.002","8.2137","0.0016","90","","96.243","0.004","90","","828.7","0.3","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H18 Br N O3 -","- C17 H18 Br N O3 -","- C34 H36 Br2 N2 O6 -","2","1","","Peng Fu; Marc L. Snapper; Amir H. Hoveyda","Catalytic Asymmetric Alkylations of Ketoimines. Enantioselective Synthesis of N-Substituted Quaternary Carbon Stereogenic Centers by Zr-Catalyzed Additions of Dialkylzinc Reagents to Aryl-, Alkyl-, and Trifluoroalkyl-Substituted Ketoimines","Journal of the American Chemical Society","2008","130","","5530","5541","10.1021/ja8001343","","","0.71073","MoKα","","0.0603","0.0492","","","0.1275","0.1342","","","","","","1.056","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107711","8.406","0.0016","8.9678","0.0017","9.7905","0.0019","99.208","0.003","101.481","0.003","90.237","0.003","713.5","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C32 H30 N2 O6 -","2","1","","Peng Fu; Marc L. Snapper; Amir H. Hoveyda","Catalytic Asymmetric Alkylations of Ketoimines. Enantioselective Synthesis of N-Substituted Quaternary Carbon Stereogenic Centers by Zr-Catalyzed Additions of Dialkylzinc Reagents to Aryl-, Alkyl-, and Trifluoroalkyl-Substituted Ketoimines","Journal of the American Chemical Society","2008","130","","5530","5541","10.1021/ja8001343","","","0.71073","MoKα","","0.072","0.0562","","","0.1305","0.1402","","","","","","1.101","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107712","6.464","0.003","8.621","0.004","29.556","0.011","90","","90","","90","","1647","1.2","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 Br N O3 -","- C17 H18 Br N O3 -","- C68 H72 Br4 N4 O12 -","4","1","","Peng Fu; Marc L. Snapper; Amir H. Hoveyda","Catalytic Asymmetric Alkylations of Ketoimines. Enantioselective Synthesis of N-Substituted Quaternary Carbon Stereogenic Centers by Zr-Catalyzed Additions of Dialkylzinc Reagents to Aryl-, Alkyl-, and Trifluoroalkyl-Substituted Ketoimines","Journal of the American Chemical Society","2008","130","","5530","5541","10.1021/ja8001343","","","0.71073","MoKα","","0.0338","0.0293","","","0.0685","0.0699","","","","","","0.995","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107713","17.481","0.017","10.909","0.01","8.872","0.008","90","","92.071","0.018","90","","1691","3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O3 -","- C20 H18 O3 -","- C80 H72 O12 -","4","1","","Qing-Gang Wang; Xian-Ming Deng; Ben-Hu Zhu; Long-Wu Ye; Xiu-Li Sun; Chuan-Ying Li; Chun-Yin Zhu; Qi Shen; Yong Tang","Tandem Michael Addition/Ylide Epoxidation for the Synthesis of Highly Functionalized Cyclohexadiene Epoxide Derivatives","Journal of the American Chemical Society","2008","130","","5408","5409","10.1021/ja800747m","","","0.71073","MoKα","","0.2114","0.0838","","","0.2453","0.3628","","","","","","0.871","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107714","7.7112","0.001","8.5369","0.0011","18.596","0.002","90","","97.402","0.003","90","","1214","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","","Qing-Gang Wang; Xian-Ming Deng; Ben-Hu Zhu; Long-Wu Ye; Xiu-Li Sun; Chuan-Ying Li; Chun-Yin Zhu; Qi Shen; Yong Tang","Tandem Michael Addition/Ylide Epoxidation for the Synthesis of Highly Functionalized Cyclohexadiene Epoxide Derivatives","Journal of the American Chemical Society","2008","130","","5408","5409","10.1021/ja800747m","","","0.71073","MoKα","","0.0749","0.0504","","","0.118","0.1274","","","","","","0.917","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107715","6.2797","0.0015","24.896","0.006","10.252","0.002","90","","93.604","0.004","90","","1599.6","0.6","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C19 H19 Br O2 -","- C19 H19 Br O2 -","- C76 H76 Br4 O8 -","4","1","","Qing-Gang Wang; Xian-Ming Deng; Ben-Hu Zhu; Long-Wu Ye; Xiu-Li Sun; Chuan-Ying Li; Chun-Yin Zhu; Qi Shen; Yong Tang","Tandem Michael Addition/Ylide Epoxidation for the Synthesis of Highly Functionalized Cyclohexadiene Epoxide Derivatives","Journal of the American Chemical Society","2008","130","","5408","5409","10.1021/ja800747m","","","0.71073","MoKα","","0.0809","0.0618","","","0.1451","0.1785","","","","","","1.004","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107716","12.5823","0.0014","14.2036","0.0016","19.828","0.002","83.4582","0.0013","73.2027","0.0014","86.7306","0.0014","3369.2","0.6","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C68 H51 B F24 Fe Ga I P2 -","- C67.408 H50.778 B0.9815 F23.5575 Fe Ga I1.0185 P2 -","- C134.816 H101.556 B1.963 F47.115 Fe2 Ga2 I2.037 P4 -","2","1","","Natalie D. Coombs; William Clegg; Amber L. Thompson; David J. Willock; Simon Aldridge","A Group 13/Group 17 Analogue of CO and N2: Coordinative Trapping of the GaI Molecule","Journal of the American Chemical Society","2008","130","","5449","5451","10.1021/ja800876k","","","0.671","synchrotron","","0.0931","0.0575","","","0.1388","0.1571","","","","","","1.041","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107717","11.0237","0.0002","19.0641","0.0003","22.2038","0.0004","109.44","0.001","95.792","0.001","90.752","0.001","4372.37","0.13","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C44.75 H49 Fe Ga I2 P2 -","- C44.75 H49 Fe Ga I2 P2 -","- C179 H196 Fe4 Ga4 I8 P8 -","4","2","","Natalie D. Coombs; William Clegg; Amber L. Thompson; David J. Willock; Simon Aldridge","A Group 13/Group 17 Analogue of CO and N2: Coordinative Trapping of the GaI Molecule","Journal of the American Chemical Society","2008","130","","5449","5451","10.1021/ja800876k","","","0.71073","MoKα","","0.139","0.0663","","","0.1484","0.1776","","","","","","1.008","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107718","12.0861","0.0012","14.1868","0.0015","7.3728","0.0007","90","","90","","90","","1264.2","0.2","200","2","200","2","","","","","","","chemical synthesis","6","P n m a","-P 2ac 2n","62","","Diaquacobalt Tetracyanopalladate Tetrahydrate","","- C4 H12 Co N4 O6 Pd -","- C4 H12 Co N4 O6 Pd -","- C16 H48 Co4 N16 O24 Pd4 -","4","0.5","","Martina Vondrova; Tyrel M. McQueen; Christine M. Burgess; Douglas M. Ho; Andrew B. Bocarsly","Autoreduction of Pd-Co and Pt-Co Cyanogels: Exploration of Cyanometalate Coordination Chemistry at Elevated Temperatures","Journal of the American Chemical Society","2008","130","","5563","5572","10.1021/ja8009764","","","0.71073","MoKα","","0.0813","0.0531","","0.1449","","0.1263","","","1.064","","","1.153","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107719","8.311","0.0018","19.218","0.007","14.77","0.004","90","","97.658","0.013","90","","2338","1.2","298.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H27 Cl O4 -","- C26 H27 Cl O4 -","- C104 H108 Cl4 O16 -","4","1","","Ken-ichiro Kanno; Eri Igarashi; Lishan Zhou; Kiyohiko Nakajima; Tamotsu Takahashi","Selective Linear Triene Formation from Different Alkynes using Zr/Cu system","Journal of the American Chemical Society","2008","130","","5624","5625","10.1021/ja8000387","","","0.71075","MoKα","","","0.0461","","","","0.0927","","","","","","1.094","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107720","8.462","0.003","20.401","0.005","19.553","0.008","90","","92.919","0.014","90","","3371","2","298.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H35 Cl O6 S -","- C35 H35 Cl O6 S -","- C140 H140 Cl4 O24 S4 -","4","1","","Ken-ichiro Kanno; Eri Igarashi; Lishan Zhou; Kiyohiko Nakajima; Tamotsu Takahashi","Selective Linear Triene Formation from Different Alkynes using Zr/Cu system","Journal of the American Chemical Society","2008","130","","5624","5625","10.1021/ja8000387","","","0.71075","MoKα","","","0.0458","","","","0.0621","","","","","","0.997","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107721","6.33947","0.00012","11.379","0.00012","23.8625","0.0007","90","","90","","90","","1721.37","0.06","153.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 N2 O3 -","- C18 H22 N2 O3 -","- C72 H88 N8 O12 -","4","1","","Akihiro Nojiri; Naoya Kumagai; Masakatsu Shibasaki","Asymmetric Catalysis via Dynamic Substrate/Ligand/Rare Earth Metal Conglomerate","Journal of the American Chemical Society","2008","130","","5630","5631","10.1021/ja800326d","","","1.54187","CuKα","","","0.0314","","","","0.0718","","","","","","1.152","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107722","7.49574","0.00016","10.9673","0.0002","21.8976","0.0005","90","","90","","90","","1800.16","0.07","153.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H24 N2 O3 -","- C19 H24 N2 O3 -","- C76 H96 N8 O12 -","4","1","","Akihiro Nojiri; Naoya Kumagai; Masakatsu Shibasaki","Asymmetric Catalysis via Dynamic Substrate/Ligand/Rare Earth Metal Conglomerate","Journal of the American Chemical Society","2008","130","","5630","5631","10.1021/ja800326d","","","1.54187","CuKα","","","0.0328","","","","0.0848","","","","","","1.199","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107723","13.5139","0.0003","13.5518","0.0003","20.3459","0.0004","89.7632","0.0011","89.9457","0.0011","87.7746","0.0011","3723.26","0.14","153.1","","","","","","","","","","","5","P 1","P 1","1","","","","- C18 H21 Cl N2 O3 -","- C18 H21 Cl N2 O3 -","- C144 H168 Cl8 N16 O24 -","8","8","","Akihiro Nojiri; Naoya Kumagai; Masakatsu Shibasaki","Asymmetric Catalysis via Dynamic Substrate/Ligand/Rare Earth Metal Conglomerate","Journal of the American Chemical Society","2008","130","","5630","5631","10.1021/ja800326d","","","1.54187","CuKα","","","0.052","","","","0.1576","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107724","15.2764","0.0003","12.2814","0.0002","21.5584","0.0004","90","","109.255","0.0013","90","","3818.44","0.12","93.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H26 N2 O3 -","- C20 H26 N2 O3 -","- C160 H208 N16 O24 -","8","1","","Akihiro Nojiri; Naoya Kumagai; Masakatsu Shibasaki","Asymmetric Catalysis via Dynamic Substrate/Ligand/Rare Earth Metal Conglomerate","Journal of the American Chemical Society","2008","130","","5630","5631","10.1021/ja800326d","","","1.54187","CuKα","","","0.0668","","","","0.2175","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107725","22.818","0.007","13.06","0.004","11.516","0.003","90","","100.102","0.006","90","","3378.6","1.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H46 Cl3 N3 O3 -","- C34 H44.92 Cl3 N3 O3 -","- C136 H179.68 Cl12 N12 O12 -","4","1","","Pierre Baillargeon; Yves L. Dory","Rational Design and Gas-Phase Characterization of Molecular Capsules by Self-Assembly of a Symmetric Hexasubstituted Benzene with Seven-Membered Lactams","Journal of the American Chemical Society","2008","130","","5640","5641","10.1021/ja800734b","","","0.71073","MoKα","","0.0646","0.0424","","","0.1245","0.1391","","","","","","1.074","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107726","8.4827","0.0009","13.8667","0.0017","18.602","0.006","90","","101.033","0.015","90","","2147.7","0.8","","","110","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 Cl3 Cu N4 O4 -","- C19 H19 Cl3 Cu N4 O4 -","- C76 H76 Cl12 Cu4 N16 O16 -","4","1","","Debabrata Maiti; Amy A. Narducci Sarjeant; Shinobu Itoh; Kenneth D. Karlin","Suggestion of an Organometallic Intermediate in an Intramolecular Dechlorination Reaction Involving Copper(I) and a ArCH2Cl Moiety","Journal of the American Chemical Society","2008","130","","5644","5645","10.1021/ja800795b","","","0.71073","MoKα","","0.058","0.0374","","","0.1003","0.1107","","","","","","1.093","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107727","12.7444","0.0019","12.953","0.002","14.82","0.003","64.73","0.02","84.485","0.015","83.126","0.013","2193.7","0.7","","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C44 H21 B Cl4 Cu F20 N4 -","- C44 H21 B Cl4 Cu F20 N4 -","- C88 H42 B2 Cl8 Cu2 F40 N8 -","2","1","","Debabrata Maiti; Amy A. Narducci Sarjeant; Shinobu Itoh; Kenneth D. Karlin","Suggestion of an Organometallic Intermediate in an Intramolecular Dechlorination Reaction Involving Copper(I) and a ArCH2Cl Moiety","Journal of the American Chemical Society","2008","130","","5644","5645","10.1021/ja800795b","","","0.71073","MoKα","","0.0754","0.0473","","","0.1257","0.1471","","","","","","1.136","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107728","21.57","0.0008","22.1013","0.0008","10.0759","0.0003","90","","90","","90","","4803.4","0.3","93.1","","","","","","","","","","","6","P b a 2","P 2 -2ab","32","","","","- C48 H128 Cl8 N28 Ni4 O54 -","- C48 H108 Cl8 N28 Ni4 O54 -","- C96 H216 Cl16 N56 Ni8 O108 -","2","0.5","","Ryosuke Miyake; Shohei Tashiro; Motoo Shiro; Kentaro Tanaka; Mitsuhiko Shionoya","Ni(II)-Mediated Self-Assembly of Artificial β-Dipeptides Forming a Macrocyclic Tetranuclear Complex with Interior Spaces for In-Line Molecular Arrangement","Journal of the American Chemical Society","2008","130","","5646","5647","10.1021/ja8009555","","","0.71075","MoKα","","","0.0705","","","","0.2274","","","","","","1.092","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107729","11.331","0.003","17.97","0.004","15.809","0.003","90","","110.63","0.004","90","","3012.6","1.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H37 N5 O Sn3 -","- C29 H37 N5 O Sn3 -","- C116 H148 N20 O4 Sn12 -","4","1","","Alexander V. Zabula; Tania Pape; Alexander Hepp; Falko M. Schappacher; Ute Ch. Rodewald; Rainer Pöttgen; F. Ekkehardt Hahn","Trapping of Tin(II) and Lead(II) Homologues of Carbon Monoxide by a Benzannulated Lutidine-Bridged Bisstannylene","Journal of the American Chemical Society","2008","130","","5648","5649","10.1021/ja801000b","","","0.71073","MoKα","","0.0542","0.0381","","","0.079","0.0843","","","","","","1.018","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107730","13.944","0.0016","17.45","0.002","18.007","0.002","114.633","0.002","112.534","0.002","91.377","0.002","3589.5","0.7","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.5 H44.5 N5 O1.5 Pb Sn2 -","- C32.5 H44.5 N5 O1.5 Pb Sn2 -","- C130 H178 N20 O6 Pb4 Sn8 -","4","2","","Alexander V. Zabula; Tania Pape; Alexander Hepp; Falko M. Schappacher; Ute Ch. Rodewald; Rainer Pöttgen; F. Ekkehardt Hahn","Trapping of Tin(II) and Lead(II) Homologues of Carbon Monoxide by a Benzannulated Lutidine-Bridged Bisstannylene","Journal of the American Chemical Society","2008","130","","5648","5649","10.1021/ja801000b","","","0.71073","MoKα","","0.0691","0.0468","","","0.1184","0.1276","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107731","11.4513","0.0005","12.4207","0.0008","15.2454","0.0006","90","","90","","90","","2168.4","0.19","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","none","","","- C20 H24 Br N O8 -","- C20 H24 Br N O8 -","- C80 H96 Br4 N4 O32 -","4","1","","Xiao-Hua Chen; Wen-Quan Zhang; Liu-Zhu Gong","Asymmetric Organocatalytic Three-Component 1,3-Dipolar Cycloaddition: Control of Stereochemistry via a Chiral Brønsted Acid Activated Dipole","Journal of the American Chemical Society","2008","130","","5652","5653","10.1021/ja801034e","","","0.71073","MoKα","","0.0837","0.0422","","","0.0956","0.1081","","","","","","0.982","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107732","10.251","0.003","9.229","0.002","14.677","0.004","90","","110.152","0.004","90","","1303.5","0.6","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H30 N O6 P -","- C28 H30 N O6 P -","- C56 H60 N2 O12 P2 -","2","1","","Yuan-Qing Fang; Eric N. Jacobsen","Cooperative, Highly Enantioselective Phosphinothiourea Catalysis of Imine-Allene [3 + 2] Cycloadditions","Journal of the American Chemical Society","2008","130","","5660","5661","10.1021/ja801344w","","","0.71073","MoKα","","0.0347","0.0318","","","0.0777","0.0799","","","","","","1.036","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107733","11.65564","0.00013","15.77604","0.00014","15.8509","0.0002","90","","114.267","0.001","90","","2657.12","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H29 N4 O4 Re -","- C29 H29 N4 O4 Re -","- C116 H116 N16 O16 Re4 -","4","1","","Miguel A. Huertos; Julio Pérez; Lucía Riera","Pyridine Ring Opening at Room Temperature at a Rhenium Tricarbonyl Bipyridine Complex","Journal of the American Chemical Society","2008","130","","5662","5663","10.1021/ja801655d","","","1.54184","CuKα","","0.051","0.0423","","","0.1183","0.1269","","","","","","1.241","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107734","11.4968","0.0001","24.969","0.0002","27.7281","0.0002","90","","90","","90","","7959.73","0.11","150","2","150","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 Cl6 F3 N4 O6 Re S -","- C32 H30 Cl6 F3 N4 O6 Re S -","- C256 H240 Cl48 F24 N32 O48 Re8 S8 -","8","2","","Miguel A. Huertos; Julio Pérez; Lucía Riera","Pyridine Ring Opening at Room Temperature at a Rhenium Tricarbonyl Bipyridine Complex","Journal of the American Chemical Society","2008","130","","5662","5663","10.1021/ja801655d","","","1.54184","CuKα","","0.0585","0.0548","","","0.1418","0.1507","","","","","","1.056","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107735","13.9458","0.0002","13.27459","0.00014","14.1729","0.0002","90","","118.462","0.002","90","","2306.63","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 F3 N4 O6 Re S -","- C20 H18 F3 N4 O6 Re S -","- C80 H72 F12 N16 O24 Re4 S4 -","4","1","","Miguel A. Huertos; Julio Pérez; Lucía Riera","Pyridine Ring Opening at Room Temperature at a Rhenium Tricarbonyl Bipyridine Complex","Journal of the American Chemical Society","2008","130","","5662","5663","10.1021/ja801655d","","","1.54184","CuKα","","0.0391","0.0357","","","0.0816","0.0844","","","","","","1.126","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107736","10.2268","0.0009","10.6062","0.0009","32.651","0.003","90","","96.251","0.004","90","","3520.5","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","HEYDUK03","","","- C36 H61 N2 O2 -","- C36 H61 N2 O2 -","- C144 H244 N8 O8 -","4","1","","Shawn M. Carter; Allyson Sia; Michael J. Shaw; Alan F. Heyduk","Isolation and Characterization of a Neutral Imino-semiquinone Radical","Journal of the American Chemical Society","2008","130","","5838","5839","10.1021/ja711185s","","","1.54178","CuKα","","0.0466","0.042","","","0.1032","0.1064","","","","","","1.044","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4107737","17.5624","0.0019","17.986","0.002","11.7992","0.0012","90","","108.469","0.002","90","","3535.1","0.7","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H29 N O -","- C18 H29 N O -","- C144 H232 N8 O8 -","8","2","","Shawn M. Carter; Allyson Sia; Michael J. Shaw; Alan F. Heyduk","Isolation and Characterization of a Neutral Imino-semiquinone Radical","Journal of the American Chemical Society","2008","130","","5838","5839","10.1021/ja711185s","","","0.71073","MoKα","","0.0723","0.046","","","0.1081","0.1251","","","","","","1.03","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107738","8.8928","0.0009","11.4651","0.0012","13.0649","0.0013","68.666","0.002","80.702","0.002","84.965","0.002","1223.9","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H31 Cl N3 O1.5 Rh2 -","- C26 H30 Cl N3 O1.5 Rh2 -","- C52 H60 Cl2 N6 O3 Rh4 -","2","1","","Cristina Tejel; Miguel A. Ciriano; M. Pilar del Río; Fieke van den Bruele; Dennis G. H. Hetterscheid; Nearchos Tsichlis i Spithas; Bas de Bruin","Deprotonation Induced Ligand-to-Metal Electron Transfer: Synthesis of a Mixed-Valence Rh(-I,I) Dinuclear Compound and Its Reaction with Dioxygen","Journal of the American Chemical Society","2008","130","","5844","5845","10.1021/ja711495v","","","0.71073","MoKα","","0.0719","0.0432","","","0.0871","0.0967","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107739","9.433","0.002","21.488","0.006","10.523","0.002","90","","92.052","0.013","90","","2131.6","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 N3 Rh2 -","- C26 H27 N3 Rh2 -","- C104 H108 N12 Rh8 -","4","1","","Cristina Tejel; Miguel A. Ciriano; M. Pilar del Río; Fieke van den Bruele; Dennis G. H. Hetterscheid; Nearchos Tsichlis i Spithas; Bas de Bruin","Deprotonation Induced Ligand-to-Metal Electron Transfer: Synthesis of a Mixed-Valence Rh(-I,I) Dinuclear Compound and Its Reaction with Dioxygen","Journal of the American Chemical Society","2008","130","","5844","5845","10.1021/ja711495v","","","0.71073","MoKα","","0.0431","0.0329","","","0.073","0.0764","","","","","","1.033","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107740","7.365","0.0006","10.5869","0.0009","11.1271","0.0009","107.099","0.001","93.07","0.001","109.79","0.001","768.89","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H18 N3 O Rh -","- C19 H18 N3 O Rh -","- C38 H36 N6 O2 Rh2 -","2","1","","Cristina Tejel; Miguel A. Ciriano; M. Pilar del Río; Fieke van den Bruele; Dennis G. H. Hetterscheid; Nearchos Tsichlis i Spithas; Bas de Bruin","Deprotonation Induced Ligand-to-Metal Electron Transfer: Synthesis of a Mixed-Valence Rh(-I,I) Dinuclear Compound and Its Reaction with Dioxygen","Journal of the American Chemical Society","2008","130","","5844","5845","10.1021/ja711495v","","","0.71073","MoKα","","0.0223","0.0211","","","0.0532","0.0538","","","","","","1.068","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107741","19.81","0.003","19.81","0.003","14.18","0.002","90","","90","","120","","4819.2","1.2","123","2","123","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C8 H16 Cu N3 O -","- C8 H16 Cu N3 O -","- C144 H288 Cu18 N54 O18 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Exceptional Framework Flexibility and Sorption Behavior of a Multifunctional Porous Cuprous Triazolate Framework","Journal of the American Chemical Society","2008","130","","6010","6017","10.1021/ja800550a","","","0.71073","MoKα","","0.0407","0.0363","","","0.096","0.0993","","","","","","1.028","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107742","19.6891","0.0008","19.6891","0.0008","14.1971","0.0007","90","","90","","120","","4766.3","0.4","123","2","123","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6 H10 Cu N3 -","- C6 H10 Cu N3 -","- C108 H180 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Exceptional Framework Flexibility and Sorption Behavior of a Multifunctional Porous Cuprous Triazolate Framework","Journal of the American Chemical Society","2008","130","","6010","6017","10.1021/ja800550a","","","0.71073","MoKα","","0.0482","0.0402","","","0.0732","0.077","","","","","","1.014","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107743","11.949","0.002","12.263","0.004","13.213","0.004","108.677","0.002","108.348","0.001","104.458","0.003","1603.2","0.8","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H39 Cu3 N12 -","- C24 H39 Cu3 N12 -","- C48 H78 Cu6 N24 -","2","1","","Jie-Peng Zhang; Xiao-Ming Chen","Exceptional Framework Flexibility and Sorption Behavior of a Multifunctional Porous Cuprous Triazolate Framework","Journal of the American Chemical Society","2008","130","","6010","6017","10.1021/ja800550a","","","0.71073","MoKα","","0.0564","0.0436","","","0.082","0.0887","","","","","","1.01","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107744","19.429","0.0017","19.429","0.0017","14.321","0.0019","90","","90","","120","","4681.7","0.8","123","2","123","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C7 H14 Cu N3 O -","- C7 H14 Cu N3 O -","- C126 H252 Cu18 N54 O18 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Exceptional Framework Flexibility and Sorption Behavior of a Multifunctional Porous Cuprous Triazolate Framework","Journal of the American Chemical Society","2008","130","","6010","6017","10.1021/ja800550a","","","0.71073","MoKα","","0.0293","0.0266","","","0.0573","0.0587","","","","","","1.037","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107745","19.6052","0.0005","19.6052","0.0005","14.242","0.0004","90","","90","","120","","4740.7","0.2","93","2","93","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6 H10 Cu N4 -","- C6 H10 Cu N4 -","- C108 H180 Cu18 N72 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Exceptional Framework Flexibility and Sorption Behavior of a Multifunctional Porous Cuprous Triazolate Framework","Journal of the American Chemical Society","2008","130","","6010","6017","10.1021/ja800550a","","","0.71073","MoKα","","0.0367","0.0327","","","0.0734","0.0761","","","","","","1.015","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107746","8.101","0.004","23.939","0.012","7.943","0.004","90","","103.897","0.01","90","","1495.3","1.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H30 N O3 -","- C16 H23 N O3 -","- C64 H92 N4 O12 -","4","1","","Kevin J. Frankowski; Jennifer E. Golden; Yibin Zeng; Yao Lei; Jeffrey Aubé","Syntheses of the Stemona Alkaloids (\±)-Stenine, (\±)-Neostenine, and (\±)-13-Epineostenine Using a Stereodivergent Diels-Alder/Azido-Schmidt Reaction","Journal of the American Chemical Society","2008","130","","6018","6024","10.1021/ja800574m","","","0.71073","MoKα","","0.1136","0.0999","","","0.2498","0.2569","","","","","","1.068","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107747","9.266","0.0008","9.7945","0.0008","9.8086","0.0008","98.42","0.002","109.421","0.002","111.49","0.002","743.78","0.11","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H27 N O2 -","- C17 H27 N O2 -","- C34 H54 N2 O4 -","2","1","","Kevin J. Frankowski; Jennifer E. Golden; Yibin Zeng; Yao Lei; Jeffrey Aubé","Syntheses of the Stemona Alkaloids (\±)-Stenine, (\±)-Neostenine, and (\±)-13-Epineostenine Using a Stereodivergent Diels-Alder/Azido-Schmidt Reaction","Journal of the American Chemical Society","2008","130","","6018","6024","10.1021/ja800574m","","","0.71073","MoKα","","0.0507","0.0432","","","0.1116","0.1156","","","","","","0.998","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107748","12.4012","0.0003","16.6358","0.0006","10.2988","0.0003","90","","90","","90","","2124.68","0.11","173","2","173","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C25 H34 Zr -","- C25 H34 Zr -","- C100 H136 Zr4 -","4","0.5","","Doris Pun; Emil Lobkovsky; Paul J. Chirik","Indenyl Zirconium Dinitrogen Chemistry: N2 Coordination to an Isolated Zirconium Sandwich and Synthesis of Side-on, End-on Dinitrogen Compounds","Journal of the American Chemical Society","2008","130","","6047","6054","10.1021/ja801021w","","","0.71073","MoKα","","0.0455","0.0316","","","0.0742","0.0813","","","","","","1.035","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107749","13.5456","0.0006","17.1401","0.0008","18.5216","0.0009","90","","90","","90","","4300.2","0.3","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C46 H60 N2 Zr2 -","- C46 H60 N2 Zr2 -","- C184 H240 N8 Zr8 -","4","0.5","","Doris Pun; Emil Lobkovsky; Paul J. Chirik","Indenyl Zirconium Dinitrogen Chemistry: N2 Coordination to an Isolated Zirconium Sandwich and Synthesis of Side-on, End-on Dinitrogen Compounds","Journal of the American Chemical Society","2008","130","","6047","6054","10.1021/ja801021w","","","0.71073","MoKα","","0.0555","0.0391","","","0.0979","0.1038","","","","","","1.098","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107750","11.7576","0.0007","12.0196","0.0007","24.3109","0.0016","90","","90","","90","","3435.7","0.4","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C152 H168 N8 O24 -","8","2","","Mathieu Branca; Didier Gori; Régis Guillot; Valérie Alezra; Cyrille Kouklovsky","Tertiary Aromatic Amide for Memory of Chirality: Access to Enantioenriched α-Substituted Valine","Journal of the American Chemical Society","2008","130","","5864","5865","10.1021/ja801165z","","x-ray","0.71073","MoKα","","0.0592","0.0445","","","0.1007","0.1083","","","","","","1.07","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107751","16.156","0.003","17.388","0.003","18.641","0.003","106.359","0.003","105.492","0.002","90.897","0.003","4818.6","1.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C176 H230 Au25 N S18 -","- C176 H230 Au25 N S18 -","- C176 H230 Au25 N S18 -","1","0.5","","Manzhou Zhu; Christine M. Aikens; Frederick J. Hollander; George C. Schatz; Rongchao Jin","Correlating the Crystal Structure of A Thiol-Protected Au25 Cluster and Optical Properties","Journal of the American Chemical Society","2008","130","","5883","5885","10.1021/ja801173r","","","0.71073","MoKα","","0.053","0.0314","","","0.0569","0.0614","","","","","","0.944","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107752","9.6521","0.0007","11.1645","0.0008","27.4646","0.0018","90","","90","","90","","2959.6","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H37 Cl N2 O6 -","- C28 H37 Cl N2 O6 -","- C112 H148 Cl4 N8 O24 -","4","1","","Anand Singh; Jeffrey N. Johnston","A Diastereo- and Enantioselective Synthesis of α-Substituted syn-α,β-Diamino Acids","Journal of the American Chemical Society","2008","130","","5866","5867","10.1021/ja8011808","","","0.71073","MoKα","","0.0625","0.04","","","0.0864","0.0965","","","","","","1.02","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4107753","12.1315","0.0015","9.6222","0.0012","27.912","0.003","90","","95.13","0.003","90","","3245.2","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H46 Ir N O P2 -","- C33 H46 Ir N O P2 -","- C132 H184 Ir4 N4 O4 P8 -","4","1","","Matthew T. Whited; Robert H. Grubbs","Oxygen-Atom Transfer from Carbon Dioxide to a Fischer Carbene at (PNP)Ir","Journal of the American Chemical Society","2008","130","","5874","5875","10.1021/ja801865c","","","0.71073","MoKα","","0.0488","0.0304","","","0.0487","0.0502","","","","","","1.685","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107754","15.554","0.004","11.303","0.003","18.303","0.004","90","","91.557","0.008","90","","3216.6","1.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H50 Ir N O P2 -","- C31 H50 Ir N O P2 -","- C124 H200 Ir4 N4 O4 P8 -","4","1","","Matthew T. Whited; Robert H. Grubbs","Oxygen-Atom Transfer from Carbon Dioxide to a Fischer Carbene at (PNP)Ir","Journal of the American Chemical Society","2008","130","","5874","5875","10.1021/ja801865c","","","0.71073","MoKα","","0.113","0.0526","","","0.0888","0.1046","","","","","","1.314","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107755","8.817","0.003","16.056","0.005","9.01","0.003","90","","108.558","0.007","90","","1209.2","0.7","173.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H34 Cu N7 O3 -","- C22 H34 Cu N7 O3 -","- C44 H68 Cu2 N14 O6 -","2","1","","Masato Kujime; Chiemi Izumi; Masaaki Tomura; Masahiko Hada; Hiroshi Fujii","Effect of a Tridentate Ligand on the Structure, Electronic Structure, and Reactivity of the Copper(I) Nitrite Complex: Role of the Conserved Three-Histidine Ligand Environment of the Type-2 Copper Site in Copper-Containing Nitrite Reductases","Journal of the American Chemical Society","2008","130","","6088","6098","10.1021/ja075575b","","","0.7107","MoKα","","","0.0736","","","","0.2063","","","","","","2.624","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107756","18.196","0.003","13.135","0.002","7.773","0.001","90","","90","","90","","1857.8","0.5","173.2","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 H22 Cu N7 O2 -","- C26 H40 Cu N11 O2 -","- C104 H160 Cu4 N44 O8 -","4","0.5","","Masato Kujime; Chiemi Izumi; Masaaki Tomura; Masahiko Hada; Hiroshi Fujii","Effect of a Tridentate Ligand on the Structure, Electronic Structure, and Reactivity of the Copper(I) Nitrite Complex: Role of the Conserved Three-Histidine Ligand Environment of the Type-2 Copper Site in Copper-Containing Nitrite Reductases","Journal of the American Chemical Society","2008","130","","6088","6098","10.1021/ja075575b","","","0.7107","MoKα","","","0.0694","","","","0.1679","","","","","","1.729","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107757","9.409","0.003","13.841","0.004","9.811","0.003","90","","113.179","0.006","90","","1174.6","0.6","173.2","","","","","","","","","","","5","P 1 a 1","P -2ya","7","","","","- C22 H34 Cu N7 O2 -","- C22 H34 Cu N7 O2 -","- C44 H68 Cu2 N14 O4 -","2","1","","Masato Kujime; Chiemi Izumi; Masaaki Tomura; Masahiko Hada; Hiroshi Fujii","Effect of a Tridentate Ligand on the Structure, Electronic Structure, and Reactivity of the Copper(I) Nitrite Complex: Role of the Conserved Three-Histidine Ligand Environment of the Type-2 Copper Site in Copper-Containing Nitrite Reductases","Journal of the American Chemical Society","2008","130","","6088","6098","10.1021/ja075575b","","","0.7107","MoKα","","","0.08","","","","0.2117","","","","","","2.412","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107758","9.9013","0.0015","16.451","0.002","20.166","0.003","90","","109.61","0.03","90","","3094.2","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H46 Cu N7 O2 -","- C28 H46 Cu N7 O2 -","- C112 H184 Cu4 N28 O8 -","4","1","","Masato Kujime; Chiemi Izumi; Masaaki Tomura; Masahiko Hada; Hiroshi Fujii","Effect of a Tridentate Ligand on the Structure, Electronic Structure, and Reactivity of the Copper(I) Nitrite Complex: Role of the Conserved Three-Histidine Ligand Environment of the Type-2 Copper Site in Copper-Containing Nitrite Reductases","Journal of the American Chemical Society","2008","130","","6088","6098","10.1021/ja075575b","","","0.7107","MoKα","","0.0868","0.0714","","","0.1709","0.179","","","","","","1.151","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107759","9.8244","","16.3555","","14.9146","","90","","90.97","","90","","2396.18","","293.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 Cu N7 O4 -","- C22 H34 Cu N7 O4 -","- C88 H136 Cu4 N28 O16 -","4","1","","Masato Kujime; Chiemi Izumi; Masaaki Tomura; Masahiko Hada; Hiroshi Fujii","Effect of a Tridentate Ligand on the Structure, Electronic Structure, and Reactivity of the Copper(I) Nitrite Complex: Role of the Conserved Three-Histidine Ligand Environment of the Type-2 Copper Site in Copper-Containing Nitrite Reductases","Journal of the American Chemical Society","2008","130","","6088","6098","10.1021/ja075575b","","","0.7107","MoKα","","","0.076","","","","0.2046","","","","","","1.376","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107760","15.521","0.003","26.412","0.005","6.9655","0.0014","90","","90","","90","","2855.4","1","298","2","298","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C40 H72 Cl4 N8 O8 -","- C40 H72 Cl4 N8 O8 -","- C80 H144 Cl8 N16 O16 -","2","0.5","","Ignacio Alfonso; Michael Bolte; Miriam Bru; M. Isabel Burguete; Santiago V. Luis; Jenifer Rubio","Supramolecular Control for the Modular Synthesis of Pseudopeptidic Macrocycles through an Anion-Templated Reaction","Journal of the American Chemical Society","2008","130","","6137","6144","10.1021/ja710132c","","","0.71073","MoKα","","0.2118","0.1004","","","0.2571","0.316","","","","","","1.024","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107761","13.9744","0.0006","23.6761","0.0009","11.94","0.0006","90","","106.885","0.004","90","","3780.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","palladium vacataporphyrin","","","- C47 H36 Cl3 N3 Pd -","- C47 H36 Cl3 N3 Pd -","- C188 H144 Cl12 N12 Pd4 -","4","1","","Ewa Pacholska-Dudziak; Janusz Skonieczny; Miłosz Pawlicki; Ludmiła Szterenberg; Zbigniew Ciunik; Lechosław Latos-Grażyński","Palladium Vacataporphyrin Reveals Conformational Rearrangements Involving Hückel and Möbius Macrocyclic Topologies","Journal of the American Chemical Society","2008","130","","6182","6195","10.1021/ja711039c","","","1.5418","CuKα","","0.0706","0.0584","","","0.1503","0.1656","","","","","","0.99","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107762","6.4945","0.0009","14.4","0.002","16.979","0.002","90","","90","","90","","1587.9","0.4","126","","126","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H22 O3 -","- C19 H21 O3 -","- C76 H84 O12 -","4","1","","Barry M. Trost; Jia Xie","Palladium-Catalyzed Diastereo- and Enantioselective Wagner-Meerwein Shift: Control of Absolute Stereochemistry in the C-C Bond Migration Event","Journal of the American Chemical Society","2008","130","","6231","6242","10.1021/ja7111299","","","0.71073","MoKα","","0.0425","0.0327","","","0.0749","0.0785","","","","","","0.962","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107763","14.372","0.003","12.196","0.002","14.497","0.003","90","","112.923","0.002","90","","2340.4","0.8","110","2","110","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C14 H37 Cl2 N5 O2 Pt S2 Zn -","- C14 H37 Cl2 N5 O2 Pt S2 Zn -","- C56 H148 Cl8 N20 O8 Pt4 S8 Zn4 -","4","1","","Elky Almaraz; Queite A. de Paula; Qin Liu; Joseph H. Reibenspies; Marcetta Y. Darensbourg; Nicholas P. Farrell","Thiolate Bridging and Metal Exchange in Adducts of a Zinc Finger Model and PtII Complexes: Biomimetic Studies of Protein/Pt/DNA Interactions","Journal of the American Chemical Society","2008","130","","6272","6280","10.1021/ja711254q","","","0.71073","MoKα","","0.0229","0.0187","","","0.0402","0.0417","","","","","","1.03","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107764","9.965","0.004","15.076","0.007","7.497","0.003","90","","90","","90","","1126.3","0.8","110","2","110","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C9 H18 N2 Pt S2 -","- C9 H18 N2 Pt S2 -","- C36 H72 N8 Pt4 S8 -","4","0.5","","Elky Almaraz; Queite A. de Paula; Qin Liu; Joseph H. Reibenspies; Marcetta Y. Darensbourg; Nicholas P. Farrell","Thiolate Bridging and Metal Exchange in Adducts of a Zinc Finger Model and PtII Complexes: Biomimetic Studies of Protein/Pt/DNA Interactions","Journal of the American Chemical Society","2008","130","","6272","6280","10.1021/ja711254q","","","0.71073","MoKα","","0.0567","0.0491","","","0.1257","0.132","","","","","","1.011","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107765","8.1341","0.0009","10.4101","0.0011","13.6281","0.0014","90","","94.148","0.007","90","","1151","0.2","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H36 N4 S4 Zn2 -","- C18 H36 N4 S4 Zn2 -","- C36 H72 N8 S8 Zn4 -","2","0.5","","Elky Almaraz; Queite A. de Paula; Qin Liu; Joseph H. Reibenspies; Marcetta Y. Darensbourg; Nicholas P. Farrell","Thiolate Bridging and Metal Exchange in Adducts of a Zinc Finger Model and PtII Complexes: Biomimetic Studies of Protein/Pt/DNA Interactions","Journal of the American Chemical Society","2008","130","","6272","6280","10.1021/ja711254q","","","1.54178","CuKα","","0.0627","0.0367","","","0.0737","0.0819","","","","","","1.003","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107766","13.0193","0.0015","14.7971","0.0017","26.831","0.003","90","","90","","90","","5168.9","1","110","2","110","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C18 H36 Cl2 N4 Pt S4 Zn2 -","- C18 H36 Cl2 N4 Pt S4 Zn2 -","- C144 H288 Cl16 N32 Pt8 S32 Zn16 -","8","1","","Elky Almaraz; Queite A. de Paula; Qin Liu; Joseph H. Reibenspies; Marcetta Y. Darensbourg; Nicholas P. Farrell","Thiolate Bridging and Metal Exchange in Adducts of a Zinc Finger Model and PtII Complexes: Biomimetic Studies of Protein/Pt/DNA Interactions","Journal of the American Chemical Society","2008","130","","6272","6280","10.1021/ja711254q","","","1.54178","CuKα","","0.0492","0.0307","","","0.0563","0.0595","","","","","","1.009","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107767","7.6139","0.0004","7.6363","0.0004","16.8065","0.0008","89.186","0.002","78.148","0.003","84.51","0.003","951.93","0.08","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","7,8,9,10-tetrafluoro-5,12-bis(triisopropylsilylethynyl) tetraceno[2,3-b]thiophene","","- C42 H48 F4 S Si2 -","- C42 H48 F4 S Si2 -","- C42 H48 F4 S Si2 -","1","0.5","","Ming L. Tang; Anna D. Reichardt; Nobuyuki Miyaki; Randall M. Stoltenberg; Zhenan Bao","Ambipolar, High Performance, Acene-Based Organic Thin Film Transistors","Journal of the American Chemical Society","2008","130","","6064","6065","10.1021/ja8005918","","","1.54178","CuKα","","0.0971","0.0866","","","0.206","0.2113","","","","","","1.154","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107768","24.789","0.003","24.031","0.003","15.525","0.002","90","","90","","90","","9248","2","100","0.1","100","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","holrc02","","","- C102 H136 D12 Fe2 N10 -","- C102 H148 Fe2 N10 -","- C408 H592 Fe8 N40 -","4","0.5","","Ryan E. Cowley; Jérôme Elhaïk; Nathan A. Eckert; William W. Brennessel; Eckhard Bill; Patrick L. Holland","A Bridging Hexazene (RNNNNNNR) Ligand from Reductive Coupling of Azides","Journal of the American Chemical Society","2008","130","","6074","6075","10.1021/ja801375g","","","0.71073","MoKα","","0.1014","0.0641","","","0.1305","0.144","","","","","","1.064","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107769","14.2681","0.0016","18.409","0.002","14.5166","0.0016","90","","90.204","0.002","90","","3812.9","0.7","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","HOLRC04","","","- C80 H116 Cl4 Fe2 N10 -","- C80 H116 Cl4 Fe2 N10 -","- C160 H232 Cl8 Fe4 N20 -","2","0.5","","Ryan E. Cowley; Jérôme Elhaïk; Nathan A. Eckert; William W. Brennessel; Eckhard Bill; Patrick L. Holland","A Bridging Hexazene (RNNNNNNR) Ligand from Reductive Coupling of Azides","Journal of the American Chemical Society","2008","130","","6074","6075","10.1021/ja801375g","","","0.71073","MoKα","","0.0557","0.042","","","0.1088","0.116","","","","","","1.051","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107770","21.009","0.0017","21.009","","36.131","0.0014","90","","90","","90","","15947.4","1.4","120","0.1","120","0.1","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","Tetrais(di-tert-butylmethylsilyl)disilene cation radical tetrakis(pentfluorophenyl)borate","","- C72 H96 B F20 Si6 -","- C72 H96 B F20 Si6 -","- C576 H768 B8 F160 Si48 -","8","0.25","","Shigeyoshi Inoue; Masaaki Ichinohe; Akira Sekiguchi","The Isolable Cation Radical of Disilene: Synthesis, Characterization, and a Reversible One-Electron Redox System","Journal of the American Chemical Society","2008","130","","6078","6079","10.1021/ja801761w","","","0.7107","MoKα","","0.107","0.0591","","","0.154","0.1794","","","","","","0.981","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107771","41.254","0.004","9.4592","0.0009","18.4138","0.0016","90","","98.645","0.003","90","","7104","1.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H26 Cu N4 O14 Zn3 -","- C40 H26 Cu N4 O14 Zn3 -","- C160 H104 Cu4 N16 O56 Zn12 -","4","1","","Banglin Chen; Xuebo Zhao; Apipong Putkham; Kunlun Hong; Emil B. Lobkovsky; Eric J. Hurtado; Ashleigh J. Fletcher; K. Mark Thomas","Surface Interactions and Quantum Kinetic Molecular Sieving for H2 and D2 Adsorption on a Mixed Metal-Organic Framework Material","Journal of the American Chemical Society","2008","130","","6411","6423","10.1021/ja710144k","","","0.71073","MoKα","","0.0887","0.0456","","","0.1225","0.1324","","","","","","0.881","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107772","34.906","0.004","11.9591","0.0012","20.979","0.002","90","","121.945","0.001","90","","7431.3","1.3","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","holyy13","","","- C39 H59 Fe N4 -","- C39 H59 Fe N4 -","- C312 H472 Fe8 N32 -","8","1","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0455","0.0408","","","0.1091","0.1122","","","","","","1.056","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107773","13.4952","0.001","13.7544","0.001","18.0711","0.0014","90","","101.095","0.001","90","","3291.6","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","holph19","","","- C70 H106 Fe2 N6 O2 -","- C70 H106 Fe2 N6 O2 -","- C140 H212 Fe4 N12 O4 -","2","0.5","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0475","0.0386","","","0.098","0.103","","","","","","1.045","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107774","14.764","0.002","21.904","0.003","39.736","0.006","90","","90","","90","","12850","3","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","holyy24","","","- C68 H105 Fe2 N5 -","- C68 H105 Fe2 N5 -","- C544 H840 Fe16 N40 -","8","2","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0941","0.0533","","","0.0927","0.1048","","","","","","1.034","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107775","35.887","0.004","12.2275","0.0013","18.927","0.002","90","","94.473","0.002","90","","8280","1.5","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","holas08","","","- C43.5 H67 Fe N3 -","- C43.5 H67 Fe N3 -","- C348 H536 Fe8 N24 -","8","2","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0747","0.0511","","","0.1361","0.1481","","","","","","1.043","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107776","11.4337","0.0006","15.4062","0.0008","21.372","0.0011","90","","92.224","0.001","90","","3761.8","0.3","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","holjs75","","","- C43 H52 Fe N2 -","- C43 H52 Fe N2 -","- C172 H208 Fe4 N8 -","4","1","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0519","0.0378","","","0.1047","0.1096","","","","","","1.089","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107777","10.1455","0.0008","13.0167","0.0013","14.7129","0.0008","81.198","0.001","81.269","0.001","81.809","0.001","1883.7","0.3","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","holas11","","","- C77 H114 Fe2 N10 -","- C70 H106 Fe2 N10 -","- C70 H106 Fe2 N10 -","1","0.5","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0416","0.0385","","","0.1026","0.1042","","","","","","1.067","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107778","9.747","0.002","19.519","0.005","10.807","0.003","90","","96.48","0.004","90","","2042.9","0.9","100","0.1","100","0.1","","","","","","","","4","P 1 21/m 1","-P 2yb","11","holas06","","","- C45 H69 Fe N5 -","- C45 H69 Fe N5 -","- C90 H138 Fe2 N10 -","2","0.5","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0569","0.0429","","","0.1084","0.1169","","","","","","1.037","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107779","9.7911","0.0011","20.071","0.002","10.8467","0.0012","90","","100.282","0.002","90","","2097.3","0.4","223","0.2","223","0.2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","holyy25","","","- C46 H61 Fe N4 -","- C46 H61 Fe N4 -","- C92 H122 Fe2 N8 -","2","0.5","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0785","0.0483","","","0.1218","0.1371","","","","","","1.029","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107780","16.222","0.002","19.321","0.002","13.3145","0.0016","90","","124.815","0.002","90","","3426.1","0.7","100","0.1","100","0.1","","","","","","","","6","C 1 2/m 1","-C 2y","12","holyy23","","","- C73.8 H99.8 Cl0.2 Fe2 N4 O3.6 -","- C73.802 H99.802 Cl0.198 Fe2 N4 O3.604 -","- C147.604 H199.604 Cl0.396 Fe4 N8 O7.208 -","2","0.25","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0506","0.0399","","","0.1035","0.1091","","","","","","1.046","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107781","16.101","0.003","16.526","0.003","25.199","0.004","90","","90","","90","","6705","2","100","0.1","100","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","holas17","","","- C72 H108 Fe2 N4 O4 -","- C72 H108 Fe2 N4 O4 -","- C288 H432 Fe8 N16 O16 -","4","0.5","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0881","0.0496","","","0.114","0.1288","","","","","","1.035","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107782","10.878","0.002","12.781","0.003","15.368","0.003","98.705","0.003","99.605","0.003","107.216","0.003","1966.1","0.7","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","holas18","","","- C42 H68 Fe N4 -","- C42 H68 Fe N4 -","- C84 H136 Fe2 N8 -","2","1","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0359","0.0302","","","0.0795","0.0832","","","","","","1.029","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107783","22.792","0.002","14.7881","0.0015","16.1542","0.0016","90","","90.95","0.001","90","","5444","0.9","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","holjs65","","","- C58 H84 Fe2 N4 O2 -","- C58 H84 Fe2 N4 O2 -","- C232 H336 Fe8 N16 O8 -","4","0.5","","Ying Yu; Azwana R. Sadique; Jeremy M. Smith; Thomas R. Dugan; Ryan E. Cowley; William W. Brennessel; Christine J. Flaschenriem; Eckhard Bill; Thomas R. Cundari; Patrick L. Holland","The Reactivity Patterns of Low-Coordinate Iron-Hydride Complexes","Journal of the American Chemical Society","2008","130","","6624","6638","10.1021/ja710669w","","","0.71073","MoKα","","0.0424","0.0339","","","0.0868","0.0925","","","","","","1.023","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107784","19.435","0.003","19.435","0.003","8.189","0.002","90","","90","","120","","2678.7","0.9","203","2","203","2","","","","","","","","4","R 3 :H","R 3","146","","","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C135 H99 N9 O18 -","9","1","","Shui-Ming Lu; Howard Alper","Sequence of Intramolecular Carbonylation and Asymmetric Hydrogenation Reactions: Highly Regio- and Enantioselective Synthesis of Medium Ring Tricyclic Lactams","Journal of the American Chemical Society","2008","130","","6451","6455","10.1021/ja7111417","","","0.71073","MoKα","","0.0275","0.0263","","","0.0682","0.0691","","","","","","1.061","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107785","18.342","0.003","4.9532","0.0007","14.966","0.002","90","","105.889","0.002","90","","1307.7","0.3","202","2","202","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C15 H12 Cl N O2 -","- C15 H12 Cl N O2 -","- C60 H48 Cl4 N4 O8 -","4","1","","Shui-Ming Lu; Howard Alper","Sequence of Intramolecular Carbonylation and Asymmetric Hydrogenation Reactions: Highly Regio- and Enantioselective Synthesis of Medium Ring Tricyclic Lactams","Journal of the American Chemical Society","2008","130","","6451","6455","10.1021/ja7111417","","","0.71073","MoKα","","0.0576","0.0401","","","0.095","0.1037","","","","","","1.073","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107786","19.8173","0.0019","19.8173","0.0019","8.1477","0.0016","90","","90","","120","","2771.1","0.7","202","2","202","2","","","","","","","","4","R 3 :H","R 3","146","","","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C135 H117 N9 O18 -","9","1","","Shui-Ming Lu; Howard Alper","Sequence of Intramolecular Carbonylation and Asymmetric Hydrogenation Reactions: Highly Regio- and Enantioselective Synthesis of Medium Ring Tricyclic Lactams","Journal of the American Chemical Society","2008","130","","6451","6455","10.1021/ja7111417","","","0.71073","MoKα","","0.0952","0.0515","","","0.0894","0.1028","","","","","","1.048","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107787","3.55894","0.00009","3.55894","","5.92341","0.00027","90","","90","","120","","64.975","0.003","15","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","CaLi2(DN)2","","","- Ca D2 Li2 N2 -","- Ca D2.04 Li1.94 N2 -","- Ca D2.04 Li1.94 N2 -","1","0.0833333","","Hui Wu","Structure of Ternary Imide Li2Ca(NH)2 and Hydrogen Storage Mechanisms in Amide-Hydride System","Journal of the American Chemical Society","2008","130","","6515","6522","10.1021/ja800300e","powder diffraction","neutron","1.5403","neutron","","","","","","","","0.07992","","","","","1.45","","","","has coordinates","276354","2022-06-28","16:49:12",""
"4107788","3.56787","0.00007","3.56787","","5.94851","0.00023","90","","90","","120","","65.578","0.003","15","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","CaLi2(DN)2","","","- Ca D2 Li2 N2 -","- Ca D2.04 Li1.72 N2 -","- Ca D2.04 Li1.72 N2 -","1","0.0833333","","Hui Wu","Structure of Ternary Imide Li2Ca(NH)2 and Hydrogen Storage Mechanisms in Amide-Hydride System","Journal of the American Chemical Society","2008","130","","6515","6522","10.1021/ja800300e","powder diffraction","neutron","1.5403","neutron","","","","","","","","0.0839","","","","","1.28","","","","has coordinates","276354","2022-06-28","16:49:13",""
"4107789","12.266","0.005","14.702","0.005","21.63","0.005","102.839","0.005","95.784","0.005","100.245","0.005","3702","2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H110 Cl Cr2 N4 O6 -","- C80 H110 Cl Cr2 N4 O6 -","- C160 H220 Cl2 Cr4 N8 O12 -","2","1","","Donald J. Darensbourg; Adriana I. Moncada; Wonsook Choi; Joseph H. Reibenspies","Mechanistic Studies of the Copolymerization Reaction of Oxetane and Carbon Dioxide to Provide Aliphatic Polycarbonates Catalyzed by (Salen)CrX Complexes","Journal of the American Chemical Society","2008","130","","6523","6533","10.1021/ja800302c","","","0.71073","MoKα","","0.1239","0.0755","","","0.1995","0.2321","","","","","","1.029","","","","has coordinates,has disorder","178823","2020-10-21","18:00:00",""
"4107790","16.175","0.005","16.394","0.005","17.126","0.006","89.781","0.004","88.053","0.004","79.249","0.004","4459","2","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H61 Cl4 Cr N2 O3 -","- C43 H61 Cl4 Cr N2 O3 -","- C172 H244 Cl16 Cr4 N8 O12 -","4","2","","Donald J. Darensbourg; Adriana I. Moncada; Wonsook Choi; Joseph H. Reibenspies","Mechanistic Studies of the Copolymerization Reaction of Oxetane and Carbon Dioxide to Provide Aliphatic Polycarbonates Catalyzed by (Salen)CrX Complexes","Journal of the American Chemical Society","2008","130","","6523","6533","10.1021/ja800302c","","","0.71073","MoKα","","0.0908","0.0579","","","0.1433","0.1643","","","","","","1.077","","","","has coordinates","176810","2020-10-21","18:00:00",""
"4107791","11.1738","0.0002","11.1738","0.0002","46.6887","0.0016","90","","90","","120","","5048.3","0.2","100","2","100","2","","","","","","","","4","P 65","P 65","170","","","","- C32 H48 N4 O7 -","- C32 H48 N4 O7 -","- C192 H288 N24 O42 -","6","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","MoKα","","0.0346","0.0325","","","0.0881","0.0903","","","","","","1.032","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107792","9.0136","0.0008","11.0459","0.001","11.1448","0.001","81.098","0.001","80.032","0.001","89.905","0.001","1079.34","0.17","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C37 H56 Cl3 N5 O8 -","- C37 H56 Cl3 N5 O8 -","- C37 H56 Cl3 N5 O8 -","1","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0422","0.0405","","","0.1046","0.1068","","","","","","1.038","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107793","10.3242","0.0007","21.0858","0.0015","10.6792","0.0007","90","","107.73","","90","","2214.4","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C42 H64 N6 O9 -","- C42 H64 N6 O9 -","- C84 H128 N12 O18 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","MoKα","","0.0502","0.0434","","","0.109","0.1127","","","","","","1.05","","","","has coordinates","178823","2020-10-21","18:00:00",""
"4107794","10.2391","0.0009","21.1012","0.0018","10.6255","0.0009","90","","108.968","0.001","90","","2171.1","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C41 H62 N6 O9 -","- C41 H62 N6 O9 -","- C82 H124 N12 O18 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0458","0.0383","","","0.0937","0.0997","","","","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107795","10.4365","0.0009","20.2299","0.0018","10.8443","0.0009","90","","114.053","0.001","90","","2090.7","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C41 H62 N6 O9 -","- C41 H62 N6 O9 -","- C82 H124 N12 O18 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0363","0.035","","","0.0907","0.0922","","","","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107796","9.6483","0.0014","10.7101","0.0015","13.9602","0.0019","100.241","0.002","107.743","0.002","94.394","0.002","1338.8","0.3","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C47 H72 Cl3 N7 O10 -","- C47 H72 Cl3 N7 O10 -","- C47 H72 Cl3 N7 O10 -","1","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0515","0.0479","","","0.128","0.1329","","","","","","1.034","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107797","10.4798","0.0015","10.7124","0.0015","13.7467","0.0019","85.002","0.002","83.407","0.002","83.323","0.002","1518.4","0.4","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C49 H73 Cl12 N7 O10 -","- C45 H69 N7 O10 -","- C45 H69 N7 O10 -","1","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0785","0.0728","","","0.194","0.1989","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107798","10.5904","0.0011","19.448","0.002","27.721","0.003","90","","90","","90","","5709.5","1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C50 H76 N8 O11 -","- C50 H76 N8 O11 -","- C200 H304 N32 O44 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0623","0.0547","","","0.137","0.1409","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107799","10.3529","0.0004","19.6361","0.0008","26.4378","0.0011","90","","90","","90","","5374.6","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C51 H78 Cl2 N8 O11 -","- C51 H78 Cl2 N8 O11 -","- C204 H312 Cl8 N32 O44 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.0508","0.046","","","0.1256","0.1312","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107800","15.4249","0.0009","15.4249","0.0009","55.881","0.006","90","","90","","90","","13295.6","1.8","100","2","100","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C55.5 H84.5 Cl4.5 N9 O12 -","- C55 H84 Cl3 N9 O12 -","- C440 H672 Cl24 N72 O96 -","8","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.1171","0.1086","","","0.2791","0.2851","","","","","","1.112","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107801","11.003","0.002","15.078","0.003","47.015","0.01","90","","90","","90","","7800","3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C63.27 H95.27 Cl9.82 N10 O13 -","- C63.233 H95.233 Cl9.699 N10 O13 -","- C252.932 H380.932 Cl38.796 N40 O52 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in α/β-Peptides with 1:1 Residue Alternation","Journal of the American Chemical Society","2008","130","","6544","6550","10.1021/ja800355p","","","0.71073","Mo-Kα","","0.1116","0.0914","","","0.2007","0.2093","","","","","","1.178","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107802","15.931","0.005","7.498","0.003","16.677","0.006","90","","110.193","0.013","90","","1869.6","1.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H7 Br Co2 O6 -","- C18 H7 Br Co2 O6 -","- C72 H28 Br4 Co8 O24 -","4","1","","Nobuharu Iwasawa; Maiko Otsuka; Satomi Yamashita; Masao Aoki; Jun Takaya","Synthesis, Structure, and Reactivity of Naphthalyne-Co2(CO)6 Complexes","Journal of the American Chemical Society","2008","130","","6328","6329","10.1021/ja801569q","","x-ray","0.71075","MoKα","","0.0366","0.0307","","","0.07","0.0733","","","","","","1.046","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107803","9.6593","0.0019","18.779","0.004","12.872","0.003","90","","101.48","0.03","90","","2288.2","0.9","110","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 N2 O4 Pd2 -","- C26 H22 N2 O4 Pd2 -","- C104 H88 N8 O16 Pd8 -","4","1","","Mieock Kim; Thomas J. Taylor; François P. Gabbaï","Hg(II)...Pd(II) Metallophilic Interactions","Journal of the American Chemical Society","2008","130","","6332","6333","10.1021/ja801626c","","","0.71073","MoKα","","0.0273","0.0235","","","0.0577","0.0595","","","","","","1.008","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107804","13.7936","0.0008","9.9402","0.0006","18.7739","0.0011","90","","92.146","0.002","90","","2572.3","0.3","110","2","273","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C56 H36 Cl4 F10 Hg N4 O4 Pd2 -","- C56 H36 Cl4 F10 Hg N4 O4 Pd2 -","- C112 H72 Cl8 F20 Hg2 N8 O8 Pd4 -","2","0.5","","Mieock Kim; Thomas J. Taylor; François P. Gabbaï","Hg(II)...Pd(II) Metallophilic Interactions","Journal of the American Chemical Society","2008","130","","6332","6333","10.1021/ja801626c","","","0.71073","MoKα","","0.0547","0.0347","","","0.0662","0.0724","","","","","","1.003","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107805","9.3662","0.0019","12.94","0.003","24.519","0.005","90","","92.43","0.03","90","","2969","1.1","110","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H44 F10 Hg N4 O8 Pd4 -","- C64 H44 F10 Hg N4 O8 Pd4 -","- C128 H88 F20 Hg2 N8 O16 Pd8 -","2","0.5","","Mieock Kim; Thomas J. Taylor; François P. Gabbaï","Hg(II)...Pd(II) Metallophilic Interactions","Journal of the American Chemical Society","2008","130","","6332","6333","10.1021/ja801626c","","","0.71073","MoKα","","0.0578","0.0433","","","0.1137","0.1243","","","","","","1.006","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107806","8.4773","0.0013","13.378","0.002","16.47","0.003","90","","91.413","0.002","90","","1867.3","0.5","125","2","125","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H19 Br N2 O5 -","- C19 H19 Br N2 O5 -","- C76 H76 Br4 N8 O20 -","4","2","","Gregory T. Notte; James L. Leighton","A New Silicon Lewis Acid for Highly Enantioselective Mannich Reactions of Aliphatic Ketone-Derived Hydrazones","Journal of the American Chemical Society","2008","130","","6676","6677","10.1021/ja800830h","","","0.71073","MoKα","","0.0786","0.0588","","","0.1657","0.1762","","","","","","1.032","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107807","9.0685","0.0013","9.322","0.0013","12.3235","0.0018","90","","94.955","0.002","90","","1037.9","0.3","125","2","125","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H23 F3 N2 O3 -","- C22 H23 F3 N2 O3 -","- C44 H46 F6 N4 O6 -","2","1","","Gregory T. Notte; James L. Leighton","A New Silicon Lewis Acid for Highly Enantioselective Mannich Reactions of Aliphatic Ketone-Derived Hydrazones","Journal of the American Chemical Society","2008","130","","6676","6677","10.1021/ja800830h","","","0.71073","MoKα","","0.1884","0.0731","","","0.1227","0.152","","","","","","1.035","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107808","8.6428","0.0019","14.3923","0.0023","14.5761","0.0019","69.525","0.013","85.969","0.015","80.834","0.016","1676.7","0.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H26 Cl2 O2 P2 Pd -","- C34 H26 Cl2 O2 P2 Pd -","- C68 H52 Cl4 O4 P4 Pd2 -","2","1","","David W. Norman; Charles A. Carraz; David J. Hyett; Paul G. Pringle; Joseph B. Sweeney; A. Guy Orpen; Hirrahataya Phetmung; Richard L. Wingad","Bidentates versus Monodentates in Asymmetric Hydrogenation Catalysis: Synergic Effects on Rate and Allosteric Effects on Enantioselectivity","Journal of the American Chemical Society","2008","130","","6840","6847","10.1021/ja800858x","","","0.71073","MoKα","","0.0666","0.0439","","","0.0805","0.0883","","","","","","1.049","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107809","9.228","0.0002","18.6499","0.0003","14.0852","0.0003","90","","92.2427","0.001","90","","2422.22","0.08","160","1","160","1","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C26 H26 B Cl F4 N2 O0.5 -","- C26.75 H24 B Cl F4 N2 -","- C107 H96 B4 Cl4 F16 N8 -","4","1","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.121","0.0813","","","0.2131","0.244","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107810","10.2952","0.0003","29.0435","0.0009","14.3129","0.0004","90","","108.316","0.0015","90","","4062.9","0.2","160","1","160","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H54 Cl4 N2 O -","- C40 H54 Cl4 N2 O -","- C160 H216 Cl16 N8 O4 -","4","1","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.1348","0.0652","","","0.1415","0.1723","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107811","15.9174","0.0005","10.7396","0.0004","25.1724","0.001","90","","98.385","0.002","90","","4257.1","0.3","160","1","160","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C27 H26 N2 -","- C27 H26 N2 -","- C216 H208 N16 -","8","2","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.1442","0.0748","","","0.1977","0.2333","","","","","","1.04","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107812","12.6275","0.0004","20.2412","0.0006","12.1196","0.0004","90","","107.354","0.0018","90","","2956.72","0.16","160","1","160","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C35 H42 N2 -","- C35 H42 N2 -","- C140 H168 N8 -","4","1","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.1213","0.0726","","","0.172","0.1974","","","","","","1.084","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107813","21.1294","0.0003","17.2169","0.0003","8.095","0.0001","90","","111.126","0.001","90","","2746.91","0.07","160","1","160","1","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C30.5 H32 Cl2 N2 Pd -","- C30.5 H32 Cl2 N2 Pd -","- C122 H128 Cl8 N8 Pd4 -","4","0.5","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.0499","0.0435","","","0.109","0.1133","","","","","","1.036","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107814","8.6415","0.0002","10.7297","0.0003","14.0776","0.0005","91.8725","0.0014","95.4669","0.0019","98.7762","0.0018","1282.66","0.07","160","1","160","1","","","","","","","","5","P -1","-P 1","2","","","","- C30 H31 Cl N2 Pd -","- C30 H31 Cl N2 Pd -","- C60 H62 Cl2 N4 Pd2 -","2","1","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.0649","0.0523","","","0.1283","0.1362","","","","","","1.048","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107815","13.4818","0.0002","14.362","0.0002","22.1744","0.0004","107.523","0.001","96.5314","0.0008","104.221","0.0008","3886.12","0.11","160","1","160","1","","","","","","","","5","P -1","-P 1","2","","","","- C39.5 H50.5 Cl N2 Pd -","- C38 H47 Cl N2 Pd -","- C152 H188 Cl4 N8 Pd4 -","4","2","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.0829","0.0605","","","0.1515","0.1618","","","","","","1.04","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107816","11.9641","0.0001","22.8052","0.0002","13.0081","0.0001","90","","106.834","0.0004","90","","3397.08","0.05","160","1","160","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H47 Cl N2 Pd -","- C38 H47 Cl N2 Pd -","- C152 H188 Cl4 N8 Pd4 -","4","1","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.0526","0.0434","","","0.1089","0.1147","","","","","","1.059","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107817","7.9161","0.0002","8.0645","0.0002","13.5869","0.0004","85.0784","0.0016","86.6572","0.0015","71.868","0.0016","820.81","0.04","160","1","160","1","","","","","","","","3","P -1","-P 1","2","","","","- C46 H36 N4 -","- C46 H36 N4 -","- C46 H36 N4 -","1","0.5","","Xinjun Luan; Ronaldo Mariz; Michele Gatti; Chiara Costabile; Albert Poater; Luigi Cavallo; Anthony Linden; Reto Dorta","Identification and Characterization of a New Family of Catalytically Highly Active Imidazolin-2-ylidenes","Journal of the American Chemical Society","2008","130","","6848","6858","10.1021/ja800861p","","","0.71073","MoKα","","0.0705","0.0562","","","0.1502","0.1638","","","","","","1.026","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107818","10.2166","0.0005","10.2662","0.0005","18.1889","0.0009","82.596","0.001","81.632","0.001","75.876","0.001","1821.7","0.16","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H47 Cl3 N O2 P Pd -","- C34.5 H46 Cl2 N O2 P Pd -","- C69 H92 Cl4 N2 O4 P2 Pd2 -","2","1","","Mark R. Biscoe; Brett P. Fors; Stephen L. Buchwald","A New Class of Easily Activated Palladium Precatalysts for Facile C-N Cross-Coupling Reactions and the Low Temperature Oxidative Addition of Aryl Chlorides","Journal of the American Chemical Society","2008","130","","6686","6687","10.1021/ja801137k","","","0.71073","MoKα","","0.0363","0.0355","","","0.1237","0.1247","","","","","","1.107","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107819","52.1923","0.0014","17.6634","0.0004","36.4505","0.0008","90","","93.573","0.001","90","","33538.2","1.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- H124 K18 O185 Si3 W30 Zr6 -","- K12 O153.25 Si3 W30 Zr6 -","- K96 O1226 Si24 W240 Zr48 -","8","1","","Bassem S. Bassil; Sib Sankar Mal; Michael H. Dickman; Ulrich Kortz; Holger Oelrich; Lorenz Walder","6-Peroxo-6-Zirconium Crown and Its Hafnium Analogue Embedded in a Triangular Polyanion: [M6(O2)6(OH)6(γ-SiW10O36)3]18- (M = Zr, Hf)","Journal of the American Chemical Society","2008","130","","6696","6697","10.1021/ja801424q","","","0.71073","MoKα","","0.1245","0.0749","","","0.1902","0.2253","","","","","","1.008","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107820","52.2945","0.0017","17.6832","0.0004","36.3549","0.0009","90","","93.667","0.002","90","","33549.8","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- H124 Hf6 K18 O185 Si3 W30 -","- Hf6 K11.15 O162.55 Si3 W30 -","- Hf48 K89.2 O1300.4 Si24 W240 -","8","1","","Bassem S. Bassil; Sib Sankar Mal; Michael H. Dickman; Ulrich Kortz; Holger Oelrich; Lorenz Walder","6-Peroxo-6-Zirconium Crown and Its Hafnium Analogue Embedded in a Triangular Polyanion: [M6(O2)6(OH)6(γ-SiW10O36)3]18- (M = Zr, Hf)","Journal of the American Chemical Society","2008","130","","6696","6697","10.1021/ja801424q","","","0.71073","MoKα","","0.1133","0.0663","","","0.1618","0.1998","","","","","","0.994","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107821","13.318","0.002","13.43","0.003","17.498","0.003","70.438","0.018","74.727","0.015","60.84","0.02","2556.1","1","110","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C45 H48 B Cu F20 N11 O2 -","- C45 H48 B Cu F20 N11 O2 -","- C90 H96 B2 Cu2 F40 N22 O4 -","2","1","","Debabrata Maiti; Dong-Heon Lee; Amy A. Narducci Sarjeant; Monita Y. M. Pau; Edward I. Solomon; Katya Gaoutchenova; Jörg Sundermeyer; Kenneth D. Karlin","Reaction of a Copper-Dioxygen Complex with Nitrogen Monoxide (.NO) Leads to a Copper(II)-Peroxynitrite Species","Journal of the American Chemical Society","2008","130","","6700","6701","10.1021/ja801540e","","","0.71073","MoKα","","0.0537","0.0329","","","0.0824","0.0859","","","","","","1.028","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107822","13.433","0.003","13.442","0.004","17.5504","0.0016","70.037","0.017","74.295","0.014","60.28","0.03","2566.7","1.2","","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C45 H48 B Cu F20 N11 O3 -","- C45 H48 B Cu F20 N11 O3 -","- C90 H96 B2 Cu2 F40 N22 O6 -","2","1","","Debabrata Maiti; Dong-Heon Lee; Amy A. Narducci Sarjeant; Monita Y. M. Pau; Edward I. Solomon; Katya Gaoutchenova; Jörg Sundermeyer; Kenneth D. Karlin","Reaction of a Copper-Dioxygen Complex with Nitrogen Monoxide (.NO) Leads to a Copper(II)-Peroxynitrite Species","Journal of the American Chemical Society","2008","130","","6700","6701","10.1021/ja801540e","","","0.71073","MoKα","","0.1204","0.066","","","0.0965","0.1174","","","","","","1.086","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107823","13.78","0.004","15.634","0.004","24.966","0.005","96.675","0.006","96.97","0.006","105.531","0.006","5081","2","293.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C73 H32 Fe N4 O3 Pd5 S50 -","- C73 H32 Fe N4 O3 Pd5 S50 -","- C146 H64 Fe2 N8 O6 Pd10 S100 -","2","1","","Kazuyuki Takahashi; Heng-Bo Cui; Yoshinori Okano; Hayao Kobayashi; Hatsumi Mori; Hiroyuki Tajima; Yasuaki Einaga; Osamu Sato","Evidence of the Chemical Uniaxial Strain Effect on Electrical Conductivity in the Spin-Crossover Conducting Molecular System: [FeIII(qnal)2][Pd(dmit)2]5.Acetone","Journal of the American Chemical Society","2008","130","","6688","6689","10.1021/ja801585r","","","0.7107","MoKα","","","0.0515","","","","0.0888","","","","","","0.996","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107824","13.573","0.007","15.573","0.008","24.912","0.011","96.599","0.01","97.03","0.01","106.056","0.011","4961","4","105.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C73 H32 Fe N4 O3 Pd5 S50 -","- C73 H32 Fe N4 O3 Pd5 S50 -","- C146 H64 Fe2 N8 O6 Pd10 S100 -","2","1","","Kazuyuki Takahashi; Heng-Bo Cui; Yoshinori Okano; Hayao Kobayashi; Hatsumi Mori; Hiroyuki Tajima; Yasuaki Einaga; Osamu Sato","Evidence of the Chemical Uniaxial Strain Effect on Electrical Conductivity in the Spin-Crossover Conducting Molecular System: [FeIII(qnal)2][Pd(dmit)2]5.Acetone","Journal of the American Chemical Society","2008","130","","6688","6689","10.1021/ja801585r","","","0.7107","MoKα","","","0.098","","","","0.2961","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107825","19.963","0.003","13.639","0.002","19.76","0.003","90","","110.694","0.003","90","","5033","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C94.5 H22 N2 O2 S -","- C94.5 H22 N2 O2 S -","- C378 H88 N8 O8 S4 -","4","1","","Yasujiro Murata; Shuhei Maeda; Michihisa Murata; Koichi Komatsu","Encapsulation and Dynamic Behavior of Two H2 Molecules in an Open-Cage C70","Journal of the American Chemical Society","2008","130","","6702","6703","10.1021/ja801753m","","","0.71073","MoKα","","0.1169","0.0595","","","0.1158","0.1278","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107826","4.015","0.0008","11.236","0.002","9.332","0.0019","90","","95.66","0.03","90","","418.94","0.14","120","2","120","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C6 H4 Br2 O2 Se -","- C6 H4 Br2 O2 Se -","- C12 H8 Br4 O4 Se2 -","2","1","","Asit Patra; Yair H. Wijsboom; Sanjio S. Zade; Mao Li; Yana Sheynin; Gregory Leitus; Michael Bendikov","Poly(3,4-ethylenedioxyselenophene)","Journal of the American Chemical Society","2008","130","","6734","6736","10.1021/ja8018675","","","0.71073","MoKα","","0.031","0.0291","","","0.0711","0.0719","","","","","","1.003","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4107827","8.476","0.002","9.296","0.002","15.43","0.004","103.566","0.005","94.996","0.005","105.678","0.005","1123.1","0.5","200","2","200","2","","","","","","","","3","P -1","-P 1","2","10_in_paper","","","- C30 H18 O6 -","- C30 H18 O6 -","- C60 H36 O12 -","2","1","","Birgit Esser; Frank Rominger; Rolf Gleiter","Synthesis of [6.8]3Cyclacene: Conjugated Belt and Model for an Unusual Type of Carbon Nanotube","Journal of the American Chemical Society","2008","130","","6716","6717","10.1021/ja801918n","","","0.71073","MoKα","","0.1249","0.0937","","","0.1804","0.1934","","","","","","1.225","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107828","15.3781","0.0006","6.8444","0.0003","18.2608","0.0007","90","","90.665","0.001","90","","1921.89","0.13","200","2","200","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","4_in_paper","[6.8]~3~cyclacene","","- C30 H18 -","- C30 H18 -","- C120 H72 -","4","1","","Birgit Esser; Frank Rominger; Rolf Gleiter","Synthesis of [6.8]3Cyclacene: Conjugated Belt and Model for an Unusual Type of Carbon Nanotube","Journal of the American Chemical Society","2008","130","","6716","6717","10.1021/ja801918n","","","0.71073","MoKα","","0.0824","0.0504","","","0.1013","0.1163","","","","","","1.113","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107829","13.5928","0.0004","12.7499","0.0004","14.2697","0.0004","90","","112.297","0.001","90","","2288.13","0.12","200","2","200","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","8a_in_paper","","","- C30 H30 -","- C30 H30 -","- C120 H120 -","4","1","","Birgit Esser; Frank Rominger; Rolf Gleiter","Synthesis of [6.8]3Cyclacene: Conjugated Belt and Model for an Unusual Type of Carbon Nanotube","Journal of the American Chemical Society","2008","130","","6716","6717","10.1021/ja801918n","","","0.71073","MoKα","","0.0596","0.0391","","","0.0938","0.1059","","","","","","1.012","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107830","7.772","0.0005","12.2598","0.0007","13.3098","0.0008","64.209","0.001","78.12","0.001","76.922","0.001","1103.88","0.12","200","2","200","2","","","","","","","","2","P -1","-P 1","2","8b_in_paper","","","- C30 H30 -","- C30 H30 -","- C60 H60 -","2","1","","Birgit Esser; Frank Rominger; Rolf Gleiter","Synthesis of [6.8]3Cyclacene: Conjugated Belt and Model for an Unusual Type of Carbon Nanotube","Journal of the American Chemical Society","2008","130","","6716","6717","10.1021/ja801918n","","","0.71073","MoKα","","0.0834","0.0448","","","0.0989","0.1131","","","","","","1.025","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107831","10.16","0.003","11.469","0.003","13.227","0.004","75.653","0.006","84.405","0.006","76.52","0.005","1450.8","0.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","9_in_paper","","","- C30 H24 Br6 -","- C30 H24 Br6 -","- C60 H48 Br12 -","2","1","","Birgit Esser; Frank Rominger; Rolf Gleiter","Synthesis of [6.8]3Cyclacene: Conjugated Belt and Model for an Unusual Type of Carbon Nanotube","Journal of the American Chemical Society","2008","130","","6716","6717","10.1021/ja801918n","","","0.71073","MoKα","","0.0941","0.068","","","0.1721","0.186","","","","","","0.995","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107832","10.2829","0.0003","10.2829","0.0003","14.3687","0.0007","90","","90","","90","","1519.32","0.1","273","2","273","2","","","","","","","","4","P 41 2 2","P 4w 2c","91","","","","- C11 H10 O7 Tb -","- C11 H10 O7 Tb -","- C44 H40 O28 Tb4 -","4","0.5","","Banglin Chen; Liangbo Wang; Fatima Zapata; Guodong Qian; Emil B. Lobkovsky","A Luminescent Microporous Metal-Organic Framework for the Recognition and Sensing of Anions","Journal of the American Chemical Society","2008","130","","6718","6719","10.1021/ja802035e","","","0.71073","MoKα","","0.0341","0.0286","","","0.0623","0.0638","","","","","","1.066","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107833","10.972","0.002","12.222","0.002","19.955","0.004","90","","98.005","0.001","90","","2649.9","0.8","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","allene","","","- C31 H24 O4 S2 -","- C31 H24 O4 S2 -","- C124 H96 O16 S8 -","4","1","","Torahiko Yamaguchi; Yohsuke Yamamoto; Daisuke Kinoshita; Kin-ya Akiba; Yun Zhang; Christopher A. Reed; Daisuke Hashizume; Fujiko Iwasaki","Synthesis and Structure of a Hexacoordinate Carbon Compound","Journal of the American Chemical Society","2008","130","","6894","6895","10.1021/ja710423d","","","0.71069","MoKα","","0.0848","0.0728","","","0.2448","0.2643","","","","","","1.209","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107834","14.1088","0.0006","17.7301","0.0007","27.1659","0.0011","90","","102.242","0.001","90","","6641","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H45.88 B22 Br12.12 Cl4 O4 S2 -","- C37 H45.8806 B22 Br12.1194 Cl4 O4 S2 -","- C148 H183.522 B88 Br48.4776 Cl16 O16 S8 -","4","1","","Torahiko Yamaguchi; Yohsuke Yamamoto; Daisuke Kinoshita; Kin-ya Akiba; Yun Zhang; Christopher A. Reed; Daisuke Hashizume; Fujiko Iwasaki","Synthesis and Structure of a Hexacoordinate Carbon Compound","Journal of the American Chemical Society","2008","130","","6894","6895","10.1021/ja710423d","","","0.71073","MoKα","","0.0843","0.0412","","","0.0791","0.0913","","","","","","1.017","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107835","13.755","0.001","17.603","0.001","26.404","0.001","90","","103.17","0.001","90","","6225","0.6","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H45.9425 B22 Cl16.0575 O4 S2 -","- C37 H45.9432 B22 Cl16.0568 O4 S2 -","- C148 H183.773 B88 Cl64.2272 O16 S8 -","4","1","","Torahiko Yamaguchi; Yohsuke Yamamoto; Daisuke Kinoshita; Kin-ya Akiba; Yun Zhang; Christopher A. Reed; Daisuke Hashizume; Fujiko Iwasaki","Synthesis and Structure of a Hexacoordinate Carbon Compound","Journal of the American Chemical Society","2008","130","","6894","6895","10.1021/ja710423d","","","0.3282","Synchrotron","","0.1168","0.0259","","","0.0498","0.0537","","","","","","1.8974","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107836","5.9784","0.0009","22.907","0.003","14.639","0.002","90","","97.816","0.002","90","","1986.1","0.5","","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","parc0105a","","","- C24 H19 N O9 -","- C24 H19 N O9 -","- C96 H76 N4 O36 -","4","2","","Craig A. Parish; Scott K. Smith; Kathleen Calati; Deborah Zink; Kenneth Wilson; Terry Roemer; Bo Jiang; Deming Xu; Gerald Bills; Gonzalo Platas; Fernando Peláez; Maria Teresa Díez; Nancy Tsou; Arlene E. McKeown; Richard G. Ball; Mary Ann Powles; Lai Yeung; Paul Liberator; Guy Harris","Isolation and Structure Elucidation of Parnafungins, Antifungal Natural Products that Inhibit mRNA Polyadenylation","Journal of the American Chemical Society","2008","130","","7060","7066","10.1021/ja711209p","","","","MoKα","","","0.0477","","","","0.1192","","","","","","1.015","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107837","7.6433","0.0007","11.0235","0.001","29.784","0.003","90","","90","","90","","2509.5","0.4","","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","parc0107b","","","- C30 H22 Cl N O9 -","- C30 H22 Cl N O9 -","- C120 H88 Cl4 N4 O36 -","4","1","","Craig A. Parish; Scott K. Smith; Kathleen Calati; Deborah Zink; Kenneth Wilson; Terry Roemer; Bo Jiang; Deming Xu; Gerald Bills; Gonzalo Platas; Fernando Peláez; Maria Teresa Díez; Nancy Tsou; Arlene E. McKeown; Richard G. Ball; Mary Ann Powles; Lai Yeung; Paul Liberator; Guy Harris","Isolation and Structure Elucidation of Parnafungins, Antifungal Natural Products that Inhibit mRNA Polyadenylation","Journal of the American Chemical Society","2008","130","","7060","7066","10.1021/ja711209p","","","","MoKα","","","0.0424","","","","0.0942","","","","","","1.029","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107838","12.5389","0.0008","7.6203","0.0005","14.5275","0.0009","90","","109.201","0.001","90","","1310.89","0.15","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-3-isopropylidenesuccinic anhydride","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.0409","0.0387","","","0.1073","0.1101","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107839","12.5365","0.0009","7.6211","0.0006","14.5294","0.0011","90","","109.18","0.001","90","","1311.11","0.17","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-3-isopropylidenesuccinic anhydride","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.0396","0.0374","","","0.104","0.1067","","","","","","1.018","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107840","12.5388","0.0009","7.6194","0.0006","14.5373","0.0011","90","","109.245","0.001","90","","1311.25","0.17","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-3-isopropylidenesuccinic anhydride","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.0458","0.0412","","","0.1131","0.1176","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107841","12.5342","0.0012","7.6101","0.0008","14.5653","0.0014","90","","108.621","0.002","90","","1316.6","0.2","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-3-isopropylidenesuccinic anhydride","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.0774","0.0624","","","0.1618","0.1721","","","","","","1.099","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107842","12.5318","0.0014","7.6226","0.0008","14.5394","0.0016","90","","109.285","0.002","90","","1310.9","0.2","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-3-isopropylidenesuccinic anhydride","","- C15 H16 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.0573","0.0466","","","0.118","0.1248","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107843","8.1636","0.0005","18.8195","0.0012","10.5104","0.0007","90","","110.805","0.001","90","","1509.47","0.17","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)-2-methylpropylidene]-3-isopropylidenesuccinic anhydride","","- C17 H20 O4 -","- C17 H20 O4 -","- C68 H80 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.042","0.0377","","","0.1014","0.1052","","","","","","1.058","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107844","8.1659","0.0007","18.8346","0.0017","10.5061","0.0009","90","","110.755","0.002","90","","1511","0.2","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)-2-methylpropylidene]-3-isopropylidenesuccinic anhydride","","- C17 H20 O4 -","- C17 H20 O4 -","- C68 H80 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.047","0.0415","","","0.1104","0.1157","","","","","","1.061","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107845","8.2761","0.001","18.741","0.002","10.5382","0.0013","90","","111.036","0.002","90","","1525.6","0.3","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)-2-methylpropylidene]-3-isopropylidenesuccinic anhydride","","- C17 H20 O4 -","- C17 H20 O4 -","- C68 H80 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.1114","0.0769","","","0.1742","0.19","","","","","","1.103","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107846","8.1632","0.0005","18.8242","0.0012","10.5207","0.0007","90","","110.749","0.001","90","","1511.82","0.17","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-2-[1-(2,5-dimethyl-3-furyl)-2-methylpropylidene]-3-isopropylidenesuccinic anhydride","","- C17 H20 O4 -","- C17 H20 O4 -","- C68 H80 O16 -","4","1","","Jun Harada; Ryo Nakajima; Keiichiro Ogawa","X-ray Diffraction Analysis of Photochromic Reaction of Fulgides: Crystalline State Reaction Induced by Two-Photon Excitation","Journal of the American Chemical Society","2008","130","","7085","7091","10.1021/ja800353u","","","0.71073","MoKα","","0.0732","0.0483","","","0.1116","0.1237","","","","","","1.042","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107847","10.1818","0.0005","22.164","0.001","17.8504","0.0009","90","","91.591","0.001","90","","4026.7","0.3","169.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42.5 H65 Ce F4 -","- C42.5 H58 Ce F4 -","- C170 H232 Ce4 F16 -","4","1","","Evan L. Werkema; Richard A. Andersen","Fluorine for Hydrogen Exchange in the Hydrofluorobenzene Derivatives C6HxF(6-x), where x= 2, 3, 4 and 5 by Monomeric [1,2,4-(Me3C)3C5H2]2CeH: The Solid State Isomerization of [1,2,4-(Me3C)3C5H2]2Ce(2,3,4,5-C6HF4) to [1,2,4-(Me3C)3C5H2]2Ce(2,3,4,6-C6HF4)","Journal of the American Chemical Society","2008","130","","7153","7165","10.1021/ja800639f","","","0.7107","MoKα","","0.0453","0.0382","","0.0557","","0.0546","","","","","","2.672","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107848","10.221","0.0006","22.063","0.001","18.024","0.001","90","","92.369","0.001","90","","4061","0.4","158.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42.5 H65 Ce F4 -","- C42.5 H58 Ce F4 -","- C170 H232 Ce4 F16 -","4","1","","Evan L. Werkema; Richard A. Andersen","Fluorine for Hydrogen Exchange in the Hydrofluorobenzene Derivatives C6HxF(6-x), where x= 2, 3, 4 and 5 by Monomeric [1,2,4-(Me3C)3C5H2]2CeH: The Solid State Isomerization of [1,2,4-(Me3C)3C5H2]2Ce(2,3,4,5-C6HF4) to [1,2,4-(Me3C)3C5H2]2Ce(2,3,4,6-C6HF4)","Journal of the American Chemical Society","2008","130","","7153","7165","10.1021/ja800639f","","","0.7107","MoKα","","0.0404","0.0305","","0.0415","","0.0401","","","","","","1.935","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107849","7.8191","0.0005","26.6567","0.0013","6.3613","0.0007","90","","98.659","0.001","90","","1310.78","0.18","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N O3 -","- C16 H13 N O3 -","- C64 H52 N4 O12 -","4","1","","Liang-Qiu Lu; Yi-Ju Cao; Xiao-Peng Liu; Jing An; Chang-Jiang Yao; Zhi-Hui Ming; Wen-Jing Xiao","A New Entry to Cascade Organocatalysis: Reactions of Stable Sulfur Ylides and Nitroolefins Sequentially Catalyzed by Thiourea and DMAP","Journal of the American Chemical Society","2008","130","","6946","6948","10.1021/ja800746q","","","0.71073","MoKα","","0.0961","0.0558","","","0.1347","0.1511","","","","","","1.033","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107850","15.674","0.001","17.967","0.001","6.3228","0.0004","90","","90","","90","","1780.59","0.19","178.2","","","","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C14 H30 B N O3 S -","- C14 H30 B N O3 S -","- C56 H120 B4 N4 O12 S4 -","4","1","","Melissa A. Beenen; Chihui An; Jonathan A. Ellman","Asymmetric Copper-Catalyzed Synthesis of α-Amino Boronate Esters from N-tert-Butanesulfinyl Aldimines","Journal of the American Chemical Society","2008","130","","6910","6911","10.1021/ja800829y","","","0.7107","MoKα","","0.0525","0.0427","","0.0524","","0.0508","","","","","","2.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107851","15.5197","0.0013","22.38","0.002","17.6378","0.0015","90","","92.417","0.002","90","","6120.7","0.9","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C51 H65 Cl2 Cu3 I3 N O10 S4 -","- C51 H65 Cl2 Cu3 I3 N O10 S4 -","- C204 H260 Cl8 Cu12 I12 N4 O40 S16 -","4","1","","Jai Young Lee; So Young Lee; Wonbo Sim; Ki-Min Park; Jineun Kim; Shim Sung Lee","Temperature-Dependent 3-D CuI Coordination Polymers of Calix[4]-bis-dithiacrown: Crystal-to-Crystal Transformation and Photoluminescence Change on Coordinated Solvent Removal","Journal of the American Chemical Society","2008","130","","6902","6903","10.1021/ja8008693","","","0.71073","MoKα","","0.1594","0.0752","","","0.1791","0.2427","","","","","","0.999","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107852","16.151","0.003","18.445","0.003","18.064","0.003","90","","91.451","0.003","90","","5379.6","1.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H60 Cu3 I3 O8.5 S4 -","- C48 H60 Cu3 I3 O8.5 S4 -","- C192 H240 Cu12 I12 O34 S16 -","4","1","","Jai Young Lee; So Young Lee; Wonbo Sim; Ki-Min Park; Jineun Kim; Shim Sung Lee","Temperature-Dependent 3-D CuI Coordination Polymers of Calix[4]-bis-dithiacrown: Crystal-to-Crystal Transformation and Photoluminescence Change on Coordinated Solvent Removal","Journal of the American Chemical Society","2008","130","","6902","6903","10.1021/ja8008693","","","0.71073","MoKα","","0.3169","0.1026","","","0.2233","0.3215","","","","","","0.994","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107853","38.237","0.002","12.0862","0.0007","24.3282","0.0013","90","","91.844","0.001","90","","11237.2","1.1","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C99 H125 Cl2 Cu6 I6 N O16 S8 -","- C99 H125 Cl2 Cu6 I6 N O16 S8 -","- C396 H500 Cl8 Cu24 I24 N4 O64 S32 -","4","0.5","","Jai Young Lee; So Young Lee; Wonbo Sim; Ki-Min Park; Jineun Kim; Shim Sung Lee","Temperature-Dependent 3-D CuI Coordination Polymers of Calix[4]-bis-dithiacrown: Crystal-to-Crystal Transformation and Photoluminescence Change on Coordinated Solvent Removal","Journal of the American Chemical Society","2008","130","","6902","6903","10.1021/ja8008693","","","0.71073","MoKα","","0.0711","0.0482","","","0.1118","0.128","","","","","","1.105","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107854","12.217","0.001","13.545","0.001","15.293","0.0012","90","","109.223","0.001","90","","2389.6","0.3","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 B N7 O4 P W -","- C19 H29 B N7 O4 P W -","- C76 H116 B4 N28 O16 P4 W4 -","4","1","","Michael A. Todd; Michal Sabat; William H. Myers; Timothy M. Smith; W. Dean Harman","Stereoselective Umpolung Tandem Addition of Heteroatoms to Phenol","Journal of the American Chemical Society","2008","130","","6906","6907","10.1021/ja801076z","","","0.71073","MoKα","","0.0593","0.0459","","","0.123","0.1287","","","","","","1.03","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107855","19.315","0.005","10.897","0.003","18.924","0.005","90","","115.879","0.005","90","","3583.6","1.7","273","2","273","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 B Cl6 N8 O4 P W -","- C24 H36 B Cl6 N8 O4 P W -","- C96 H144 B4 Cl24 N32 O16 P4 W4 -","4","1","","Michael A. Todd; Michal Sabat; William H. Myers; Timothy M. Smith; W. Dean Harman","Stereoselective Umpolung Tandem Addition of Heteroatoms to Phenol","Journal of the American Chemical Society","2008","130","","6906","6907","10.1021/ja801076z","","","0.71073","MoKα","","0.0537","0.0426","","","0.1008","0.1047","","","","","","0.97","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107856","13.7982","0.0003","9.9351","0.0002","10.1855","0.0002","90","","92.855","0.001","90","","1394.56","0.05","99","2","99","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 O3 -","- C16 H18 O3 -","- C64 H72 O12 -","4","1","","Guotao Li; Xiaogen Huang; Liming Zhang","Au(I)-Catalyzed Efficient Synthesis of Functionalized Bicyclo[3.2.0]heptanes","Journal of the American Chemical Society","2008","130","","6944","6945","10.1021/ja802294t","","","0.71073","MoKα","","0.0803","0.0676","","","0.1789","0.1873","","","","","","0.967","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107857","5.6851","0.0004","18.5378","0.0017","16.875","0.0012","90","","96.864","0.007","90","","1765.7","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 N O3 S -","- C20 H21 N O3 S -","- C80 H84 N4 O12 S4 -","4","1","","Maciej A. A. Walczak; Peter Wipf","Rhodium(I)-Catalyzed Cycloisomerizations of Bicyclobutanes","Journal of the American Chemical Society","2008","130","","6924","6925","10.1021/ja802906k","","","0.71073","MoKα","","0.0598","0.0449","","","0.1298","0.1482","","","","","","0.593","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107858","7.3968","0.0007","13.8925","0.0017","18.4277","0.0018","112.065","0.007","95.624","0.007","90.53","0.008","1744.3","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H50 N2 Si2 -","- C38 H50 N2 Si2 -","- C76 H100 N4 Si4 -","2","1","","Shaobin Miao; Scott M. Brombosz; Paul V. R. Schleyer; Judy I. Wu; Stephen Barlow; Seth R. Marder; Kenneth I. Hardcastle; Uwe H. F. Bunz","AreN,N-Dihydrodiazatetracene Derivatives Antiaromatic?","Journal of the American Chemical Society","2008","130","","7339","7344","10.1021/ja077614p","","","0.71073","MoKα","","0.2158","0.1484","","","0.3756","0.4149","","","","","","1.073","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107859","30.889","0.004","13.6906","0.0013","7.2062","0.0008","90","","102.456","0.005","90","","2975.7","0.6","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H38 N2 Si2 -","- C32 H38 N2 Si2 -","- C128 H152 N8 Si8 -","4","0.5","","Shaobin Miao; Scott M. Brombosz; Paul V. R. Schleyer; Judy I. Wu; Stephen Barlow; Seth R. Marder; Kenneth I. Hardcastle; Uwe H. F. Bunz","AreN,N-Dihydrodiazatetracene Derivatives Antiaromatic?","Journal of the American Chemical Society","2008","130","","7339","7344","10.1021/ja077614p","","","1.54178","CuKα","","0.1282","0.0883","","","0.2224","0.2471","","","","","","1.076","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107860","7.069","0.0002","8.436","0.0003","18.5219","0.0006","90","","95.23","0.002","90","","1099.94","0.06","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 N2 -","- C16 H10 N2 -","- C64 H40 N8 -","4","1","","Shaobin Miao; Scott M. Brombosz; Paul V. R. Schleyer; Judy I. Wu; Stephen Barlow; Seth R. Marder; Kenneth I. Hardcastle; Uwe H. F. Bunz","AreN,N-Dihydrodiazatetracene Derivatives Antiaromatic?","Journal of the American Chemical Society","2008","130","","7339","7344","10.1021/ja077614p","","","1.54178","CuKα","","0.0541","0.0395","","","0.1152","0.128","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107861","5.8275","0.0003","7.8508","0.0004","12.515","0.0007","101.29","0.003","100.541","0.003","94.365","0.004","548.28","0.05","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H12 N2 -","- C16 H12 N2 -","- C32 H24 N4 -","2","1","","Shaobin Miao; Scott M. Brombosz; Paul V. R. Schleyer; Judy I. Wu; Stephen Barlow; Seth R. Marder; Kenneth I. Hardcastle; Uwe H. F. Bunz","AreN,N-Dihydrodiazatetracene Derivatives Antiaromatic?","Journal of the American Chemical Society","2008","130","","7339","7344","10.1021/ja077614p","","","1.54178","CuKα","","0.0535","0.0445","","","0.1313","0.1404","","","","","","1.052","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107862","21.3885","0.0013","15.3559","0.0008","21.9899","0.0014","90","","117.885","0.001","90","","6383.8","0.7","143","1","143","1","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C72 H72 Li3 N6 O6 Y -","- C72 H72 Li3 N6 O6 Y -","- C288 H288 Li12 N24 O24 Y4 -","4","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0506","0.044","","","0.0972","0.1016","","","","","","1.053","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107863","21.4512","0.0011","15.2859","0.0007","22.0196","0.0011","90","","117.987","0.001","90","","6375.9","0.5","143","1","143","1","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C72 H72 Li3 Lu N6 O6 -","- C72 H72 Li3 Lu N6 O6 -","- C288 H288 Li12 Lu4 N24 O24 -","4","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0457","0.037","","","0.0676","0.0729","","","","","","1.121","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107864","21.3491","0.0013","15.4596","0.0008","22.1083","0.0014","90","","117.82","","90","","6453.4","0.7","143","1","143","1","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C72 H72 La Li3 N6 O6 -","- C72 H72 La Li3 N6 O6 -","- C288 H288 La4 Li12 N24 O24 -","4","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0619","0.0598","","","0.1423","0.1442","","","","","","1.051","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107865","18.532","0.004","11.479","0.003","19.262","0.005","90","","101.379","0.002","90","","4017","1.7","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C80 H76 La Li3 O11 -","- C80 H76 La Li3 O11 -","- C160 H152 La2 Li6 O22 -","2","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0767","0.0585","","","0.1237","0.1357","","","","","","1.035","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107866","13.36","0.0008","13.5347","0.0008","23.0661","0.0015","90","","101.927","0.001","90","","4080.9","0.4","143","1","143","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C100 H76 La Li3 N6 O6 -","- C100 H76 La Li3 N8 O6 -","- C200 H152 La2 Li6 N16 O12 -","2","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0334","0.0308","","","0.0742","0.0768","","","","","","1.082","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107867","21.28","0.003","15.4073","0.0016","21.986","0.003","90","","117.708","0.003","90","","6381.9","1.4","143","1","143","1","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C72 H72 Eu Li3 N6 O6 -","- C72 H72 Eu Li3 N6 O6 -","- C288 H288 Eu4 Li12 N24 O24 -","4","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0491","0.0431","","","0.0935","0.0975","","","","","","1.055","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107868","18.2048","0.0006","11.4818","0.0004","18.9389","0.0007","90","","100.19","0.001","90","","3896.2","0.2","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C80 H76 Eu Li3 O11 -","- C80 H76 Eu Li3 O11 -","- C160 H152 Eu2 Li6 O22 -","2","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71073","MoKα","","0.0536","0.0518","","","0.1584","0.1608","","","","","","1.151","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107869","19.416","0.002","25.18","0.003","29.907","0.003","90","","90","","90","","14621","3","143","1","143","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C70.5 H74 Eu Li3 N8.5 O6.5 -","- C70.5 H74 Eu Li3 N8.5 O6.5 -","- C564 H592 Eu8 Li24 N68 O52 -","8","2","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0647","0.0582","","","0.1743","0.1801","","","","","","1.095","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107870","18.0621","0.0008","31.9433","0.0013","14.5269","0.0006","90","","90","","90","","8381.5","0.6","143","1","143","1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C195 H147 Eu2 Li6 N15 O12 -","- C180 H132 Eu2 Li6 N12 O12 -","- C360 H264 Eu4 Li12 N24 O24 -","2","0.5","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0555","0.0367","","","0.077","0.0822","","","","","","0.773","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107871","11.3943","0.0009","13.5615","0.0011","14.5726","0.0011","105.098","0.001","110.681","0.001","106.799","0.001","1844.2","0.3","143","1","143","1","","","","","","","","5","P 1","P 1","1","","","","- C84 H84 Li3 O12 Yb -","- C84 H84 Li3 O12 Yb -","- C84 H84 Li3 O12 Yb -","1","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.027","0.0268","","","0.0563","0.0564","","","","","","0.977","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107872","18.2837","0.0013","11.4684","0.0008","19.0027","0.0014","90","","100.562","0.002","90","","3917.1","0.5","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C80 H76 Li3 O11 Pr -","- C80 H76 Li3 O11 Pr -","- C160 H152 Li6 O22 Pr2 -","2","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.054","0.0477","","","0.1161","0.1235","","","","","","1.097","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107873","17.988","0.0006","31.6872","0.001","14.5672","0.0005","90","","90","","90","","8303.1","0.5","143","1","143","1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C97.5 H73.5 Li3 N7.5 O6 Yb -","- C97.5 H73.5 Li3 N7.5 O6 Yb -","- C390 H294 Li12 N30 O24 Yb4 -","4","1","","Alfred J. Wooten; Patrick J. Carroll; Patrick J. Walsh","Insight into Substrate Binding in Shibasaki's Li3(THF)n(BINOLate)3Ln Complexes and Implications in Catalysis","Journal of the American Chemical Society","2008","130","","7407","7419","10.1021/ja7107933","","","0.71069","MoKα","","0.0649","0.0519","","","0.1411","0.1524","","","","","","1.056","","","","has coordinates","270822","2021-11-23","08:35:46",""
"4107874","11.241","0.013","13.471","0.015","21.93","0.02","88.995","0.012","88.021","0.012","81.839","0.011","3285","6","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H31 B F2 N2 S4 -","- C33 H31 B F2 N2 S4 -","- C132 H124 B4 F8 N8 S16 -","4","2","","Andrew C. Benniston; Graeme Copley; Anthony Harriman; Dorota B. Rewinska; Ross W. Harrington; William Clegg","A Donor-Acceptor Molecular Dyad Showing Multiple Electronic Energy-Transfer Processes in Crystalline and Amorphous States","Journal of the American Chemical Society","2008","130","","7174","7175","10.1021/ja800387d","","","0.7977","synchrotron","","0.1862","0.1023","","","0.2652","0.3088","","","","","","0.947","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107875","13.697","0.002","11.7074","0.0016","14.558","0.002","90","","90","","90","","2334.5","0.6","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C21 H18 B F3 Mo N6 O4 -","- C21 H18 B F3 Mo N6 O4 -","- C84 H72 B4 F12 Mo4 N24 O16 -","4","1","","Ethel C. Garnier; Lanny S. Liebeskind","Organometallic Enantiomeric Scaffolding: General Access to 2-Substituted Oxa- and Azabicyclo[3.2.1]octenes via a Brønsted Acid Catalyzed [5 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2008","130","","7449","7458","10.1021/ja800664v","","","0.71073","MoKα","","0.1051","0.0753","","","0.1447","0.1564","","","","","","1.033","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107876","10.304","0.002","13.205","0.003","13.799","0.003","90","","110.89","0.03","90","","1754.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 N O2 S -","- C18 H25 N O2 S -","- C72 H100 N4 O8 S4 -","4","1","","Lei Jiao; Siyu Ye; Zhi-Xiang Yu","Rh(I)-Catalyzed Intramolecular [3 + 2] Cycloaddition of trans-Vinylcyclopropane-enes","Journal of the American Chemical Society","2008","130","","7178","7179","10.1021/ja8008715","","","0.71073","MoKα","","0.1189","0.0577","","","0.1258","0.14","","","","","","0.974","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107877","11.0258","0.0005","14.7287","0.0006","17.6215","0.0007","90","","90","","90","","2861.7","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H51 Br O3 Si -","- C25 H51 Br O3 Si -","- C100 H204 Br4 O12 Si4 -","4","1","","Hao Li; Teck-Peng Loh","Control of up to Five Stereocenters in a Cascade Reaction: Synthesis of Highly Functionalized Five-Membered Rings","Journal of the American Chemical Society","2008","130","","7194","7195","10.1021/ja801488z","","","0.71073","MoKα","","0.0603","0.0368","","","0.0743","0.0826","","","","","","1.031","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107878","10.5848","0.0004","10.8318","0.0004","14.6865","0.0005","105.455","0.002","109.497","0.002","98.896","0.002","1473.89","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H49 Cl O3 Si -","- C29 H49 Cl O3 Si -","- C58 H98 Cl2 O6 Si2 -","2","1","","Hao Li; Teck-Peng Loh","Control of up to Five Stereocenters in a Cascade Reaction: Synthesis of Highly Functionalized Five-Membered Rings","Journal of the American Chemical Society","2008","130","","7194","7195","10.1021/ja801488z","","","0.71073","MoKα","","0.0677","0.0491","","","0.1498","0.1794","","","","","","1.12","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107879","16.694","0.006","25.514","0.009","11.092","0.004","90","0.002","94.772","0.002","90","0.002","4708","3","113","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H54 Cl4 Fe2 -","- C56 H54 Cl4 Fe2 -","- C224 H216 Cl16 Fe8 -","4","1","","Satoshi Muratsugu; Shoko Kume; Hiroshi Nishihara","Redox-Assisted Ring Closing Reaction of the Photogenerated Cyclophanediene Form of Bis(ferrocenyl)dimethyldihydropyrene with Interferrocene Electronic Communication Switching","Journal of the American Chemical Society","2008","130","","7204","7205","10.1021/ja8016494","","","0.7107","MoKα","","","0.0863","","","","0.2489","","","","","","1.063","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107880","20.4473","0.001","8.5753","0.0004","20.7023","0.0011","90","","95.704","0.002","90","","3612","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3235VWM","","","- C39 H49 N5 O6 Ru -","- C39 H49 N5 O6 Ru -","- C156 H196 N20 O24 Ru4 -","4","1","","Virginia W. Manner; Antonio G. DiPasquale; James M. Mayer","Facile Concerted Proton-Electron Transfers in a Ruthenium Terpyridine-4'-Carboxylate Complex with a Long Distance Between the Redox and Basic Sites","Journal of the American Chemical Society","2008","130","","7210","7211","10.1021/ja801672w","","","1.54178","CuKα","","0.0378","0.0334","","","0.0769","0.079","","","","","","1.055","","","","has coordinates,has disorder","204147","2020-10-21","18:00:00",""
"4107881","19.507","0.004","8.412","0.001","12.104","0.002","90","","91.85","0.02","90","","1985.1","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Bis(bis(ethylenedithio)tetraselenafulvalene) tri(dicyanamidomanganate (II)","","","- C26 H16 Mn N9 S8 Se8 -","- C26 H16 Mn N9 S8 Se8 -","- C52 H32 Mn2 N18 S16 Se16 -","2","0.5","","Nataliya D. Kushch; Eduard B. Yagubskii; Mark V. Kartsovnik; Lev I. Buravov; Alexander D. Dubrovskii; Anatolii N. Chekhlov; Werner Biberacher","π-Donor BETS Based Bifunctional Superconductor with Polymeric Dicyanamidomanganate(II) Anion Layer: κ-(BETS)2Mn[N(CN)2]3","Journal of the American Chemical Society","2008","130","","7238","7240","10.1021/ja801841q","","","0.7107","MoKα","","0.0809","0.0392","","0.113","0.086","","","","0.935","1.081","1.081","","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107882","15.2815","0.0003","10.8506","0.0002","20.2006","0.0003","90","","104.951","0.001","90","","3236.14","0.1","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H24 N2 O2 -","- C17 H24 N2 O2 -","- C136 H192 N16 O16 -","8","1","","Baoguo Zhao; Haifeng Du; Yian Shi","A Cu(I)-Catalyzed C-H α-Amination of Esters. Direct Synthesis of Hydantoins","Journal of the American Chemical Society","2008","130","","7220","7221","10.1021/ja802242h","","","0.71073","MoKα","","0.0569","0.0443","","","0.123","0.1333","","","","","","1.032","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107883","9.4261","0.0003","19.5939","0.0006","7.9784","0.0002","90","","103.533","0.002","90","","1432.65","0.07","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 N2 O3 -","- C15 H18 N2 O3 -","- C60 H72 N8 O12 -","4","1","","Baoguo Zhao; Haifeng Du; Yian Shi","A Cu(I)-Catalyzed C-H α-Amination of Esters. Direct Synthesis of Hydantoins","Journal of the American Chemical Society","2008","130","","7220","7221","10.1021/ja802242h","","","0.71073","MoKα","","0.0889","0.052","","","0.1321","0.154","","","","","","1.062","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107884","13.563","0.0011","11.4777","0.0009","13.6129","0.001","90","","105.522","0.003","90","","2041.9","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","LCCFormOH","","","- C23 H31 N O7 -","- C23 H31 N O7 -","- C92 H124 N4 O28 -","4","2","","Ryan A. Shenvi; Carlos A. Guerrero; Jun Shi; Chuang-Chuang Li; Phil S. Baran","Synthesis of (+)-Cortistatin A","Journal of the American Chemical Society","2008","130","","7241","7243","10.1021/ja8023466","","","1.54178","CuKα","","0.027","0.0266","","","0.0691","0.0694","","","","","","1.046","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4107885","7.3942","0.0003","9.8421","0.0004","27.3297","0.0014","90","","90","","90","","1988.9","0.15","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","LCC-diol","","","- C22 H31 N O6 -","- C22 H31 N O6 -","- C88 H124 N4 O24 -","4","1","","Ryan A. Shenvi; Carlos A. Guerrero; Jun Shi; Chuang-Chuang Li; Phil S. Baran","Synthesis of (+)-Cortistatin A","Journal of the American Chemical Society","2008","130","","7241","7243","10.1021/ja8023466","","","1.54178","CuKα","","0.0391","0.0318","","","0.07","0.0733","","","","","","1.031","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4107886","14.0002","0.0008","6.891","0.0004","14.3433","0.0008","90","","98.124","0.003","90","","1369.89","0.14","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","JS-3","","","- C26 H36 N O7 Si -","- C26 H36 N O7 Si -","- C52 H72 N2 O14 Si2 -","2","1","","Ryan A. Shenvi; Carlos A. Guerrero; Jun Shi; Chuang-Chuang Li; Phil S. Baran","Synthesis of (+)-Cortistatin A","Journal of the American Chemical Society","2008","130","","7241","7243","10.1021/ja8023466","","","1.54178","CuKα","","0.034","0.0317","","","0.0811","0.0825","","","","","","1.057","","","","has coordinates","278044","2022-09-21","13:27:52",""
"4107887","14.801","0.0007","19.3787","0.0009","7.3587","0.0003","90","","90","","90","","2110.65","0.16","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","LCC-Br-cyclo","","","- C23 H28 Br N O7 -","- C23 H28 Br N O7 -","- C92 H112 Br4 N4 O28 -","4","1","","Ryan A. Shenvi; Carlos A. Guerrero; Jun Shi; Chuang-Chuang Li; Phil S. Baran","Synthesis of (+)-Cortistatin A","Journal of the American Chemical Society","2008","130","","7241","7243","10.1021/ja8023466","","","0.71073","MoKα","","0.0328","0.0299","","","0.0761","0.0775","","","","","","1.037","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4107888","9.2942","0.0008","9.2942","0.0008","16.1873","0.0019","90","","90","","90","","1398.3","0.2","293","2","293","2","","","","","","","","4","P 41","P 4w","76","","","","- C15 H13 Br O3 -","- C15 H13 Br O3 -","- C60 H52 Br4 O12 -","4","1","","Ying-Qing Jiang; Yong-Ling Shi; Min Shi","Chiral Phosphine-Catalyzed Enantioselective Construction of γ-Butenolides Through Substitution of Morita-Baylis-Hillman Acetates with 2-Trimethylsilyloxy Furan","Journal of the American Chemical Society","2008","130","","7202","7203","10.1021/ja802422d","","","0.71073","MoKα","","0.0752","0.065","","","0.1574","0.1632","","","","","","1.07","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107889","17.5145","0.0007","11.3698","0.0004","18.5318","0.0007","90","","113.714","0.001","90","","3378.8","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 B N2 -","- C20 H23 B N2 -","- C160 H184 B8 N16 -","8","2","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Crystal Clear Structural Evidence for Electron Delocalization in 1,2-Dihydro-1,2-azaborines","Journal of the American Chemical Society","2008","130","","7250","7252","10.1021/ja8024966","","","0.71073","MoKα","","0.0612","0.0506","","","0.1328","0.145","","","","","","1.003","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107890","17.7457","0.0013","11.468","0.0008","18.6032","0.0014","90","","113.451","0.001","90","","3473.2","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 B N2 -","- C20 H25 B N2 -","- C160 H200 B8 N16 -","8","2","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Crystal Clear Structural Evidence for Electron Delocalization in 1,2-Dihydro-1,2-azaborines","Journal of the American Chemical Society","2008","130","","7250","7252","10.1021/ja8024966","","","0.71073","MoKα","","0.0559","0.0452","","","0.1058","0.1146","","","","","","1.061","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107891","9.3902","0.0006","16.6049","0.0011","11.3179","0.0008","90","","98.344","0.001","90","","1746","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H25 B N2 -","- C20 H25 B N2 -","- C80 H100 B4 N8 -","4","1","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Crystal Clear Structural Evidence for Electron Delocalization in 1,2-Dihydro-1,2-azaborines","Journal of the American Chemical Society","2008","130","","7250","7252","10.1021/ja8024966","","","0.71073","MoKα","","0.063","0.046","","","0.0989","0.109","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107892","10.1761","0.0011","11.5744","0.0012","15.4369","0.0016","81.469","0.002","83.033","0.002","74.388","0.002","1725.4","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H25 B N2 -","- C20 H25 B N2 -","- C80 H100 B4 N8 -","4","2","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Crystal Clear Structural Evidence for Electron Delocalization in 1,2-Dihydro-1,2-azaborines","Journal of the American Chemical Society","2008","130","","7250","7252","10.1021/ja8024966","","","0.71073","MoKα","","0.0921","0.0557","","","0.1184","0.1349","","","","","","1.028","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107893","9.6233","0.0008","16.3666","0.0013","11.5544","0.0009","90","","96.654","0.002","90","","1807.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H27 B N2 -","- C20 H27 B N2 -","- C80 H108 B4 N8 -","4","1","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Crystal Clear Structural Evidence for Electron Delocalization in 1,2-Dihydro-1,2-azaborines","Journal of the American Chemical Society","2008","130","","7250","7252","10.1021/ja8024966","","","0.71073","MoKα","","0.0868","0.052","","","0.1091","0.1282","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107894","9.3648","0.001","10.0518","0.0011","18.751","0.002","90","","90","","90","","1765.1","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 N O3 S -","- C19 H25 N O3 S -","- C76 H100 N4 O12 S4 -","4","1","","Liang Lu; Wei Zhang; Rich G. Carter","Total Synthesis of Cytotoxic Macrolide Amphidinolide B1and the Proposed Structure of Amphidinolide B2","Journal of the American Chemical Society","2008","130","","7253","7255","10.1021/ja803012n","","","0.71073","MoKα","","0.0618","0.0436","","","0.0799","0.0876","","","","","","1.06","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107895","5.58392","0.00017","38.9909","0.0011","5.61065","0.00018","90","","90","","90","","1221.56","0.06","","","","","","","","","","","","5","I m m a","-I 2b 2","74","","","","- Ba0.81 Ca0.78 Fe2.5 Nd0.91 O6.43 -","- Ba0.8116 Ca0.77905 Fe2.5 Nd0.90915 O6.43 -","- Ba6.4928 Ca6.2324 Fe20 Nd7.2732 O51.44 -","8","0.5","","Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky","Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments","Journal of the American Chemical Society","2008","130","","7570","7583","10.1021/ja077762f","powder diffraction","neutron","1.59432","","","","","","","","","0.09473","","3.23","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4107896","18.99784","","5.38025","","8.43848","","90","","90","","90","","862.523","","","","","","","","","","","","","3","B b 21 m","B -2 -2b","36","","","","- Ba Fe2 O4 -","- Ba Fe2 O4 -","- Ba8 Fe16 O32 -","8","1","","Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky","Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments","Journal of the American Chemical Society","2008","130","","7570","7583","10.1021/ja077762f","powder diffraction","x-ray","1.78896","","","","","","","","","0.08315","","1.11","","","","","","","has coordinates,has Fobs","178824","2020-10-21","18:00:00",""
"4107897","4.98","0.004","8.509","0.006","16.242","0.012","92.121","0.011","96.382","0.014","97.568","0.012","677.1","0.9","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 I4 N4 O2 -","- C20 H18 I4 N4 O2 -","- C20 H18 I4 N4 O2 -","1","0.5","","Liang Luo; Christopher Wilhelm; Aiwu Sun; Clare P. Grey; Joseph W. Lauher; Nancy S. Goroff","Poly(diiododiacetylene): Preparation, Isolation, and Full Characterization of a Very Simple Poly(diacetylene)","Journal of the American Chemical Society","2008","130","","7702","7709","10.1021/ja8011403","","","0.71073","MoKα","","0.3385","0.0636","","","0.1272","0.1743","","","","","","0.645","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107898","4.9395","0.0017","8.699","0.003","15.821","0.006","94.874","0.008","97.664","0.006","98.583","0.007","662.4","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 I4 N4 O2 -","- C20 H18 I4 N4 O2 -","- C20 H18 I4 N4 O2 -","1","0.5","","Liang Luo; Christopher Wilhelm; Aiwu Sun; Clare P. Grey; Joseph W. Lauher; Nancy S. Goroff","Poly(diiododiacetylene): Preparation, Isolation, and Full Characterization of a Very Simple Poly(diacetylene)","Journal of the American Chemical Society","2008","130","","7702","7709","10.1021/ja8011403","","","0.71073","MoKα","","0.1288","0.06","","","0.138","0.1655","","","","","","0.864","","","","has coordinates","178824","2020-10-21","18:00:00",""
"4107899","5.3592","0.0001","6.121","0.0002","10.633","0.0003","90.47","0.002","95.167","0.002","100.205","0.002","341.785","0.016","293","2","293","2","","","","","","","","6","P -1","-P 1","2","DITFB/tmo 1/1","1,4-difluorotetraiodobenzene-1,4-thimorpholine 1/1","","- C10 H9 F4 I2 N S -","- C10 H9 F4 I2 N S -","- C10 H9 F4 I2 N S -","1","0.5","","Dominik Cinčić; Tomislav Friščić; William Jones","A Stepwise Mechanism for the Mechanochemical Synthesis of Halogen-Bonded Cocrystal Architectures","Journal of the American Chemical Society","2008","130","","7524","7525","10.1021/ja801164v","","","0.71073","MoKα","","0.0426","0.0337","","","0.0696","0.0742","","","","","","1.114","","","","has coordinates,has disorder","178824","2020-10-21","18:00:00",""
"4107900","5.2314","0.0001","6.1085","0.0001","15.3239","0.0003","100.209","0.001","96.185","0.001","99.371","0.001","470.778","0.015","180","2","180","2","","","","","","","","6","P -1","-P 1","2","(1,4-tfib).(tmo)2","1,4-diiodotetrafluorobenzene-1,4-thiomorpholine 1/2","","- C14 H18 F4 I2 N2 S2 -","- C14 H18 F4 I2 N2 S2 -","- C14 H18 F4 I2 N2 S2 -","1","0.5","","Dominik Cinčić; Tomislav Friščić; William Jones","A Stepwise Mechanism for the Mechanochemical Synthesis of Halogen-Bonded Cocrystal Architectures","Journal of the American Chemical Society","2008","130","","7524","7525","10.1021/ja801164v","","","0.71073","MoKα","","0.0325","0.0315","","","0.0825","0.0837","","","","","","1.049","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107901","5.2892","0.0001","6.0639","0.0001","15.3113","0.0003","99.382","0.001","95.93","0.001","99.454","0.001","473.643","0.015","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(1,4-tfib).(pipe)2","1,4-diiodotetrafluorobenzene-piperidine 1/2","","- C16 H22 F4 I2 N2 -","- C16 H22 F4 I2 N2 -","- C16 H22 F4 I2 N2 -","1","0.5","","Dominik Cinčić; Tomislav Friščić; William Jones","A Stepwise Mechanism for the Mechanochemical Synthesis of Halogen-Bonded Cocrystal Architectures","Journal of the American Chemical Society","2008","130","","7524","7525","10.1021/ja801164v","","","0.71073","MoKα","","0.0383","0.0355","","","0.0957","0.0977","","","","","","1.213","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107902","8.9245","0.0002","21.1954","0.0003","7.2904","0.0001","90","","90","","90","","1379.04","0.04","180","2","180","2","","","","","","","","6","P n m a","-P 2ac 2n","62","ODI-tmo 1/1","1,2-DIIODOTETRAFLUOROBENZENE-1,4-THIOMORPHOLINE 1/1","","- C10 H9 F4 I2 N S -","- C10 H9 F4 I2 N S -","- C40 H36 F16 I8 N4 S4 -","4","0.5","","Dominik Cinčić; Tomislav Friščić; William Jones","A Stepwise Mechanism for the Mechanochemical Synthesis of Halogen-Bonded Cocrystal Architectures","Journal of the American Chemical Society","2008","130","","7524","7525","10.1021/ja801164v","","","0.71073","MoKα","","0.0507","0.0386","","","0.0932","0.1107","","","","","","1.263","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107903","10.818","0.001","13.2984","0.0012","16.557","0.0015","90","","90","","90","","2381.9","0.4","163","2","163","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C33 H25 N3 -","- C33 H25 N3 -","- C132 H100 N12 -","4","1","","Dennis H. Leung; Joseph W. Ziller; Zhibin Guan","Axial Donating Ligands: A New Strategy for Late Transition Metal Olefin Polymerization Catalysis","Journal of the American Chemical Society","2008","130","","7538","7539","10.1021/ja8017847","","","0.71073","MoKα","","0.0677","0.039","","","0.0736","0.086","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107904","12.1681","0.0012","12.2662","0.0012","12.3904","0.0012","67.212","0.002","81.112","0.002","78.737","0.002","1665.8","0.3","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 Cl N3 Pd -","- C34 H28 Cl N3 Pd -","- C68 H56 Cl2 N6 Pd2 -","2","1","","Dennis H. Leung; Joseph W. Ziller; Zhibin Guan","Axial Donating Ligands: A New Strategy for Late Transition Metal Olefin Polymerization Catalysis","Journal of the American Chemical Society","2008","130","","7538","7539","10.1021/ja8017847","","","0.71073","MoKα","","0.0616","0.0586","","","0.1925","0.1966","","","","","","1.128","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107905","19.306","0.003","16.092","0.003","21.832","0.004","90","","108.852","0.008","90","","6419","2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C71 H19 B2 F40 N O -","- C71 H19 B2 F40 N O -","- C284 H76 B8 F160 N4 O4 -","4","0.5","","Edward L. Clennan; Chen Liao; Erambo Ayokosok","Pyrylogens: Synthesis, Structural, Electrochemical, and Photophysical Characterization of a New Class of Electron Transfer Sensitizers","Journal of the American Chemical Society","2008","130","","7552","7553","10.1021/ja802343v","","","0.71073","MoKα","","0.1047","0.0451","","","0.1164","0.1438","","","","","","1.029","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107906","6.7443","0.0019","11.952","0.004","15.773","0.005","90","","90","","90","","1271.4","0.7","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N O4 -","- C14 H19 N O4 -","- C56 H76 N4 O16 -","4","1","","Peng Liu; Sungwoo Hong; Steven M. Weinreb","Total Synthesis of the Securinega Alkaloid (-)-Secu'amamine A","Journal of the American Chemical Society","2008","130","","7562","7563","10.1021/ja802700z","","","0.71073","MoKα","","0.0417","0.0399","","","0.0987","0.1008","","","","","","0.757","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107907","7.5059","0.0009","7.1184","0.0009","10.6757","0.0013","90","","90.675","0.002","90","","570.36","0.12","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C26 H30 N2 O6 -","2","1","","Peng Liu; Sungwoo Hong; Steven M. Weinreb","Total Synthesis of the Securinega Alkaloid (-)-Secu'amamine A","Journal of the American Chemical Society","2008","130","","7562","7563","10.1021/ja802700z","","","0.71073","MoKα","","0.0406","0.038","","","0.0987","0.101","","","","","","1.06","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107908","9.5856","0.001","21.593","0.002","14.2124","0.0015","90","","104.175","0.002","90","","2852.1","0.5","158","2","158","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H38 N2 O7 -","- C29 H38 N2 O7 -","- C116 H152 N8 O28 -","4","1","","Connor L. Martin; Larry E. Overman; Jason M. Rohde","Total Synthesis of (\±)-Actinophyllic Acid","Journal of the American Chemical Society","2008","130","","7568","7569","10.1021/ja803158y","","","0.71073","MoKα","","0.0652","0.0408","","","0.0931","0.1088","","","","","","1.022","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107909","5.56049","0.00005","38.71093","0.00031","5.58134","0.00005","90","","90","","90","","1201.39","0.018","","","","","","","","","","","","5","I 2 m b","I -2b 2","46","","","","- Ba1.62 Ca1.56 Fe5 Nd1.82 O13 -","- Ba1.6232 Ca1.5581 Fe5 Nd1.8183 O13 -","- Ba6.4928 Ca6.2324 Fe20 Nd7.2732 O52 -","4","0.5","","Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky","Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments","Journal of the American Chemical Society","2008","130","","7570","7583","10.1021/ja077762f","powder diffraction","x-ray","0.6","","","","","","","","","0.05176","","2.56","","","","","","","has coordinates,has Fobs","178825","2020-10-21","18:00:00",""
"4107910","5.56053","0.00006","38.7107","0.0004","5.58133","0.00006","90","","90","","90","","1201.39","0.02","","","","","","","","","","","","5","I m m a","-I 2b 2","74","","","","- Ba0.41 Ca0.39 Fe1.25 Nd0.45 O3.25 -","- Ba0.4058 Ca0.389525 Fe1.25 Nd0.454575 O3.25 -","- Ba6.4928 Ca6.2324 Fe20 Nd7.2732 O52 -","16","1","","Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky","Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments","Journal of the American Chemical Society","2008","130","","7570","7583","10.1021/ja077762f","powder diffraction","x-ray","0.6","","","","","","","","","0.05181","","2.63","","","","","","","has coordinates,has Fobs","178825","2020-10-21","18:00:00",""
"4107911","5.52075","0.00005","11.68876","0.00013","5.60301","0.00005","90","","90","","90","","361.566","0.006","","","","","","","","","","","","5","P m m a","-P 2a 2a","51","","","","- Ba Ca Fe3 Nd O8 -","- Ba Ca1.0004 Fe3 Nd0.9999 O8 -","- Ba2 Ca2.0008 Fe6 Nd1.9998 O16 -","2","0.25","","Christophe Tenailleau; Mathieu Allix; John B. Claridge; Maryvonne Hervieu; Michael F. Thomas; James P. Hirst; Matthew J. Rosseinsky","Modular Construction of Oxide Structures-Compositional Control of Transition Metal Coordination Environments","Journal of the American Chemical Society","2008","130","","7570","7583","10.1021/ja077762f","powder diffraction","","","","","","","","","","","","","1.11","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4107912","10.4434","0.0007","11.6473","0.0006","15.558","0.0009","90","","90","","90","","1892.43","0.19","160","1","160","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H28 N2 O6 -","- C15 H28 N2 O6 -","- C60 H112 N8 O24 -","4","1","","Enrique Gomez-Bengoa; Anthony Linden; Rosa López; Idoia Múgica-Mendiola; Mikel Oiarbide; Claudio Palomo","Asymmetric Aza-Henry Reaction Under Phase Transfer Catalysis: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","7955","7966","10.1021/ja800253z","","","0.71073","MoKα","","0.071","0.0564","","","0.1425","0.1533","","","","","","1.056","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4107913","5.2003","0.0011","7.5427","0.0017","8.9943","0.0019","66.624","0.002","77.794","0.002","74.287","0.003","309.57","0.12","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H10 Cd O12 -","- C8 H10 Cd O12 -","- C8 H10 Cd O12 -","1","0.5","","Bo Zheng; Hao Dong; Junfeng Bai; Yizhi Li; Shuhua Li; Manfred Scheer","Temperature Controlled Reversible Change of the Coordination Modes of the Highly Symmetrical Multitopic Ligand To Construct Coordination Assemblies: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","7778","7779","10.1021/ja800439p","","","0.71073","MoKα","","0.0283","0.0269","","","0.0643","0.0646","","","","","","1.082","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107914","6.9429","0.0009","16.203","0.002","16.022","0.002","90","","99.525","0.002","90","","1777.6","0.4","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 Cd4 O34 -","- C16 H36 Cd4 O34 -","- C32 H72 Cd8 O68 -","2","0.5","","Bo Zheng; Hao Dong; Junfeng Bai; Yizhi Li; Shuhua Li; Manfred Scheer","Temperature Controlled Reversible Change of the Coordination Modes of the Highly Symmetrical Multitopic Ligand To Construct Coordination Assemblies: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","7778","7779","10.1021/ja800439p","","","0.71073","MoKα","","0.0601","0.0508","","","0.1303","0.1359","","","","","","1.055","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107915","8.2631","0.0007","12.0373","0.0011","6.2297","0.0006","90","","102.876","0.001","90","","604.06","0.1","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H4 Cd O6 -","- C4 H4 Cd O6 -","- C16 H16 Cd4 O24 -","4","1","","Bo Zheng; Hao Dong; Junfeng Bai; Yizhi Li; Shuhua Li; Manfred Scheer","Temperature Controlled Reversible Change of the Coordination Modes of the Highly Symmetrical Multitopic Ligand To Construct Coordination Assemblies: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","7778","7779","10.1021/ja800439p","","","0.71073","MoKα","","0.0325","0.0309","","","0.0743","0.075","","","","","","1.154","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107916","11.7671","0.0008","11.7671","0.0008","14.9271","0.0014","90","","90","","120","","1790","0.2","291","2","291","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C4 H4 Cd O6 -","- C4 H4 Cd O6 -","- C36 H36 Cd9 O54 -","9","0.5","","Bo Zheng; Hao Dong; Junfeng Bai; Yizhi Li; Shuhua Li; Manfred Scheer","Temperature Controlled Reversible Change of the Coordination Modes of the Highly Symmetrical Multitopic Ligand To Construct Coordination Assemblies: Experimental and Theoretical Studies","Journal of the American Chemical Society","2008","130","","7778","7779","10.1021/ja800439p","","","0.71073","MoKα","","0.0194","0.0192","","","0.0503","0.0504","","","","","","1.092","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107917","33.1947","0.0016","9.7794","0.0004","18.2274","0.0007","90","","92.52","0.001","90","","5911.3","0.4","16","2","16","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C55 H73 Co3 N5 O19 -","- C55 H73 Co3 N5 O19 -","- C220 H292 Co12 N20 O76 -","4","0.5","","H. F. Clausen; J. Overgaard; Yu-Sheng Chen; Bo Brummerstedt Iversen","Synchrotron X-ray Charge Density Study of Coordination Polymer Co~3~(C~8~H~4~O~4~)~4~(C~4~H~12~N)~2~(C~5~H~11~NO)~3~ at 16 K","Journal of the American Chemical Society","2008","130","","7988","7996","10.1021/ja8007215","","","0.41328","synchrotron","","0.038","0.023","","","","0.053","0.035","","","","","0.627","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107918","8.1456","0.0004","13.1188","0.0006","19.8366","0.0008","80.628","0.003","80.543","0.003","89.488","0.003","2062.68","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C43.19 H26.37 Cl0.37 F15 Ir N6 -","- C43.185 H26.37 Cl0.37 F15 Ir N6 -","- C86.37 H52.74 Cl0.74 F30 Ir2 N12 -","2","1","","Joshua H. Palmer; Michael W. Day; Aaron D. Wilson; Lawrence M. Henling; Zeev Gross; Harry B. Gray","Iridium Corroles","Journal of the American Chemical Society","2008","130","","7786","7787","10.1021/ja801049t","","","0.71073","MoKα","","0.0458","0.033","","","0.0548","0.0561","","","","","","1.818","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4107919","10.5456","0.0005","12.9293","0.0006","21.2776","0.0009","81.591","0.003","76.344","0.003","86.714","0.003","2788","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H24 Br8 Cl6 F15 Ir N6 -","- C46 H24 Br8 Cl6 F15 Ir N6 -","- C92 H48 Br16 Cl12 F30 Ir2 N12 -","2","1","","Joshua H. Palmer; Michael W. Day; Aaron D. Wilson; Lawrence M. Henling; Zeev Gross; Harry B. Gray","Iridium Corroles","Journal of the American Chemical Society","2008","130","","7786","7787","10.1021/ja801049t","","","0.71073","MoKα","","0.0793","0.0412","","","0.0606","0.0634","","","","","","1.534","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4107920","7.9758","0.0003","10.8093","0.0004","17.284","0.0006","94.35","0.002","92.124","0.002","92.617","0.002","1483.03","0.09","98","2","98","2","","","","","","","","8","P -1","-P 1","2","","","","- C21 H51 B Br N P2 Pt Si -","- C21 H51 B Br N P2 Pt Si -","- C42 H102 B2 Br2 N2 P4 Pt2 Si2 -","2","1","","Holger Braunschweig; Thomas Kupfer; Krzysztof Radacki; Achim Schneider; Fabian Seeler; Katharina Uttinger; Hongmei Wu","Synthesis and Reactivity Studies of Iminoboryl Complexes","Journal of the American Chemical Society","2008","130","","7974","7983","10.1021/ja8016889","","","0.71073","MoKα","","0.0183","0.0172","","","0.043","0.044","","","","","","1.039","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107921","9.0559","0.0007","13.525","0.001","19.8772","0.0015","90","","94.388","0.002","90","","2427.4","0.3","193","2","193","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H36 B Br2 N P3 Rh Si -","- C12 H36 B Br2 N P3 Rh Si -","- C48 H144 B4 Br8 N4 P12 Rh4 Si4 -","4","1","","Holger Braunschweig; Thomas Kupfer; Krzysztof Radacki; Achim Schneider; Fabian Seeler; Katharina Uttinger; Hongmei Wu","Synthesis and Reactivity Studies of Iminoboryl Complexes","Journal of the American Chemical Society","2008","130","","7974","7983","10.1021/ja8016889","","","0.71073","MoKα","","0.0448","0.0395","","","0.0869","0.0887","","","","","","1.187","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107922","14.0147","0.0015","21.578","0.002","16.6106","0.0018","90","","97.802","0.006","90","","4976.7","0.9","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C46 H84 B Br Cl2 N2 P2 Pt Si -","- C46 H84 B Br Cl2 N2 P2 Pt Si -","- C184 H336 B4 Br4 Cl8 N8 P8 Pt4 Si4 -","4","1","","Holger Braunschweig; Thomas Kupfer; Krzysztof Radacki; Achim Schneider; Fabian Seeler; Katharina Uttinger; Hongmei Wu","Synthesis and Reactivity Studies of Iminoboryl Complexes","Journal of the American Chemical Society","2008","130","","7974","7983","10.1021/ja8016889","","","0.71073","MoKα","","0.0435","0.0301","","","0.0708","0.0803","","","","","","1.134","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107923","18.3001","0.0012","17.1048","0.0012","19.0262","0.0013","90","","110.753","0.003","90","","5569.2","0.7","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C92 H170 B2 Br2 Cl12 N4 P4 Pt2 -","- C92 H170 B2 Br2 Cl12 N4 P4 Pt2 -","- C184 H340 B4 Br4 Cl24 N8 P8 Pt4 -","2","0.5","","Holger Braunschweig; Thomas Kupfer; Krzysztof Radacki; Achim Schneider; Fabian Seeler; Katharina Uttinger; Hongmei Wu","Synthesis and Reactivity Studies of Iminoboryl Complexes","Journal of the American Chemical Society","2008","130","","7974","7983","10.1021/ja8016889","","","0.71073","MoKα","","0.0649","0.0393","","","0.0929","0.1143","","","","","","1.189","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107924","10.1668","0.0004","10.6685","0.0004","22.9023","0.0008","89.324","0.002","89.453","0.002","83.333","0.002","2467.03","0.16","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C49.87 H87 B Br0.07 N P2 Pt Si -","- C49.8658 H87 B Br0.0671 N P2 Pt Si -","- C99.7316 H174 B2 Br0.1342 N2 P4 Pt2 Si2 -","2","1","","Holger Braunschweig; Thomas Kupfer; Krzysztof Radacki; Achim Schneider; Fabian Seeler; Katharina Uttinger; Hongmei Wu","Synthesis and Reactivity Studies of Iminoboryl Complexes","Journal of the American Chemical Society","2008","130","","7974","7983","10.1021/ja8016889","","","0.71073","MoKα","","0.026","0.0235","","","0.0588","0.0604","","","","","","1.072","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107925","6.6746","0.0005","20.6662","0.0016","22.0533","0.0018","90","","90","","90","","3042","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H30 Br N O3 -","- C37 H30 Br N O3 -","- C148 H120 Br4 N4 O12 -","4","1","","Wenhao Hu; Xinfang Xu; Jing Zhou; Wei-Jun Liu; Haoxi Huang; Juan Hu; Liping Yang; Liu-Zhu Gong","Cooperative Catalysis with Chiral Brønsted Acid-Rh2(OAc)4: Highly Enantioselective Three-Component Reactions of Diazo Compounds with Alcohols and Imines","Journal of the American Chemical Society","2008","130","","7782","7783","10.1021/ja801755z","","","0.71073","MoKα","","0.0799","0.0532","","","0.0962","0.1048","","","","","","0.954","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107926","9.6828","0.0011","9.2447","0.0011","14.8343","0.0018","90","","90.683","0.002","90","","1327.8","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H41 N5 O5 -","- C23 H41 N5 O5 -","- C46 H82 N10 O10 -","2","1","","Felix Freire; John D. Fisk; Aaron J. Peoples; Monika Ivancic; Ilia A. Guzei; Samuel H. Gellman","Diacid Linkers That Promote Parallel β-Sheet Secondary Structure in Water","Journal of the American Chemical Society","2008","130","","7839","7841","10.1021/ja802042c","","","0.71073","MoKα","","0.0644","0.0457","","","0.1162","0.1363","","","","","","1.144","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107927","9.3424","0.0013","29.882","0.004","9.8152","0.0014","90","","91.02","0.002","90","","2739.7","0.7","105","2","105","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H45 N5 O6 -","- C24 H45 N5 O6 -","- C96 H180 N20 O24 -","4","2","","Felix Freire; John D. Fisk; Aaron J. Peoples; Monika Ivancic; Ilia A. Guzei; Samuel H. Gellman","Diacid Linkers That Promote Parallel β-Sheet Secondary Structure in Water","Journal of the American Chemical Society","2008","130","","7839","7841","10.1021/ja802042c","","","0.71073","MoKα","","0.1581","0.1437","","","0.3609","0.3759","","","","","","0.994","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107928","21.498","0.003","21.498","0.003","10.836","0.003","90","","90","","120","","4337.1","1.5","105","2","105","2","","","","","","","","4","P 63","P 6c","173","","","","- C25 H45 N5 O5 -","- C25 H45 N5 O5 -","- C150 H270 N30 O30 -","6","1","","Felix Freire; John D. Fisk; Aaron J. Peoples; Monika Ivancic; Ilia A. Guzei; Samuel H. Gellman","Diacid Linkers That Promote Parallel β-Sheet Secondary Structure in Water","Journal of the American Chemical Society","2008","130","","7839","7841","10.1021/ja802042c","","","0.71073","Mo-Kα","","0.1299","0.1025","","","0.2581","0.2898","","","","","","1.035","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107929","22.321","0.002","10.7863","0.0011","12.3575","0.0013","90","","90","","90","","2975.2","0.5","105","2","105","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C25.5 H48 N5 O6 -","- C25.5 H48 N5 O6 -","- C102 H192 N20 O24 -","4","1","","Felix Freire; John D. Fisk; Aaron J. Peoples; Monika Ivancic; Ilia A. Guzei; Samuel H. Gellman","Diacid Linkers That Promote Parallel β-Sheet Secondary Structure in Water","Journal of the American Chemical Society","2008","130","","7839","7841","10.1021/ja802042c","","","0.71073","Mo-Kα","","0.04","0.0361","","","0.0951","0.0998","","","","","","1.061","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107930","13.2529","0.0019","13.253","","13.995","0.002","90","","90","","90","","2458.1","0.5","193","2","193","2","","","","","","","","5","P 2 2 21","P 2c 2","17","","","","- C22 H32 Co N6 O3 -","- C21.5 H6 Co N6 O3 -","- C86 H24 Co4 N24 O12 -","4","1","","Hye Jin Choi; Mircea Dincă; Jeffrey R. Long","Broadly Hysteretic H2Adsorption in the Microporous Metal-Organic Framework Co(1,4-benzenedipyrazolate)","Journal of the American Chemical Society","2008","130","","7848","7850","10.1021/ja8024092","","","0.7749","MoKα","","0.0904","0.0781","","","0.2116","0.2211","","","","","","1.677","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107931","12.3497","0.001","25.303","0.0019","5.5954","0.0005","90","","90","","90","","1748.5","0.2","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C23 H17 N O3 -","- C23 H17 N O3 -","- C92 H68 N4 O12 -","4","1","","Ji Min Lee; Eun Ju Park; Seung Hwan Cho; Sukbok Chang","Cu-Facilitated C-O Bond Formation Using N-Hydroxyphthalimide: Efficient and Selective Functionalization of Benzyl and Allylic C-H Bonds","Journal of the American Chemical Society","2008","130","","7824","7825","10.1021/ja8031218","","","0.71073","MoKα","","0.0354","0.0283","","","0.0767","0.1017","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107932","14.6044","0.0017","14.9475","0.0017","19.842","0.002","85.636","0.002","88.659","0.002","61.5","0.001","3795.1","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Gd3N@C82.NiOEP.2benzene nonIPR isomer 39663","","","- C130 H56 Gd3 N5 Ni -","- C130 H56 Gd2.99 N5 Ni -","- C260 H112 Gd5.98 N10 Ni2 -","2","1","","Brandon Q. Mercado; Christine M. Beavers; Marilyn M. Olmstead; Manuel N. Chaur; Kenneth Walker; Brian C. Holloway; Luis Echegoyen; Alan L. Balch","Is the Isolated Pentagon Rule Merely a Suggestion for Endohedral Fullerenes? The Structure of a Second Egg-Shaped Endohedral Fullerene-Gd3N@Cs(39663)-C82","Journal of the American Chemical Society","2008","130","","7854","7855","10.1021/ja8032263","","","0.7749","synchrotron","","0.1007","0.0629","","","0.1555","0.1792","","","","","","1.041","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107933","4.1946","0.0006","4.1946","0.0006","19.522","0.004","90","","90","","90","","343.48","0.1","293","2","293","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- Ba2 F2 Fe2 O Se2 -","- Ba2 F2 Fe2 O Se2 -","- Ba4 F4 Fe4 O2 Se4 -","2","0.0625","","Houria Kabbour; Etienne Janod; Benoît Corraze; Michel Danot; Changhoon Lee; Myung-Hwan Whangbo; Laurent Cario","Structure and Magnetic Properties of Oxychalcogenides A~2~F~2~Fe~2~OQ~2 (A = Sr, Ba; Q = S, Se) with Fe2O Square Planar Layers Representing an Antiferromagnetic Checkerboard Spin Lattice","Journal of the American Chemical Society","2008","130","","8261","8270","10.1021/ja711139g","","","0.71073","MoKα","","0.0233","0.0196","","","0.0421","0.0436","","","","","","1.15","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107934","4.04","0.0006","4.04","0.0006","17.998","0.004","90","","90","","90","","293.76","0.09","293","2","293","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- F2 Fe2 O S2 Sr2 -","- F2 Fe2 O S2 Sr2 -","- F4 Fe4 O2 S4 Sr4 -","2","0.0625","","Houria Kabbour; Etienne Janod; Benoît Corraze; Michel Danot; Changhoon Lee; Myung-Hwan Whangbo; Laurent Cario","Structure and Magnetic Properties of Oxychalcogenides A~2~F~2~Fe~2~OQ~2 (A = Sr, Ba; Q = S, Se) with Fe2O Square Planar Layers Representing an Antiferromagnetic Checkerboard Spin Lattice","Journal of the American Chemical Society","2008","130","","8261","8270","10.1021/ja711139g","","","0.71073","MoKα","","0.0186","0.0173","","","0.0401","0.0412","","","","","","1.179","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107935","4.12377","0.0001","4.12377","0.0001","19.0885","0.0005","90","","90","","90","","324.609","0.014","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- Ba2 F2 Fe2 O S2 -","- Ba2 F2 Fe2 O S2 -","- Ba4 F4 Fe4 O2 S4 -","2","0.0625","","Houria Kabbour; Etienne Janod; Benoît Corraze; Michel Danot; Changhoon Lee; Myung-Hwan Whangbo; Laurent Cario","Structure and Magnetic Properties of Oxychalcogenides A2F2Fe2OQ2 (A = Sr, Ba; Q = S, Se) with Fe2O Square Planar Layers Representing an Antiferromagnetic Checkerboard Spin Lattice","Journal of the American Chemical Society","2008","130","","8261","8270","10.1021/ja711139g","powder diffraction","","","X-ray","","","","","","","","","5.8218","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107936","4.09255","0.00007","4.09255","0.00007","18.5801","0.0003","90","","90","","90","","311.197","0.009","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- F2 Fe2 O S2 Sr2 -","- F2 Fe2 O Se2 Sr2 -","- F4 Fe4 O2 Se4 Sr4 -","2","0.0625","","Houria Kabbour; Etienne Janod; Benoît Corraze; Michel Danot; Changhoon Lee; Myung-Hwan Whangbo; Laurent Cario","Structure and Magnetic Properties of Oxychalcogenides A2F2Fe2OQ2 (A = Sr, Ba; Q = S, Se) with Fe2O Square Planar Layers Representing an Antiferromagnetic Checkerboard Spin Lattice","Journal of the American Chemical Society","2008","130","","8261","8270","10.1021/ja711139g","powder diffraction","","","X-ray","","","","","","","","","3.9622","","","","","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107937","10.8032","0.001","12.9035","0.0011","16.2127","0.0014","90","","91.421","0.002","90","","2259.3","0.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6 - Ni(dippe)(3-pentenenitrile)","","- C19 H39 N Ni P2 -","- C19 H39 N Ni P2 -","- C76 H156 N4 Ni4 P8 -","4","1","","Brett D. Swartz; Nicole M. Reinartz; William W. Brennessel; Juventino J. García; William D. Jones","Solvent Effects and Activation Parameters in the Competitive Cleavage of C-CN and C-H Bonds in 2-Methyl-3-Butenenitrile Using [(dippe)NiH]2","Journal of the American Chemical Society","2008","130","","8548","8554","10.1021/ja8000216","","","0.71073","MoKα","","0.0529","0.0403","","","0.0868","0.091","","","","","","1.079","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107938","17.418","0.004","62.197","0.014","14.634","0.003","90","","90","","90","","15854","6","100","0.1","100","0.1","","","","","","","","6","F d d 2","F 2 -2d","43","jonbds05","10, [Ni(dippe)(2-cyanobutenyl)]+ BPh4-","","- C43 H58 B N Ni P2 -","- C43 H58 B N Ni P2 -","- C688 H928 B16 N16 Ni16 P32 -","16","1","","Brett D. Swartz; Nicole M. Reinartz; William W. Brennessel; Juventino J. García; William D. Jones","Solvent Effects and Activation Parameters in the Competitive Cleavage of C-CN and C-H Bonds in 2-Methyl-3-Butenenitrile Using [(dippe)NiH]2","Journal of the American Chemical Society","2008","130","","8548","8554","10.1021/ja8000216","","","0.71073","MoKα","","0.1465","0.0678","","","0.1067","0.1299","","","","","","1.002","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107939","9.672","0.003","11.878","0.004","16.649","0.005","89.894","0.006","80.073","0.006","73.924","0.006","1808.3","1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C52 H30 N4 -","- C52 H30 N4 -","- C104 H60 N8 -","2","1","","Baoxiang Gao; Ming Wang; Yanxiang Cheng; Lixiang Wang; Xiabin Jing; Fosong Wang","Pyrazine-Containing Acene-Type Molecular Ribbons with up to 16 Rectilinearly Arranged Fused Aromatic Rings","Journal of the American Chemical Society","2008","130","","8297","8306","10.1021/ja800311a","","","0.71073","MoKα","","0.2117","0.0654","","","0.0668","0.0941","","","","","","0.876","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107940","4.919","0.003","7.856","0.008","18.784","0.007","90","","91.27","0.04","90","","725.7","0.9","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","2-Acetamido-2-deoxyglucosylchloroacetamide monohydrate","N-(2-Acetamido-2-deoxy-beta-D-glucopyranosyl)chloroacetamide monohydrate","","- C10 H19 Cl N2 O7 -","- C10 H19 Cl N2 O7 -","- C20 H38 Cl2 N4 O14 -","2","1","","Mohamed Mohamed Naseer Ali; Udayanath Aich; Babu Varghese; Anne Imberty","Conformational Preferences of the Aglycon Moiety in Models and Analogs of GlcNAc-Asn Linkage: Crystal Structures and ab Initio Quantum Chemical Calculations of N-(β-d-Glycopyranosyl)haloacetamides","Journal of the American Chemical Society","2008","130","","8317","8325","10.1021/ja800335m","","","0.71073","MoKα","","0.0803","0.0512","","","0.1377","0.1842","","","","","","1.129","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107941","6.3408","0.0019","8.5671","0.0008","19.352","0.003","90","","90","","90","","1051.2","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Mannosylchloroacetamide","N-(Beta-D-mannopyranosyl)chloroacetamide","","- C8 H14 Cl N O6 -","- C8 H14 Cl N O6 -","- C32 H56 Cl4 N4 O24 -","4","1","","Mohamed Mohamed Naseer Ali; Udayanath Aich; Babu Varghese; Anne Imberty","Conformational Preferences of the Aglycon Moiety in Models and Analogs of GlcNAc-Asn Linkage: Crystal Structures and ab Initio Quantum Chemical Calculations of N-(β-d-Glycopyranosyl)haloacetamides","Journal of the American Chemical Society","2008","130","","8317","8325","10.1021/ja800335m","","","0.71073","MoKα","","0.0458","0.0398","","","0.1002","0.1078","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107942","15.9014","0.001","15.9014","0.001","4.0161","0.0005","90","","90","","90","","1015.49","0.16","100","2","100","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 S2 Se2 -","- C7 H5 Cl N3 S2 Se2 -","- C28 H20 Cl4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Robert W. Reed; Daniel J. T. Myles; Paul A. Dube; Richard T. Oakley","Enhanced Conductivity and Magnetic Ordering in Isostructural Heavy Atom Radicals","Journal of the American Chemical Society","2008","130","","8414","8425","10.1021/ja801070d","","","0.71073","MoKα","","0.0426","0.0371","","","0.0717","0.0732","","","","","","1.053","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107943","16.0565","0.0004","16.0565","0.0004","4.1599","0.0002","90","","90","","90","","1072.47","0.06","295","2","295","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 S2 Se2 -","- C7 H5 Cl N3 S2 Se2 -","- C28 H20 Cl4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Robert W. Reed; Daniel J. T. Myles; Paul A. Dube; Richard T. Oakley","Enhanced Conductivity and Magnetic Ordering in Isostructural Heavy Atom Radicals","Journal of the American Chemical Society","2008","130","","8414","8425","10.1021/ja801070d","","","0.71073","MoKα","","0.0445","0.0402","","","0.0822","0.0838","","","","","","1.131","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107944","16.0331","0.0006","16.0331","0.0006","4.092","0.0003","90","","90","","90","","1051.89","0.1","100","2","100","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 S2 Se2 -","- C7 H5 Cl N3 S2 Se2 -","- C28 H20 Cl4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Robert W. Reed; Daniel J. T. Myles; Paul A. Dube; Richard T. Oakley","Enhanced Conductivity and Magnetic Ordering in Isostructural Heavy Atom Radicals","Journal of the American Chemical Society","2008","130","","8414","8425","10.1021/ja801070d","","","","MoKα","","0.0201","0.0192","","","0.0468","0.0471","","","","","","0.981","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107945","16.1801","0.0012","16.1801","0.0012","4.1264","0.0006","90","","90","","90","","1080.27","0.19","100","2","100","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Robert W. Reed; Daniel J. T. Myles; Paul A. Dube; Richard T. Oakley","Enhanced Conductivity and Magnetic Ordering in Isostructural Heavy Atom Radicals","Journal of the American Chemical Society","2008","130","","8414","8425","10.1021/ja801070d","","","0.71073","MoKα","","0.0411","0.0376","","","0.08","0.0813","","","","","","1.164","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107946","16.2708","0.0005","16.2708","0.0005","4.172","0.0003","90","","90","","90","","1104.49","0.09","296","2","296","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Robert W. Reed; Daniel J. T. Myles; Paul A. Dube; Richard T. Oakley","Enhanced Conductivity and Magnetic Ordering in Isostructural Heavy Atom Radicals","Journal of the American Chemical Society","2008","130","","8414","8425","10.1021/ja801070d","","","0.71073","MoKα","","0.0396","0.0374","","","0.0635","0.064","","","","","","1.211","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107947","15.7927","0.0003","15.7927","0.0003","4.031","0.0002","90","","90","","90","","1005.37","0.06","100","2","100","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Cl N3 S4 -","- C7 H5 Cl N3 S4 -","- C28 H20 Cl4 N12 S16 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Robert W. Reed; Daniel J. T. Myles; Paul A. Dube; Richard T. Oakley","Enhanced Conductivity and Magnetic Ordering in Isostructural Heavy Atom Radicals","Journal of the American Chemical Society","2008","130","","8414","8425","10.1021/ja801070d","","","0.71073","MoKα","","0.0184","0.0177","","","0.0387","0.0391","","","","","","1.114","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107948","13.5516","0.0005","11.7085","0.0004","16.9923","0.0006","90","","90","","90","","2696.15","0.17","180","","180","","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C19 H18 Cl4 F3 N4 O5 Rh S -","- C19 H18 Cl4 F3 N4 O5 Rh S -","- C76 H72 Cl16 F12 N16 O20 Rh4 S4 -","4","0.5","","Yves Canac; Christine Lepetit; Mohammed Abdalilah; Carine Duhayon; Remi Chauvin","Diaminocarbene and Phosphonium Ylide Ligands: A Systematic Comparison of their Donor Character","Journal of the American Chemical Society","2008","130","","8406","8413","10.1021/ja801159v","","","0.71073","MoKα","","0.0932","0.0285","","0.064","0.0302","0.0302","","","","","","1.1211","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107949","10.9475","0.0009","15.1007","0.001","16.0585","0.0013","90","","91.497","0.01","90","","2653.8","0.4","180","","180","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 F3 N2 O5 P Rh S -","- C26 H21 F3 N2 O5 P Rh S -","- C104 H84 F12 N8 O20 P4 Rh4 S4 -","4","1","","Yves Canac; Christine Lepetit; Mohammed Abdalilah; Carine Duhayon; Remi Chauvin","Diaminocarbene and Phosphonium Ylide Ligands: A Systematic Comparison of their Donor Character","Journal of the American Chemical Society","2008","130","","8406","8413","10.1021/ja801159v","","","0.71073","MoKα","","0.1002","0.0688","","0.0912","0.0823","0.0823","","","","","","1.1161","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107950","9.8451","0.0008","11.9474","0.0012","16.0624","0.0015","82.894","0.012","84.034","0.011","78.412","0.011","1830.5","0.3","180","","180","","","","","","","","","9","P -1","-P 1","2","","","","- C32 H34 Cl F3 N2 O3 P Rh S -","- C32 H34 Cl F3 N2 O3 P Rh S -","- C64 H68 Cl2 F6 N4 O6 P2 Rh2 S2 -","2","1","","Yves Canac; Christine Lepetit; Mohammed Abdalilah; Carine Duhayon; Remi Chauvin","Diaminocarbene and Phosphonium Ylide Ligands: A Systematic Comparison of their Donor Character","Journal of the American Chemical Society","2008","130","","8406","8413","10.1021/ja801159v","","","0.71073","MoKα","","0.0732","0.0417","","0.0653","0.0462","0.0462","","","","","","1.0842","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107951","10.3396","0.0013","12.9085","0.0016","11.7145","0.0014","90","","90","","90","","1563.5","0.3","163","2","163","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C18 H23 Y -","- C18 H23 Y -","- C72 H92 Y4 -","4","0.5","","William J. Evans; Benjamin M. Schmiege; Sara E. Lorenz; Kevin A. Miller; Timothy M. Champagne; Joseph W. Ziller; Antonio G. DiPasquale; Arnold L. Rheingold","Reductive Reactivity of the Organolanthanide Hydrides, [(C5Me5)2LnH]x, Leads to an sa-Allyl Cyclopentadienyl (η5-C5Me4CH2-C5Me4CH2-η3)2- and Trianionic Cyclooctatetraenyl (C8H7)3- Ligands","Journal of the American Chemical Society","2008","130","","8555","8563","10.1021/ja8011726","","","0.71073","MoKα","","0.0378","0.0298","","","0.0694","0.073","","","","","","1.085","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107952","9.2799","0.001","11.1103","0.0012","12.6823","0.0014","83.277","0.002","78.81","0.002","83.363","0.002","1268.1","0.2","163","2","163","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H43 Y -","- C30 H43 Y -","- C60 H86 Y2 -","2","1","","William J. Evans; Benjamin M. Schmiege; Sara E. Lorenz; Kevin A. Miller; Timothy M. Champagne; Joseph W. Ziller; Antonio G. DiPasquale; Arnold L. Rheingold","Reductive Reactivity of the Organolanthanide Hydrides, [(C5Me5)2LnH]x, Leads to an sa-Allyl Cyclopentadienyl (η5-C5Me4CH2-C5Me4CH2-η3)2- and Trianionic Cyclooctatetraenyl (C8H7)3- Ligands","Journal of the American Chemical Society","2008","130","","8555","8563","10.1021/ja8011726","","","0.71073","MoKα","","0.0304","0.0256","","","0.0635","0.0656","","","","","","1.058","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107953","8.42","0.003","16.807","0.005","24.239","0.008","90","","93.001","0.005","90","","3425","2","208","2","208","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C38 H52 Y2 -","- C38 H52 Y2 -","- C152 H208 Y8 -","4","1","","William J. Evans; Benjamin M. Schmiege; Sara E. Lorenz; Kevin A. Miller; Timothy M. Champagne; Joseph W. Ziller; Antonio G. DiPasquale; Arnold L. Rheingold","Reductive Reactivity of the Organolanthanide Hydrides, [(C5Me5)2LnH]x, Leads to an sa-Allyl Cyclopentadienyl (η5-C5Me4CH2-C5Me4CH2-η3)2- and Trianionic Cyclooctatetraenyl (C8H7)3- Ligands","Journal of the American Chemical Society","2008","130","","8555","8563","10.1021/ja8011726","","","0.71069","MoKα","","0.1052","0.0524","","","0.1109","0.1285","","","","","","1.031","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107954","10.392","0.001","10.6563","0.0011","14.8522","0.0015","110.948","0.001","98.645","0.002","95.886","0.002","1496.7","0.3","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H86 La2 S2 -","- C66 H86 La2 S2 -","- C66 H86 La2 S2 -","1","0.5","","William J. Evans; Benjamin M. Schmiege; Sara E. Lorenz; Kevin A. Miller; Timothy M. Champagne; Joseph W. Ziller; Antonio G. DiPasquale; Arnold L. Rheingold","Reductive Reactivity of the Organolanthanide Hydrides, [(C5Me5)2LnH]x, Leads to an sa-Allyl Cyclopentadienyl (η5-C5Me4CH2-C5Me4CH2-η3)2- and Trianionic Cyclooctatetraenyl (C8H7)3- Ligands","Journal of the American Chemical Society","2008","130","","8555","8563","10.1021/ja8011726","","","0.71073","MoKα","","0.027","0.0245","","","0.0627","0.0648","","","","","","1.055","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107955","10.3399","0.0011","10.4821","0.0011","14.6925","0.0016","69.574","0.002","76.507","0.002","83.37","0.002","1450.1","0.3","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H86 S2 Y2 -","- C66 H86 S2 Y2 -","- C66 H86 S2 Y2 -","1","0.5","","William J. Evans; Benjamin M. Schmiege; Sara E. Lorenz; Kevin A. Miller; Timothy M. Champagne; Joseph W. Ziller; Antonio G. DiPasquale; Arnold L. Rheingold","Reductive Reactivity of the Organolanthanide Hydrides, [(C5Me5)2LnH]x, Leads to an sa-Allyl Cyclopentadienyl (η5-C5Me4CH2-C5Me4CH2-η3)2- and Trianionic Cyclooctatetraenyl (C8H7)3- Ligands","Journal of the American Chemical Society","2008","130","","8555","8563","10.1021/ja8011726","","","0.71073","MoKα","","0.0459","0.039","","","0.0949","0.0982","","","","","","1.057","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107956","8.8769","0.0003","12.8191","0.0004","29.5359","0.0009","90","","90","","90","","3361","0.19","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","CB2.5CF3COOH","CB2.5CF3COOH","","- C20 H17 F15 N8 O14 -","- C20.002 H17 F15.003 N8 O14.002 -","- C80.008 H68 F60.012 N32 O56.008 -","4","1","","Wei-Hao Huang; Peter Y. Zavalij; Lyle Isaacs","Cucurbit[n]uril Formation Proceeds by Step-Growth Cyclo-oligomerization","Journal of the American Chemical Society","2008","130","","8446","8454","10.1021/ja8013693","","","0.71073","MoKα","","0.0458","0.0384","","","0.078","0.0816","","","","","","1","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107957","18.6306","0.0008","18.6306","0.0008","15.2173","0.0012","90","","90","","90","","5281.9","0.5","220","2","220","2","","","","","","","","6","P 42/m","-P 4c","84","Na*2CB4*H2O*7TFA","Na*2CB4*H2O*7TFA","","- C58 H56 F21 N32 Na O31 -","- C52 H48 F12 N32 Na O25 -","- C104 H96 F24 N64 Na2 O50 -","2","0.25","","Wei-Hao Huang; Peter Y. Zavalij; Lyle Isaacs","Cucurbit[n]uril Formation Proceeds by Step-Growth Cyclo-oligomerization","Journal of the American Chemical Society","2008","130","","8446","8454","10.1021/ja8013693","","","0.71073","MoKα","","0.0898","0.0779","","","0.1813","0.1867","","","","","","1.001","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107958","11.662","0.004","33.042","0.011","14.952","0.005","90","","90","","90","","5762","3","220","2","220","2","","","","","","","","5","P n m a","-P 2ac 2n","62","[CB5<0.85TFA]*4.6TFA*4H2O","Semi-circle CB5 trifluoroacetic acid hydrate, CB5*5.45TFA*4H2O","","- C38.9 H38 F16.35 N20 O24.9 -","- C29.7 H30 F2.55 N20 O11.7 -","- C118.8 H120 F10.2 N80 O46.8 -","4","0.5","","Wei-Hao Huang; Peter Y. Zavalij; Lyle Isaacs","Cucurbit[n]uril Formation Proceeds by Step-Growth Cyclo-oligomerization","Journal of the American Chemical Society","2008","130","","8446","8454","10.1021/ja8013693","","","0.71073","MoKα","","0.1051","0.0854","","","0.1724","0.1791","","","","","","1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107959","24.119","0.002","12.8676","0.0013","31.795","0.003","90","","90","","90","","9867.7","1.6","220","2","220","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","CB6 hydrate","CB6 hydrate","","- C34 H60 Cl2 N24 O23 -","- C34 H36 N24 O12 -","- C272 H288 N192 O96 -","8","1","","Wei-Hao Huang; Peter Y. Zavalij; Lyle Isaacs","Cucurbit[n]uril Formation Proceeds by Step-Growth Cyclo-oligomerization","Journal of the American Chemical Society","2008","130","","8446","8454","10.1021/ja8013693","","","0.71073","MoKα","","0.0926","0.0565","","","0.1146","0.125","","","","","","1","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107960","9.9594","0.0007","12.2807","0.0008","31.266","0.002","90","","90","","90","","3824.1","0.4","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H56 Cl4 O3 Sn -","- C37 H56 Cl4 O3 Sn -","- C148 H224 Cl16 O12 Sn4 -","4","1","","Vivek Rauniyar; Huimin Zhai; Dennis G. Hall","Catalytic Enantioselective Allyl- and Crotylboration of Aldehydes Using Chiral Diol.SnCl4 Complexes. Optimization, Substrate Scope and Mechanistic Investigations","Journal of the American Chemical Society","2008","130","","8481","8490","10.1021/ja8016076","","","0.71073","MoKα","","0.035","0.0316","","","0.081","0.0827","","","","","","1.092","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107961","10.2147","0.0009","13.9642","0.0012","15.8484","0.0014","90","","90","","90","","2260.6","0.3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H21 N3 O2 S -","- C26 H21 N3 O2 S -","- C104 H84 N12 O8 S4 -","4","1","","Chao Wang; Jon A. Tunge","Asymmetric Cycloadditions of Palladium-Polarized Aza-o-xylylenes","Journal of the American Chemical Society","2008","130","","8118","8119","10.1021/ja801742h","","","0.71073","MoKα","","0.0602","0.0528","","","0.1078","0.1109","","","","","","1.043","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107962","25.7228","0.0006","25.7228","0.0006","25.7228","0.0006","90","","90","","90","","17019.8","0.7","200","2","200","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","IRMOF-3-AM6","","","- C42.9 H47.4 N3 O15.7 Zn4 -","- C24 O13 Zn4 -","- C192 O104 Zn32 -","8","0.0416667","","Kristine K. Tanabe; Zhenqiang Wang; Seth M. Cohen","Systematic Functionalization of a Metal-Organic Framework via a Postsynthetic Modification Approach","Journal of the American Chemical Society","2008","130","","8508","8517","10.1021/ja801848j","","","0.71073","MoKα","","0.0395","0.0349","","","0.1047","0.1081","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107963","25.7691","0.0017","25.7691","0.0017","25.7691","0.0017","90","","90","","90","","17112","2","200","2","200","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","IRMOF-3-AM13","","","- C40.8 H46.2 N3 O14.2 Zn4 -","- C24 O13 Zn4 -","- C192 O104 Zn32 -","8","0.0416667","","Kristine K. Tanabe; Zhenqiang Wang; Seth M. Cohen","Systematic Functionalization of a Metal-Organic Framework via a Postsynthetic Modification Approach","Journal of the American Chemical Society","2008","130","","8508","8517","10.1021/ja801848j","","","0.71073","MoKα","","0.0407","0.0368","","","0.114","0.1207","","","","","","1.165","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107964","25.7786","0.0007","25.7786","0.0007","25.7786","0.0007","90","","90","","90","","17130.8","0.8","200","2","200","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","IRMOF-3-AM19","","","- C27.9 H22.41 N3 O13.21 Zn4 -","- C24 O13 Zn4 -","- C192 O104 Zn32 -","8","0.0416667","","Kristine K. Tanabe; Zhenqiang Wang; Seth M. Cohen","Systematic Functionalization of a Metal-Organic Framework via a Postsynthetic Modification Approach","Journal of the American Chemical Society","2008","130","","8508","8517","10.1021/ja801848j","","","0.71073","MoKα","","0.0405","0.0351","","","0.1035","0.1078","","","","","","1.071","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107965","25.7386","0.0006","25.7386","0.0006","25.7386","0.0006","90","","90","","90","","17051.2","0.7","200","2","200","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","IRMOF-3-AM4","","","- C39 H39 N3 O16 Zn4 -","- C24 O13 Zn4 -","- C192 O104 Zn32 -","8","0.0416667","","Kristine K. Tanabe; Zhenqiang Wang; Seth M. Cohen","Systematic Functionalization of a Metal-Organic Framework via a Postsynthetic Modification Approach","Journal of the American Chemical Society","2008","130","","8508","8517","10.1021/ja801848j","","","0.71073","MoKα","","0.0387","0.0304","","","0.0814","0.0849","","","","","","0.918","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107966","10.889","0.0019","16.683","0.002","19.004","0.003","90","","98.215","0.003","90","","3416.9","0.9","93.15","","93","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H29 Cl6 O8 P Pd S -","- C28 H29 Cl6 O8 P Pd S -","- C112 H116 Cl24 O32 P4 Pd4 S4 -","4","1","","Akifumi Nakamura; Kagehiro Munakata; Takuya Kochi; Kyoko Nozaki","Regiocontrolled Copolymerization of Methyl Acrylate with Carbon Monoxide","Journal of the American Chemical Society","2008","130","","8128","8129","10.1021/ja802161n","","","0.71075","MoKα","","0.1028","0.058","","","0.0932","0.1125","","","","","","1.112","","","","has coordinates,has disorder","178825","2020-10-21","18:00:00",""
"4107967","9.3505","0.0003","16.1767","0.0006","19.9603","0.0007","90","","90","","90","","3019.2","0.18","140","2","140","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C32 H40 Li2 N6 -","- C32 H40 Li2 N6 -","- C128 H160 Li8 N24 -","4","0.5","","Zsolt Csok; Oleg Vechorkin; Seth B. Harkins; Rosario Scopelliti; Xile Hu","Nickel Complexes of a Pincer NN2 Ligand: Multiple Carbon-Chloride Activation of CH2Cl2 and CHCl3 Leads to Selective Carbon-Carbon Bond Formation","Journal of the American Chemical Society","2008","130","","8156","8157","10.1021/ja8025938","","","0.71073","MoKα","","0.0713","0.0476","","","0.1062","0.1251","","","","","","1.128","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107968","31.1523","0.0006","9.2463","0.0002","11.0586","0.0002","90","","100.598","0.002","90","","3131.02","0.11","140","2","140","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C16 H20 Cl N3 Ni -","- C16 H20 Cl N3 Ni -","- C128 H160 Cl8 N24 Ni8 -","8","2","","Zsolt Csok; Oleg Vechorkin; Seth B. Harkins; Rosario Scopelliti; Xile Hu","Nickel Complexes of a Pincer NN2 Ligand: Multiple Carbon-Chloride Activation of CH2Cl2 and CHCl3 Leads to Selective Carbon-Carbon Bond Formation","Journal of the American Chemical Society","2008","130","","8156","8157","10.1021/ja8025938","","","0.71073","MoKα","","0.0269","0.0223","","","0.0541","0.0578","","","","","","1.065","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107969","8.6148","0.0003","14.4586","0.0005","13.8551","0.0004","90","","104.929","0.004","90","","1667.51","0.1","140","2","140","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 N3 Ni -","- C18 H25 N3 Ni -","- C72 H100 N12 Ni4 -","4","1","","Zsolt Csok; Oleg Vechorkin; Seth B. Harkins; Rosario Scopelliti; Xile Hu","Nickel Complexes of a Pincer NN2 Ligand: Multiple Carbon-Chloride Activation of CH2Cl2 and CHCl3 Leads to Selective Carbon-Carbon Bond Formation","Journal of the American Chemical Society","2008","130","","8156","8157","10.1021/ja8025938","","","0.71073","MoKα","","0.0546","0.0345","","","0.0739","0.083","","","","","","1.045","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107970","13.52","0.013","7.298","0.003","20.276","0.013","90","","106.74","0.06","90","","1916","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H25 N3 Ni -","- C22 H25 N3 Ni -","- C88 H100 N12 Ni4 -","4","1","","Zsolt Csok; Oleg Vechorkin; Seth B. Harkins; Rosario Scopelliti; Xile Hu","Nickel Complexes of a Pincer NN2 Ligand: Multiple Carbon-Chloride Activation of CH2Cl2 and CHCl3 Leads to Selective Carbon-Carbon Bond Formation","Journal of the American Chemical Society","2008","130","","8156","8157","10.1021/ja8025938","","","0.71073","MoKα","","0.1861","0.1586","","","0.3969","0.4088","","","","","","1.201","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107971","9.5968","0.0003","17.1226","0.0004","10.9594","0.0003","90","","112.874","0.004","90","","1659.26","0.09","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 I N3 Ni -","- C16 H20 I N3 Ni -","- C64 H80 I4 N12 Ni4 -","4","1","","Zsolt Csok; Oleg Vechorkin; Seth B. Harkins; Rosario Scopelliti; Xile Hu","Nickel Complexes of a Pincer NN2 Ligand: Multiple Carbon-Chloride Activation of CH2Cl2 and CHCl3 Leads to Selective Carbon-Carbon Bond Formation","Journal of the American Chemical Society","2008","130","","8156","8157","10.1021/ja8025938","","","0.71073","MoKα","","0.0306","0.0243","","","0.0578","0.0624","","","","","","1.069","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107972","19.2325","0.0004","9.97896","0.00018","31.6956","0.0006","90","","106.072","0.0007","90","","5845.3","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H23 N O2 -","- C26 H23 N O2 -","- C312 H276 N12 O24 -","12","6","","Yuki Nishioka; Takumi Yamaguchi; Masaki Kawano; Makoto Fujita","Asymmetric [2 + 2] Olefin Cross Photoaddition in a Self-Assembled Host with Remote Chiral Auxiliaries","Journal of the American Chemical Society","2008","130","","8160","8161","10.1021/ja802818t","","","1.54186","CuKα","","0.0569","0.0384","","","0.0828","0.0998","","","","","","1.064","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107973","4.229","0.0008","14.112","0.003","23.312","0.005","90","","90","","90","","1391.3","0.5","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H6 F3 I2 N -","- C13 H6 F3 I2 N -","- C52 H24 F12 I8 N4 -","4","1","","Tanya Shirman; Dalia Freeman; Yael Diskin Posner; Isai Feldman; Antonio Facchetti; Milko E. van der Boom","Assembly of Crystalline Halogen-Bonded Materials by Physical Vapor Deposition","Journal of the American Chemical Society","2008","130","","8162","8163","10.1021/ja8029784","","","0.71073","MoKα","","0.0382","0.0294","","","0.0588","0.0613","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107974","12.3527","0.0005","15.9319","0.0008","9.9546","0.0005","90","","90","","90","","1959.09","0.16","100","","100","","","","","","","","pentane","5","P n m a","-P 2ac 2n","62","","","","- C13 H35 Fe Li3 O2 -","- C13 H35 Fe Li3 O2 -","- C52 H140 Fe4 Li12 O8 -","4","0.5","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.0835","0.0497","","","0.1004","0.1138","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107975","9.7659","0.0003","9.9967","0.0002","18.5066","0.0005","104.658","0.002","94.97","0.001","98.647","0.001","1713.32","0.08","100","","100","","","","","","","","diethylether","5","P -1","-P 1","2","","catena(tetraphenyliron(ii)-bis(diethylether)lithium-1,4-dioxane-lithium)","","- C36 H48 Fe Li2 O4 -","- C36 H48 Fe Li2 O4 -","- C72 H96 Fe2 Li4 O8 -","2","1","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.1273","0.0792","","","0.1553","0.1788","","","","","","1.046","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107976","12.5561","0.0005","7.3323","0.0003","14.7157","0.0006","90","","108.352","0.001","90","","1285.9","0.09","100","","100","","","","","","","","pentane","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H23 Fe -","- C14 H23 Fe -","- C56 H92 Fe4 -","4","1","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.0419","0.0297","","","0.0685","0.0731","","","","","","1.002","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107977","15.4528","0.0002","7.3077","0.0001","11.5264","0.0002","90","","103.277","0.001","90","","1266.82","0.03","100","","100","","","","","","","","diethylether","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 Fe -","- C15 H22 Fe -","- C60 H88 Fe4 -","4","1","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.0299","0.0253","","","0.0647","0.0675","","","","","","0.994","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107978","27.265","0.006","8.1454","0.0016","16.02","0.003","90","","90","","90","","3557.8","1.2","100","","100","","","","","","","","see paper","4","P n a 21","P 2c -2n","33","","","","- C17 H28 Fe P2 -","- C17 H28 Fe P2 -","- C136 H224 Fe8 P16 -","8","2","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.0612","0.0533","","","0.1521","0.1594","","","","","","1.053","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107979","6.7149","0.0006","11.2061","0.0008","8.4971","0.0008","90","","100.748","0.003","90","","628.17","0.09","100","","100","","","","","","","","Ether","4","P 1 21/m 1","-P 2yb","11","","","","- C13 H20 Cl Fe -","- C13 H20 Cl Fe -","- C26 H40 Cl2 Fe2 -","2","0.5","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.0543","0.0399","","","0.088","0.0938","","","","","","1.043","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107980","13.6935","0.0015","28.256","0.003","13.6923","0.0011","90","","90.412","0.007","90","","5297.7","0.9","100","","100","","","","","","","","pentane","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H23 Fe -","- C14 H22.5 Fe -","- C224 H360 Fe16 -","16","4","","Alois Fürstner; Rubén Martin; Helga Krause; Günter Seidel; Richard Goddard; Christian W. Lehmann","Preparation, Structure, and Reactivity of Nonstabilized Organoiron Compounds. Implications for Iron-Catalyzed Cross Coupling Reactions","Journal of the American Chemical Society","2008","130","","8773","8787","10.1021/ja801466t","","","0.71073","MoKα","","0.1818","0.0899","","","0.1797","0.2241","","","","","","1.021","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4107981","9.6421","0.0004","10.2603","0.0004","12.2844","0.0005","75.43","0.003","75.3","0.003","89.954","0.003","1135.14","0.08","90","2","90","2","","","","","","","","6","P -1","-P 1","2","[Ru(Me~2~bpb)(NO)(OH)]^.^DMSO","","","- C22 H23 N5 O5 Ru S -","- C22 H23 N5 O5 Ru S -","- C44 H46 N10 O10 Ru2 S2 -","2","1","","Michael J. Rose; Nicole L. Fry; Rebecca Marlow; Lindsay Hinck; Pradip K. Mascharak","Sensitization of Ruthenium Nitrosyls to Visible Light via Direct Coordination of the Dye Resorufin: Trackable NO Donors for Light-Triggered NO Delivery to Cellular Targets","Journal of the American Chemical Society","2008","130","","8834","8846","10.1021/ja801823f","","","0.71073","MoKα","","0.0213","0.0199","","","0.0522","0.0532","","","","","","1.054","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107982","10.0845","0.0005","10.7797","0.0006","15.0195","0.0008","76.057","0.001","71.396","0.001","69.137","0.001","1430.94","0.13","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N6 O7 Ru -","- C32 H24 N6 O7 Ru -","- C64 H48 N12 O14 Ru2 -","2","1","","Michael J. Rose; Nicole L. Fry; Rebecca Marlow; Lindsay Hinck; Pradip K. Mascharak","Sensitization of Ruthenium Nitrosyls to Visible Light via Direct Coordination of the Dye Resorufin: Trackable NO Donors for Light-Triggered NO Delivery to Cellular Targets","Journal of the American Chemical Society","2008","130","","8834","8846","10.1021/ja801823f","","","0.71073","MoKα","","0.0499","0.0348","","","0.0775","0.0839","","","","","","0.954","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107983","12.3639","0.0014","17.278","0.002","18.019","0.002","90","","113.317","0.001","90","","3534.9","0.7","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H27 Cl3 N6 O6 Ru -","- C41 H27 Cl3 N6 O6 Ru -","- C164 H108 Cl12 N24 O24 Ru4 -","4","1","","Michael J. Rose; Nicole L. Fry; Rebecca Marlow; Lindsay Hinck; Pradip K. Mascharak","Sensitization of Ruthenium Nitrosyls to Visible Light via Direct Coordination of the Dye Resorufin: Trackable NO Donors for Light-Triggered NO Delivery to Cellular Targets","Journal of the American Chemical Society","2008","130","","8834","8846","10.1021/ja801823f","","","0.71073","MoKα","","0.1072","0.0874","","","0.2631","0.2811","","","","","","1.035","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107984","12.149","0.002","16.232","0.003","17.971","0.004","90","","108.15","0.03","90","","3367.6","1.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H26 N6 O8 Ru -","- C40 H26 N6 O8 Ru -","- C160 H104 N24 O32 Ru4 -","4","1","","Michael J. Rose; Nicole L. Fry; Rebecca Marlow; Lindsay Hinck; Pradip K. Mascharak","Sensitization of Ruthenium Nitrosyls to Visible Light via Direct Coordination of the Dye Resorufin: Trackable NO Donors for Light-Triggered NO Delivery to Cellular Targets","Journal of the American Chemical Society","2008","130","","8834","8846","10.1021/ja801823f","","","0.7749","synchrotron","","0.0442","0.0355","","","0.09","0.0955","","","","","","1.021","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107985","12.7984","0.0006","10.5976","0.0004","18.0009","0.0007","90","","97.784","0.0014","90","","2419.01","0.17","296.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 B2 F8 N3 Pd3 -","- C20 H23 B2 F8 N3 Pd3 -","- C80 H92 B8 F32 N12 Pd12 -","4","1","","Tetsuro Murahashi; Yasuhiro Hashimoto; Koji Chiyoda; Mayu Fujimoto; Tomohito Uemura; Ryou Inoue; Sensuke Ogoshi; Hideo Kurosawa","Reductive Coupling of Metal Triangles in Sandwich Complexes","Journal of the American Chemical Society","2008","130","","8586","8587","10.1021/ja802624p","","","0.71075","MoKα","","","0.0374","","","","0.0436","","","","","","4.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107986","7.2569","0.0003","21.5621","0.0008","22.2397","0.0007","90","","95.791","0.001","90","","3462.2","0.2","123.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H41 B2 F8 N3 Pd3 -","- C28 H41 B2 F8 N3 Pd3 -","- C112 H164 B8 F32 N12 Pd12 -","4","1","","Tetsuro Murahashi; Yasuhiro Hashimoto; Koji Chiyoda; Mayu Fujimoto; Tomohito Uemura; Ryou Inoue; Sensuke Ogoshi; Hideo Kurosawa","Reductive Coupling of Metal Triangles in Sandwich Complexes","Journal of the American Chemical Society","2008","130","","8586","8587","10.1021/ja802624p","","","0.7107","MoKα","","","0.051","","","","0.0584","","","","","","0.726","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107987","11.4203","0.0004","13.8401","0.0006","14.353","0.0006","83.787","0.0012","77.022","0.0013","71.287","0.0014","2092.19","0.15","123.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H43 B2 F8 N5 Pd6 -","- C38 H43 B2 F8 N5 Pd6 -","- C76 H86 B4 F16 N10 Pd12 -","2","1","","Tetsuro Murahashi; Yasuhiro Hashimoto; Koji Chiyoda; Mayu Fujimoto; Tomohito Uemura; Ryou Inoue; Sensuke Ogoshi; Hideo Kurosawa","Reductive Coupling of Metal Triangles in Sandwich Complexes","Journal of the American Chemical Society","2008","130","","8586","8587","10.1021/ja802624p","","","0.71075","MoKα","","","0.072","","","","0.0941","","","","","","10.799","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107988","22.759","0.006","18.556","0.005","11.696","0.003","90","","116.826","0.004","90","","4408","2","123.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H47 B2 F8 N5 Pd6 -","- C38 H44 B2 F8 N5 Pd6 -","- C152 H176 B8 F32 N20 Pd24 -","4","0.5","","Tetsuro Murahashi; Yasuhiro Hashimoto; Koji Chiyoda; Mayu Fujimoto; Tomohito Uemura; Ryou Inoue; Sensuke Ogoshi; Hideo Kurosawa","Reductive Coupling of Metal Triangles in Sandwich Complexes","Journal of the American Chemical Society","2008","130","","8586","8587","10.1021/ja802624p","","","0.7107","MoKα","","","0.0675","","","","0.095","","","","","","2.237","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4107989","9.968","0.0002","14.2904","0.0003","16.9202","0.0003","90","","90","","90","","2410.23","0.08","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H30 N O2 P -","- C29 H30 N O2 P -","- C116 H120 N4 O8 P4 -","4","1","","Haifeng Du; Baoguo Zhao; Yian Shi","Catalytic Asymmetric Allylic and Homoallylic Diamination of Terminal Olefins via Formal C-H Activation","Journal of the American Chemical Society","2008","130","","8590","8591","10.1021/ja8027394","","","0.71073","MoKα","","0.047","0.0389","","","0.0957","0.1047","","","","","","0.65","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107990","9.6965","0.0003","15.3134","0.0004","17.21","0.0005","90","","90","","90","","2555.45","0.13","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H38 N O2 P -","- C29 H38 N O2 P -","- C116 H152 N4 O8 P4 -","4","1","","Haifeng Du; Baoguo Zhao; Yian Shi","Catalytic Asymmetric Allylic and Homoallylic Diamination of Terminal Olefins via Formal C-H Activation","Journal of the American Chemical Society","2008","130","","8590","8591","10.1021/ja8027394","","","0.71073","MoKα","","0.0627","0.044","","","0.1203","0.1407","","","","","","0.702","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107991","7.4727","0.0003","12.8011","0.0005","17.0678","0.0006","90","","90","","90","","1632.68","0.11","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H28 N2 O2 -","- C15 H28 N2 O2 -","- C60 H112 N8 O8 -","4","1","","Haifeng Du; Baoguo Zhao; Yian Shi","Catalytic Asymmetric Allylic and Homoallylic Diamination of Terminal Olefins via Formal C-H Activation","Journal of the American Chemical Society","2008","130","","8590","8591","10.1021/ja8027394","","","0.71073","MoKα","","0.0728","0.0517","","","0.1293","0.1432","","","","","","1.058","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107992","11.17","0.004","8.528","0.003","16.418","0.006","90","","94.423","0.007","90","","1559.3","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H27 Cu N2 O -","- C13 H27 Cu N2 O -","- C52 H108 Cu4 N8 O4 -","4","1","","Galyna G. Dubinina; Hideki Furutachi; David A. Vicic","Active Trifluoromethylating Agents from Well-Defined Copper(I)-CF3 Complexes","Journal of the American Chemical Society","2008","130","","8600","8601","10.1021/ja802946s","","","0.71075","MoKα","","0.082","0.0659","","","0.1536","0.1616","","","","","","1.209","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107993","10.86","0.15","14.76","0.05","20.36","0.1","90","","94.8","0.3","90","","3252","5","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H44 Cu F3 N2 Si -","- C31 H44 Cu F3 N2 Si -","- C124 H176 Cu4 F12 N8 Si4 -","4","1","","Galyna G. Dubinina; Hideki Furutachi; David A. Vicic","Active Trifluoromethylating Agents from Well-Defined Copper(I)-CF3 Complexes","Journal of the American Chemical Society","2008","130","","8600","8601","10.1021/ja802946s","","","0.71075","MoKα","","0.0765","0.0503","","","0.1273","0.1467","","","","","","1.06","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107994","8.249","0.003","9.803","0.003","16.222","0.006","84.265","0.007","86.712","0.008","83.729","0.008","1296","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H18 B Cu F3 N2 -","- C10 H18 Cu F3 N2 -","- C40 H72 Cu4 F12 N8 -","4","2","","Galyna G. Dubinina; Hideki Furutachi; David A. Vicic","Active Trifluoromethylating Agents from Well-Defined Copper(I)-CF3 Complexes","Journal of the American Chemical Society","2008","130","","8600","8601","10.1021/ja802946s","","","0.71075","MoKα","","0.0711","0.06","","","0.1537","0.1612","","","","","","1.076","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107995","12.935","","23.242","0.0012","12.935","0.0005","90","","90","","90","","3888.7","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C56 H28 N4 O12 Zn2 -","- C56 H28 N4 O12 Zn2 -","- C112 H56 N8 O24 Zn4 -","2","1","","Omar K. Farha; Karen L. Mulfort; Alison M. Thorsness; Joseph T. Hupp","Separating Solids: Purification of Metal-Organic Framework Materials","Journal of the American Chemical Society","2008","130","","8598","8599","10.1021/ja803097e","","","0.71073","MoKα","","0.176","0.0981","","","0.2275","0.2438","","","","","","0.779","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107996","7.215","0.0008","10.9179","0.0012","19.254","0.002","90","","94.616","0.002","90","","1511.8","0.3","90","2","90","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Br N O3 -","- C16 H14 Br N O3 -","- C64 H56 Br4 N4 O12 -","4","1","","James R. Manning; Huw M. L. Davies","One-Pot Synthesis of Highly Functionalized Pyridines via a Rhodium Carbenoid Induced Ring Expansion of Isoxazoles","Journal of the American Chemical Society","2008","130","","8602","8603","10.1021/ja803139k","","","0.71073","MoKα","","0.0386","0.0338","","","0.0906","0.0937","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4107997","12.2958","0.0012","12.3811","0.0012","15.1557","0.0015","75.937","0.002","68.298","0.002","74.755","0.002","2040.7","0.3","243","2","243","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H114 Mo O4 P6 S4 W -","- C70 H114 Mo O4 P6 S4 W -","- C70 H114 Mo O4 P6 S4 W -","1","0.5","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0299","0.0258","","","0.0671","0.0689","","","","","","1.058","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107998","13.2117","0.0007","14.3682","0.0008","18.8799","0.001","84.418","0.001","73.326","0.001","66.223","0.001","3141.1","0.3","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H84 O4 P3 S4 W -","- C58 H84 O4 P3 S4 W -","- C116 H168 O8 P6 S8 W2 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0309","0.0261","","","0.0676","0.0701","","","","","","1.032","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4107999","12.3083","0.001","12.379","0.0011","15.1786","0.0013","76.076","0.001","68.349","0.002","74.949","0.002","2048.6","0.3","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H114 Mo2 O4 P6 S4 -","- C70 H114 Mo2 O4 P6 S4 -","- C70 H114 Mo2 O4 P6 S4 -","1","0.5","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0413","0.0347","","","0.0959","0.101","","","","","","1.019","","","","has coordinates","178825","2020-10-21","18:00:00",""
"4108000","14.0932","0.0007","24.0931","0.0012","21.8585","0.0011","90","","105.871","0.001","90","","7139.1","0.6","125","2","125","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C67 H91 Mo O12 P3 S4 -","- C49 H73 Mo O12 P3 S4 -","- C196 H292 Mo4 O48 P12 S16 -","4","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.1079","0.0593","","","0.1301","0.1434","","","","","","1","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108001","14.5295","0.0009","16.9384","0.001","17.4029","0.001","67.311","0.001","70.876","0.001","70.19","0.001","3620.8","0.4","125","2","125","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H107 Mo Ni O4 P5 S4 -","- C61 H107 Mo Ni O4 P5 S4 -","- C122 H214 Mo2 Ni2 O8 P10 S8 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.1673","0.0651","","","0.098","0.1218","","","","","","1.014","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108002","13.3569","0.0009","14.1906","0.001","17.3759","0.0012","92.013","0.001","94.763","0.001","100.333","0.001","3224.7","0.4","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H88 Mo O4 P2 S4 -","- C66 H88 Mo O4 P2 S4 -","- C132 H176 Mo2 O8 P4 S8 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0615","0.0423","","","0.1049","0.1151","","","","","","1.023","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108003","13.2173","0.0009","14.3491","0.0009","18.9086","0.0012","84.63","0.001","73.869","0.001","66.282","0.001","3153.3","0.4","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H84 Mo O4 P3 S4 -","- C58 H84 Mo O4 P3 S4 -","- C116 H168 Mo2 O8 P6 S8 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.052","0.0394","","","0.1062","0.1139","","","","","","1.055","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108004","12.3747","0.0014","18.238","0.002","18.723","0.002","90","","97.803","0.002","90","","4186.5","0.8","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C76 H120 Mo2 O12 P6 S4 -","- C76 H120 Mo2 O12 P6 S4 -","- C152 H240 Mo4 O24 P12 S8 -","2","0.5","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0848","0.0593","","","0.1581","0.1823","","","","","","1.025","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108005","29.496","0.002","16.9091","0.0012","27.935","0.002","90","","107.052","0.001","90","","13320.1","1.6","125","2","125","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C61 H87 Mo O12 P3 S4 -","- C61 H87 Mo O12 P3 S4 -","- C488 H696 Mo8 O96 P24 S32 -","8","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.1344","0.0519","","","0.0985","0.1285","","","","","","1.003","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108006","14.1372","0.0006","24.2372","0.0011","21.5715","0.001","90","","107.351","0.001","90","","7055.1","0.5","125","2","125","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C67 H91 O12 P3 S4 W -","- C49 H73 O12 P3 S4 W -","- C196 H292 O48 P12 S16 W4 -","4","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.1038","0.0499","","","0.0819","0.0883","","","","","","1.062","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108007","13.6182","0.0006","15.7406","0.0006","17.2203","0.0007","84.063","0.001","73.404","0.001","83.212","0.001","3503.3","0.2","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C66.5 H95 O12 P3 S4 W -","- C66.5 H95 O12 P3 S4 W -","- C133 H190 O24 P6 S8 W2 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0256","0.0225","","","0.0573","0.0589","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108008","14.5404","0.0011","16.1285","0.0013","17.951","0.002","114.671","0.002","100.424","0.002","104.562","0.001","3501.6","0.6","125","2","125","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H99 Ni O4 P5 S4 W -","- C61 H99 Ni O4 P5 S4 W -","- C122 H198 Ni2 O8 P10 S8 W2 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0626","0.0387","","","0.0719","0.0789","","","","","","1.004","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108009","16.0332","0.0017","16.501","0.0018","17.3405","0.0019","109.434","0.002","99.872","0.002","102.302","0.002","4078.1","0.8","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H99 O4 P S4 W -","- C71 H75 O4 P S4 W -","- C142 H150 O8 P2 S8 W2 -","2","1","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0722","0.042","","","0.0907","0.0989","","","","","","1.049","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108010","12.3356","0.0008","12.4148","0.0008","15.2081","0.0009","75.851","0.001","68.304","0.001","74.616","0.001","2058.5","0.2","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H114 O4 P6 S4 W2 -","- C70 H114 O4 P6 S4 W2 -","- C70 H114 O4 P6 S4 W2 -","1","0.5","","Daniela Buccella; Gerard Parkin","Mononuclear and Dinuclear Molybdenum and Tungsten Complexes of p-tert-Butyltetrathiacalix[4]arene and p-tert-Butyltetrasulfonylcalix[4]arene: Facile Cleavage of the Calixarene Ligand Framework by Nickel","Journal of the American Chemical Society","2008","130","","8617","8619","10.1021/ja803215x","","","0.71073","MoKα","","0.0385","0.0302","","","0.0727","0.0765","","","","","","1.005","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108011","11.0964","0.0019","5.8325","0.001","24.085","0.004","90","","98.716","0.003","90","","1540.8","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 N4 O2 -","- C18 H16 N4 O2 -","- C72 H64 N16 O8 -","4","1","","Brant C. Boren; Sridhar Narayan; Lars K. Rasmussen; Li Zhang; Haitao Zhao; Zhenyang Lin; Guochen Jia; Valery V. Fokin","Ruthenium-Catalyzed Azide-Alkyne Cycloaddition: Scope and Mechanism","Journal of the American Chemical Society","2008","130","","8923","8930","10.1021/ja0749993","","","0.71073","MoKα","","0.0542","0.0454","","","0.1159","0.1221","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108012","33.703","0.005","20.664","0.003","23.485","0.004","90","","132.887","0.002","90","","11984","3","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Cp*sMo(S2)SSMe][O3SCF3]","","","- C47.5 H70 F6 Mo4 O6 S10 -","- C47.5 H70 F6 Mo4 O6 S10 -","- C380 H560 F48 Mo32 O48 S80 -","8","1","","Aaron M. Appel; Suh-Jane Lee; James A. Franz; Daniel L. DuBois; M. Rakowski DuBois; Jerome C. Birnbaum; Brendan Twamley","Formation and Reactivity of a Persistent Radical in a Dinuclear Molybdenum Complex","Journal of the American Chemical Society","2008","130","","8940","8951","10.1021/ja078115r","","","0.71073","MoKα","","0.1075","0.0651","","","0.1555","0.1756","","","","","","0.966","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108013","10.5202","0.0004","12.5398","0.0005","26.2385","0.001","87.631","0.002","84.018","0.002","78.866","0.001","3377","0.2","90","2","90","2","","","","","","","","4","P -1","-P 1","2","[Cp*2Mo2S2S(Bz)S(Me)] + C6H6","","","- C34 H46 Mo2 S4 -","- C34 H46 Mo2 S4 -","- C136 H184 Mo8 S16 -","4","2","","Aaron M. Appel; Suh-Jane Lee; James A. Franz; Daniel L. DuBois; M. Rakowski DuBois; Jerome C. Birnbaum; Brendan Twamley","Formation and Reactivity of a Persistent Radical in a Dinuclear Molybdenum Complex","Journal of the American Chemical Society","2008","130","","8940","8951","10.1021/ja078115r","","","0.71073","MoKα","","0.0523","0.0362","","","0.0774","0.0837","","","","","","1.048","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108014","11.6316","0.0004","11.6316","0.0004","35.549","0.002","90","","90","","90","","4809.6","0.4","90","2","90","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","[Cp*2Mo2S3SMe]2","","","- C42 H66 Mo4 S8 -","- C42 H66 Mo4 S8 -","- C168 H264 Mo16 S32 -","4","0.5","","Aaron M. Appel; Suh-Jane Lee; James A. Franz; Daniel L. DuBois; M. Rakowski DuBois; Jerome C. Birnbaum; Brendan Twamley","Formation and Reactivity of a Persistent Radical in a Dinuclear Molybdenum Complex","Journal of the American Chemical Society","2008","130","","8940","8951","10.1021/ja078115r","","","0.71073","MoKα","","0.026","0.025","","","0.0608","0.0614","","","","","","1.059","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108015","13.7803","0.0012","21.2002","0.0018","17.4958","0.0015","90","","90.26","0.002","90","","5111.3","0.8","108","2","108","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 F18 N O5 W -","- C16 H19 F18 N O5 W -","- C128 H152 F144 N8 O40 W8 -","8","2","","Andrea M. Geyer; Eric S. Wiedner; J. Brannon Gary; Robyn L. Gdula; Nicola C. Kuhlmann; Marc J. A. Johnson; Barry D. Dunietz; Jeff W. Kampf","Synthetic, Mechanistic, and Computational Investigations of Nitrile-Alkyne Cross-Metathesis","Journal of the American Chemical Society","2008","130","","8984","8999","10.1021/ja800020w","","","0.71073","MoKα","","0.0569","0.0533","","","0.1384","0.1411","","","","","","1.122","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108016","22.88","0.005","18.04","0.004","36.791","0.007","90","","90.034","0.003","90","","15186","6","108","2","108","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 F24 Li N O8 W -","- C24 H32 F24 Li N O8 W -","- C384 H512 F384 Li16 N16 O128 W16 -","16","4","","Andrea M. Geyer; Eric S. Wiedner; J. Brannon Gary; Robyn L. Gdula; Nicola C. Kuhlmann; Marc J. A. Johnson; Barry D. Dunietz; Jeff W. Kampf","Synthetic, Mechanistic, and Computational Investigations of Nitrile-Alkyne Cross-Metathesis","Journal of the American Chemical Society","2008","130","","8984","8999","10.1021/ja800020w","","","0.71073","MoKα","","0.0292","0.0236","","","0.0486","0.0504","","","","","","1.036","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108017","6.1711","0.0007","6.6959","0.0008","24.683","0.003","90","","90","","90","","1019.9","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H10 F2 N2 O4 -","- C9 H10 F2 N2 O4 -","- C36 H40 F8 N8 O16 -","4","1","","Joseph J. Barchi; Rajeshri G. Karki; Marc C. Nicklaus; Maqbool A. Siddiqui; Clifford George; Igor A. Mikhailopulo; Victor E. Marquez","Comprehensive Structural Studies of 2',3'-Difluorinated Nucleosides: Comparison of Theory, Solution, and Solid State","Journal of the American Chemical Society","2008","130","","9048","9057","10.1021/ja800964g","","","0.71073","MoKα","","0.0402","0.0352","","","0.0906","0.0933","","","","","","1.022","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108018","23.159","0.001","23.159","0.001","7.016","0.001","90","","90","","120","","3258.8","0.5","198","2","198","2","","","","","","","","5","P 65","P 65","170","","","","- C9.33 H11 F2 N2 O4.17 -","- C9.33 H10.99 F2 N2 O4.165 -","- C111.96 H131.88 F24 N24 O49.98 -","12","2","","Joseph J. Barchi; Rajeshri G. Karki; Marc C. Nicklaus; Maqbool A. Siddiqui; Clifford George; Igor A. Mikhailopulo; Victor E. Marquez","Comprehensive Structural Studies of 2',3'-Difluorinated Nucleosides: Comparison of Theory, Solution, and Solid State","Journal of the American Chemical Society","2008","130","","9048","9057","10.1021/ja800964g","","","1.54178","CuKα","","0.0586","0.044","","","0.0925","0.0977","","","","","","0.995","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108019","9.015","0.001","5.568","0.001","10.058","0.001","90","","103.214","0.003","90","","491.5","0.11","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C8 H9 F2 N3 O4 -","- C8 H9 F2 N3 O4 -","- C16 H18 F4 N6 O8 -","2","1","","Joseph J. Barchi; Rajeshri G. Karki; Marc C. Nicklaus; Maqbool A. Siddiqui; Clifford George; Igor A. Mikhailopulo; Victor E. Marquez","Comprehensive Structural Studies of 2',3'-Difluorinated Nucleosides: Comparison of Theory, Solution, and Solid State","Journal of the American Chemical Society","2008","130","","9048","9057","10.1021/ja800964g","","","1.54178","CuKα","","0.0307","0.0302","","","0.077","0.0776","","","","","","1.074","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108020","16.506","0.0006","7.3215","0.0003","13.9763","0.0006","90","","100.516","0.002","90","","1660.65","0.12","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0561","0.0389","","","0.1033","0.1094","","","","","","1.617","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108021","16.4936","0.0009","7.3003","0.0004","13.888","0.0009","90","","100.556","0.004","90","","1643.93","0.17","240","2","240","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0455","0.0335","","","0.0821","0.0857","","","","","","1.564","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108022","16.493","0.0007","7.2802","0.0003","13.8389","0.0006","90","","100.55","0.003","90","","1633.58","0.12","210","2","210","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0398","0.0304","","","0.0739","0.0764","","","","","","1.552","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108023","16.4898","0.0009","7.2729","0.0004","13.7991","0.0008","90","","100.551","0.003","90","","1626.93","0.16","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0365","0.0281","","","0.0673","0.0698","","","","","","1.51","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108024","16.4924","0.0006","7.2511","0.0003","13.7532","0.0005","90","","100.545","0.002","90","","1616.94","0.11","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0311","0.0255","","","0.0608","0.0624","","","","","","1.489","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108025","16.4836","0.0009","7.2469","0.0004","13.7167","0.0008","90","","100.551","0.003","90","","1610.82","0.16","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0281","0.0229","","","0.0552","0.0563","","","","","","1.55","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108026","16.4821","0.0009","7.2348","0.0004","13.6784","0.0008","90","","100.547","0.003","90","","1603.52","0.16","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.025","0.0212","","","0.0554","0.0564","","","","","","1.482","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108027","16.4775","0.0009","7.226","0.0004","13.6408","0.0008","90","","100.546","0.003","90","","1596.73","0.16","60","2","60","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0232","0.0205","","","0.0537","0.0543","","","","","","1.553","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108028","16.4754","0.0008","7.2193","0.0004","13.6161","0.0007","90","","100.541","0.003","90","","1592.18","0.14","30","2","30","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.022","0.0195","","","0.0517","0.0524","","","","","","1.548","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108029","17.2842","0.0009","7.5139","0.0004","14.0608","0.0008","90","","100.051","0.003","90","","1798.08","0.17","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0595","0.0414","","","0.1089","0.1134","","","","","","1.674","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108030","17.249","0.0011","7.4744","0.0005","13.9631","0.0009","90","","100.123","0.003","90","","1772.2","0.2","240","2","240","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0432","0.0324","","","0.0815","0.0837","","","","","","1.597","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108031","17.2461","0.0009","7.4589","0.0004","13.9154","0.0008","90","","100.129","0.003","90","","1762.14","0.17","210","2","210","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0357","0.028","","","0.0714","0.0731","","","","","","1.555","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108032","17.2353","0.0011","7.4456","0.0005","13.8804","0.0009","90","","100.158","0.003","90","","1753.3","0.2","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0306","0.0247","","","0.0591","0.0603","","","","","","1.444","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108033","17.2433","0.0011","7.4312","0.0005","13.8431","0.0009","90","","100.143","0.003","90","","1746.1","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0255","0.0212","","","0.0488","0.0495","","","","","","1.512","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108034","17.2186","0.0009","7.4177","0.0004","13.8073","0.0007","90","","100.193","0.002","90","","1735.67","0.16","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0208","0.0181","","","0.0429","0.0434","","","","","","1.377","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108035","17.211","0.0009","7.4028","0.0004","13.7689","0.0007","90","","100.218","0.002","90","","1726.47","0.16","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.018","0.0156","","","0.0368","0.0372","","","","","","1.337","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108036","17.1969","0.0009","7.3925","0.0004","13.7372","0.0007","90","","100.243","0.002","90","","1718.55","0.16","60","2","60","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0163","0.0148","","","0.035","0.0352","","","","","","1.392","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108037","17.1915","0.001","7.3882","0.0004","13.7152","0.0008","90","","100.254","0.003","90","","1714.2","0.17","30","2","30","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.71073","MoKα","","0.0215","0.0188","","","0.0386","0.039","","","","","","1.189","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108038","16.52","0.003","7.3101","0.0013","13.95","0.004","90","","100.485","0.017","90","","1656.5","0.6","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.169","0.0773","","","0.2138","0.2972","","","","","","0.994","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108039","16.5059","0.0012","7.2124","0.0012","13.752","0.0011","90","","100.695","0.006","90","","1608.7","0.3","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-ray","","0.1006","0.0578","","","0.1474","0.179","","","","","","1.24","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108040","16.4993","0.0012","7.1511","0.0012","13.6366","0.0011","90","","100.808","0.006","90","","1580.4","0.3","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0758","0.0394","","","0.0882","0.1069","","","","","","1.048","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108041","16.4769","0.0014","7.0705","0.0013","13.4942","0.0012","90","","100.971","0.006","90","","1543.3","0.3","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0717","0.0404","","","0.0911","0.1037","","","","","","1.051","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108042","16.4411","0.0007","6.9803","0.0006","13.3444","0.0006","90","","101.164","0.003","90","","1502.47","0.16","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0722","0.0402","","","0.0895","0.1015","","","","","","1.06","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108043","16.3973","0.0007","6.8907","0.0007","13.2377","0.0007","90","","101.387","0.004","90","","1466.27","0.18","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.143","0.0703","","","0.1789","0.2184","","","","","","1.115","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108044","16.3564","0.0011","6.76","0.001","13.15","0.001","90","","101.79","0.005","90","","1423.3","0.3","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.1037","0.0621","","","0.1638","0.1904","","","","","","1.226","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108045","16.354","0.005","6.577","0.004","13.014","0.005","90","","102.23","0.02","90","","1368","1.1","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.1354","0.079","","","0.2068","0.2437","","","","","","1.06","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108046","16.317","0.002","6.5279","0.0017","12.914","0.002","90","","102.463","0.01","90","","1343.1","0.4","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cl6 Co N2 -","- C10 H10 Cl6 Co N2 -","- C40 H40 Cl24 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.1953","0.1341","","","0.348","0.3919","","","","","","1.395","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108047","17.214","0.004","7.4879","0.001","14.0091","0.0018","90","","99.98","0.02","90","","1778.4","0.5","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.1154","0.0623","","","0.1637","0.2002","","","","","","1.245","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108048","17.211","0.002","7.3392","0.0004","13.7246","0.0007","90","","100.381","0.009","90","","1705.2","0.2","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0935","0.0549","","","0.1191","0.1381","","","","","","1.692","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108049","17.144","0.004","7.2256","0.001","13.5526","0.0016","90","","100.611","0.019","90","","1650.1","0.5","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0808","0.0498","","","0.1247","0.1391","","","","","","1.16","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108050","17.137","0.003","7.188","0.003","13.504","0.002","90","","100.821","0.013","90","","1633.9","0.8","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0734","0.052","","","0.1286","0.1431","","","","","","1.083","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108051","17.082","0.003","7.066","0.002","13.353","0.002","90","","101.073","0.012","90","","1581.7","0.6","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0655","0.0435","","","0.1154","0.1284","","","","","","1.043","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108052","17.058","0.002","7.0335","0.0017","13.2733","0.0015","90","","101.103","0.009","90","","1562.7","0.5","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0649","0.0458","","","0.1318","0.1408","","","","","","1.297","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108053","17.022","0.002","6.9783","0.0017","13.1936","0.0018","90","","101.2","0.01","90","","1537.3","0.5","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0826","0.0514","","","0.1236","0.1349","","","","","","1.208","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108054","16.968","0.002","6.8746","0.0019","13.0779","0.0018","90","","101.392","0.011","90","","1495.5","0.5","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.0893","0.054","","","0.1365","0.152","","","","","","1.464","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108055","16.92","0.003","6.768","0.002","13.009","0.002","90","","101.541","0.014","90","","1459.6","0.6","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Br4 Cl2 Co N2 -","- C10 H10 Br4 Cl2 Co N2 -","- C40 H40 Br16 Cl8 Co4 N8 -","4","0.5","","Guillermo Mínguez Espallargas; Lee Brammer; David R. Allan; Colin R. Pulham; Neil Robertson; John E. Warren","Noncovalent Interactions under Extreme Conditions: High-Pressure and Low-Temperature Diffraction Studies of the Isostructural Metal-Organic Networks (4-Chloropyridinium)2[CoX4] (X = Cl, Br)","Journal of the American Chemical Society","2008","130","","9058","9071","10.1021/ja8010868","","","0.488","X-rays","","0.1014","0.0681","","","0.1883","0.2036","","","","","","1.439","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108056","21.2194","0.0009","21.3055","0.0008","24.4632","0.001","89.325","0.003","79.31","0.003","63.263","0.003","9673.3","0.7","93.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C148 H100 Ag9 F27 N24 O46 S21 -","- C148 H72 Ag9 F27 N24 O46 S21 -","- C296 H144 Ag18 F54 N48 O92 S42 -","2","1","","Shuichi Hiraoka; Erika Okuno; Takaaki Tanaka; Motoo Shiro; Mitsuhiko Shionoya","Ranging Correlated Motion (1.5 nm) of Two Coaxially Arranged Rotors Mediated by Helix Inversion of a Supramolecular Transmitter","Journal of the American Chemical Society","2008","130","","9089","9098","10.1021/ja8014583","","","1.54187","CuKα","","","0.1345","","","","0.3908","","","","","","1.055","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108057","12.744","0.003","13.071","0.003","20.47","0.004","82.89","0.03","74.53","0.03","88.8","0.03","3260.8","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- Er H0 Na9 O71 W10 -","- Er Na9 O71 W10 -","- Er2 Na18 O142 W20 -","2","1","","Murad A. AlDamen; Juan M. Clemente-Juan; Eugenio Coronado; Carlos Martí-Gastaldo; Alejandro Gaita-Ariño","Mononuclear Lanthanide Single-Molecule Magnets Based on Polyoxometalates","Journal of the American Chemical Society","2008","130","","8874","8875","10.1021/ja801659m","","","0.71073","MoKα","","0.1103","0.0714","","","0.1742","0.1905","","","","","","0.984","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108058","10.361","0.002","15.457","0.003","18.005","0.004","110.955","0.008","93.425","0.007","103.604","0.006","2584.2","0.9","120","2","120","2","","","","","","","","4","P -1","-P 1","2","La2@C72Ad","La2@C72Ad","","- C94 H22 Cl4 La2 -","- C94 H22 Cl4 La2 -","- C188 H44 Cl8 La4 -","2","1","","Xing Lu; Hidefumi Nikawa; Tsukasa Nakahodo; Takahiro Tsuchiya; Midori O. Ishitsuka; Yutaka Maeda; Takeshi Akasaka; Makoto Toki; Hiroshi Sawa; Zdenek Slanina; Naomi Mizorogi; Shigeru Nagase","Chemical Understanding of a Non-IPR Metallofullerene: Stabilization of Encaged Metals on Fused-Pentagon Bonds in La2@C72","Journal of the American Chemical Society","2008","130","","9129","9136","10.1021/ja8019577","","","0.71075","MoKα","","0.0961","0.0761","","","0.1788","0.1905","","","","","","1.029","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108059","10.468","0.002","15.464","0.004","17.864","0.004","111.15","0.009","95.53","0.008","104.178","0.01","2559.7","1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","La2@C72(Ad)","La2@C72(Ad)","","- C94 H22 Cl4 La2 -","- C94 H22 Cl4 La2 -","- C188 H44 Cl8 La4 -","2","1","","Xing Lu; Hidefumi Nikawa; Tsukasa Nakahodo; Takahiro Tsuchiya; Midori O. Ishitsuka; Yutaka Maeda; Takeshi Akasaka; Makoto Toki; Hiroshi Sawa; Zdenek Slanina; Naomi Mizorogi; Shigeru Nagase","Chemical Understanding of a Non-IPR Metallofullerene: Stabilization of Encaged Metals on Fused-Pentagon Bonds in La2@C72","Journal of the American Chemical Society","2008","130","","9129","9136","10.1021/ja8019577","","x-ray","0.71075","MoKα","","0.07","0.0528","","","0.1194","0.1264","","","","","","1.077","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108060","10.4412","0.0009","15.5","0.0016","17.919","0.0014","110.931","0.005","95.813","0.004","104.328","0.005","2566.1","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","La@C72Ad","La@C72Ad","","- C94 H22 Cl4 La2 -","- C94 H22 Cl4 La2.0002 -","- C188 H44 Cl8 La4.0004 -","2","1","","Xing Lu; Hidefumi Nikawa; Tsukasa Nakahodo; Takahiro Tsuchiya; Midori O. Ishitsuka; Yutaka Maeda; Takeshi Akasaka; Makoto Toki; Hiroshi Sawa; Zdenek Slanina; Naomi Mizorogi; Shigeru Nagase","Chemical Understanding of a Non-IPR Metallofullerene: Stabilization of Encaged Metals on Fused-Pentagon Bonds in La2@C72","Journal of the American Chemical Society","2008","130","","9129","9136","10.1021/ja8019577","","x-ray","0.9983","synchrotron","","0.0844","0.067","","","0.2015","0.2131","","","","","","1.06","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108061","11.278","0.002","11.608","0.002","13.556","0.002","88.988","0.003","89.252","0.003","87.863","0.003","1773","0.5","138","2","138","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H51.5 K Mn N7.5 O4 -","- C29 H51.5 K Mn N7.5 O4 -","- C58 H103 K2 Mn2 N15 O8 -","2","1","","Ryan L. Shook; William A. Gunderson; John Greaves; Joseph W. Ziller; Michael P. Hendrich; A. S. Borovik","A Monomeric MnIII-Peroxo Complex Derived Directly from Dioxygen","Journal of the American Chemical Society","2008","130","","8888","8889","10.1021/ja802775e","","","0.71073","MoKα","","0.0707","0.0513","","","0.1264","0.1398","","","","","","1.042","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4108062","12.601","0.005","14.722","0.006","16.085","0.006","90","","90","","90","","2984","2","296","2","296","2","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C32 H42 N2 Rh2 -","- C32 H40 N2 Rh2 -","- C128 H160 N8 Rh8 -","4","0.5","","Shin Takemoto; Shohei Otsuki; Yasuhiro Hashimoto; Ken Kamikawa; Hiroyuki Matsuzaka","Divalent Dirhodium Imido Complexes: Formation, Structure, and Alkyne Cycloaddition Reactivity","Journal of the American Chemical Society","2008","130","","8904","8905","10.1021/ja8033922","","","0.71075","MoKα","","0.0592","0.0485","","","0.1001","0.1038","","","","","","1.215","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108063","12.763","0.004","16.265","0.007","16.571","0.006","90","","92.249","0.012","90","","3437","2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C40 H45 N Rh2 -","- C40 H45 N Rh2 -","- C160 H180 N4 Rh8 -","4","1","","Shin Takemoto; Shohei Otsuki; Yasuhiro Hashimoto; Ken Kamikawa; Hiroyuki Matsuzaka","Divalent Dirhodium Imido Complexes: Formation, Structure, and Alkyne Cycloaddition Reactivity","Journal of the American Chemical Society","2008","130","","8904","8905","10.1021/ja8033922","","","0.71075","MoKα","","0.1543","0.1013","","","0.2629","0.2837","","","","","","1.431","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108064","16.831","0.007","16.775","0.005","23.043","0.007","90","","103.634","0.015","90","","6323","4","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H47 N Rh2 -","- C32 H47 N Rh2 -","- C256 H376 N8 Rh16 -","8","1","","Shin Takemoto; Shohei Otsuki; Yasuhiro Hashimoto; Ken Kamikawa; Hiroyuki Matsuzaka","Divalent Dirhodium Imido Complexes: Formation, Structure, and Alkyne Cycloaddition Reactivity","Journal of the American Chemical Society","2008","130","","8904","8905","10.1021/ja8033922","","","0.71075","MoKα","","0.0366","0.0305","","","0.0806","0.0845","","","","","","1.109","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108065","18.111","0.004","11.438","0.004","17.523","0.004","90","","90","","90","","3630","1.7","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C37 H56 N2 Rh2 -","- C37 H56 N2 Rh2 -","- C148 H224 N8 Rh8 -","4","1","","Shin Takemoto; Shohei Otsuki; Yasuhiro Hashimoto; Ken Kamikawa; Hiroyuki Matsuzaka","Divalent Dirhodium Imido Complexes: Formation, Structure, and Alkyne Cycloaddition Reactivity","Journal of the American Chemical Society","2008","130","","8904","8905","10.1021/ja8033922","","","0.71075","MoKα","","0.0326","0.0261","","","0.0574","0.0597","","","","","","1.021","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108066","26.01","0.004","17.383","0.0018","17.619","0.002","90","","118.334","0.009","90","","7011.7","1.6","95","2","95","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(iPr2Im)2(h2-C10F8)Ni(0)","","- C35 H40 F8 N4 Ni -","- C35 H40 F8 N4 Ni -","- C280 H320 F64 N32 Ni8 -","8","1","","Thomas Schaub; Peter Fischer; Andreas Steffen; Thomas Braun; Udo Radius; Andreas Mix","C-F Activation of Fluorinated Arenes using NHC-Stabilized Nickel(0) Complexes: Selectivity and Mechanistic Investigations","Journal of the American Chemical Society","2008","130","","9304","9317","10.1021/ja074640e","","","0.71073","MoKα","","0.0709","0.0394","","","0.0655","0.0747","","","","","","1.052","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108067","10.801","0.002","10.801","0.0014","24.033","0.002","90","","90","","90","","2803.7","0.7","95","2","95","2","","","","","","","","6","P 43","P 4cw","78","","(iPr2Im)2(F)(C6F5)Ni(II)","","- C24 H34 F6 N4 Ni O -","- C24 H34 F6 N4 Ni O -","- C96 H136 F24 N16 Ni4 O4 -","4","1","","Thomas Schaub; Peter Fischer; Andreas Steffen; Thomas Braun; Udo Radius; Andreas Mix","C-F Activation of Fluorinated Arenes using NHC-Stabilized Nickel(0) Complexes: Selectivity and Mechanistic Investigations","Journal of the American Chemical Society","2008","130","","9304","9317","10.1021/ja074640e","","","0.71073","MoKα","","0.0514","0.0357","","","0.065","0.0701","","","","","","1.059","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108068","35.173","0.004","10.2706","0.0013","24.407","0.003","90","","128.352","0.014","90","","6914","2","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(iPr2Im)2(F)(C6F4-4-SiMe)Ni(II)","","- C28.5 H44.5 F5 N4 Ni Si -","- C28.5 H44.5 F5 N4 Ni Si -","- C228 H356 F40 N32 Ni8 Si8 -","8","1","","Thomas Schaub; Peter Fischer; Andreas Steffen; Thomas Braun; Udo Radius; Andreas Mix","C-F Activation of Fluorinated Arenes using NHC-Stabilized Nickel(0) Complexes: Selectivity and Mechanistic Investigations","Journal of the American Chemical Society","2008","130","","9304","9317","10.1021/ja074640e","","","0.71073","MoKα","","0.1143","0.0631","","","0.1538","0.1832","","","","","","1.009","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108069","8.324","0.003","12.866","0.004","23.101","0.008","83.494","0.005","80.571","0.005","82.972","0.005","2411.3","1.4","273","","273","","","","","","","","","5","P -1","-P 1","2","","","","- C56 H50 F6 O3 S2 -","- C56 H50 F6 O3 S2 -","- C112 H100 F12 O6 S4 -","2","1","","Ryota Arai; Shinobu Uemura; Masahiro Irie; Kenji Matsuda","Reversible Photoinduced Change in Molecular Ordering of Diarylethene Derivatives at a Solution-HOPG Interface","Journal of the American Chemical Society","2008","130","","9371","9379","10.1021/ja711041p","","","0.71073","MoKα","","0.0939","0.0611","","","0.1507","0.1799","","","","","","1.165","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108070","10.743","0.0012","34.303","0.004","27.698","0.003","90","","98.018","0.002","90","","10107","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","compound 2[B(ArF)4] in main text","","","- C104 H120 B F24 Mo2 N8 -","- C104 H120 B F24 Mo2 N8 -","- C416 H480 B4 F96 Mo8 N32 -","4","1","","John J. Curley; Timothy R. Cook; Steven Y. Reece; Peter Müller; Christopher C. Cummins","Shining Light on Dinitrogen Cleavage: Structural Features, Redox Chemistry, and Photochemistry of the Key Intermediate Bridging Dinitrogen Complex","Journal of the American Chemical Society","2008","130","","9394","9405","10.1021/ja8002638","","","0.71073","MoKα","","0.0963","0.0614","","","0.1378","0.1568","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108071","37.061","0.003","14.5586","0.0011","27.9278","0.0017","90","","112.022","0.002","90","","13969.2","1.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 3 in main text","","","- C36 H54 Mo N4 -","- C36.0001 H54 Mo N4 -","- C576.001 H864 Mo16 N64 -","16","4","","John J. Curley; Timothy R. Cook; Steven Y. Reece; Peter Müller; Christopher C. Cummins","Shining Light on Dinitrogen Cleavage: Structural Features, Redox Chemistry, and Photochemistry of the Key Intermediate Bridging Dinitrogen Complex","Journal of the American Chemical Society","2008","130","","9394","9405","10.1021/ja8002638","","","0.71073","MoKα","","0.0764","0.0633","","","0.1815","0.1954","","","","","","1.088","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108072","19.2758","0.0019","11.4817","0.0012","21.05","0.002","90","","99.162","0.002","90","","4599.3","0.8","100","2","100","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","Compound 2 in main text","","","- C84 H144 Mo2 N8 O2 Si4 -","- C84 H144 Mo2 N8 O2 Si4 -","- C168 H288 Mo4 N16 O4 Si8 -","2","0.5","","John J. Curley; Timothy R. Cook; Steven Y. Reece; Peter Müller; Christopher C. Cummins","Shining Light on Dinitrogen Cleavage: Structural Features, Redox Chemistry, and Photochemistry of the Key Intermediate Bridging Dinitrogen Complex","Journal of the American Chemical Society","2008","130","","9394","9405","10.1021/ja8002638","","","0.71073","MoKα","","0.0391","0.0332","","","0.0842","0.0888","","","","","","1.034","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108073","21.706","0.008","11.313","0.004","31.325","0.011","90","","99.944","0.006","90","","7577","5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","compound 2 in main text","","","- C77 H120 Mo2 N8 -","- C77 H120 Mo2 N8 -","- C308 H480 Mo8 N32 -","4","1","","John J. Curley; Timothy R. Cook; Steven Y. Reece; Peter Müller; Christopher C. Cummins","Shining Light on Dinitrogen Cleavage: Structural Features, Redox Chemistry, and Photochemistry of the Key Intermediate Bridging Dinitrogen Complex","Journal of the American Chemical Society","2008","130","","9394","9405","10.1021/ja8002638","","","0.71073","MoKα","","0.067","0.0395","","","0.0915","0.1079","","","","","","1.063","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108074","17.0959","0.001","21.861","0.0012","21.5744","0.0012","90","","96.258","0.001","90","","8015","0.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","compound 2[B(ArF)4]2 in main text","","","- C158.4 H178.4 B2 F48 Mo2 N8 O4.4 -","- C158.4 H178.4 B2 F48 Mo2 N8 O4.4 -","- C316.8 H356.8 B4 F96 Mo4 N16 O8.8 -","2","0.5","","John J. Curley; Timothy R. Cook; Steven Y. Reece; Peter Müller; Christopher C. Cummins","Shining Light on Dinitrogen Cleavage: Structural Features, Redox Chemistry, and Photochemistry of the Key Intermediate Bridging Dinitrogen Complex","Journal of the American Chemical Society","2008","130","","9394","9405","10.1021/ja8002638","","","0.71073","MoKα","","0.0791","0.0494","","","0.1207","0.1394","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108075","11.35","0.002","14.15","0.003","16.557","0.003","77.231","0.003","75.225","0.003","67.525","0.003","2353.1","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","(CO)5W(cyclo-P3)W(N[iPr]Ar)3","","","- C43 H60 N3 O5 P3 W2 -","- C43 H60 N3 O5 P3 W2 -","- C86 H120 N6 O10 P6 W4 -","2","1","","Nicholas A. Piro; Christopher C. Cummins","P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes","Journal of the American Chemical Society","2008","130","","9524","9535","10.1021/ja802080m","","","0.71073","MoKα","","0.0621","0.042","","","0.0914","0.0994","","","","","","1.095","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108076","12.145","0.003","13.565","0.003","22.695","0.006","106.235","0.004","91.068","0.004","94.536","0.004","3575.3","1.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","{Et2ONa}{[W(CO)5]2(cyclo-P3)Nb(N[Np]Ar)3} (C6H6)","","","- C59 H76 N3 Na Nb O11 P3 W2 -","- C59 H76 N3 Na Nb O11 P3 W2 -","- C118 H152 N6 Na2 Nb2 O22 P6 W4 -","2","1","","Nicholas A. Piro; Christopher C. Cummins","P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes","Journal of the American Chemical Society","2008","130","","9524","9535","10.1021/ja802080m","","","0.71073","MoKα","","0.097","0.0515","","","0.1186","0.1383","","","","","","1.033","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108077","12.1488","0.0008","13.9473","0.0009","24.4655","0.0015","75.719","0.001","79.17","0.001","66.612","0.001","3668.4","0.4","100","2","100","2","","","","","","","","9","P -1","-P 1","2","Ph3Sn{(CO)5W}P3Nb(N[Np]Ar)3 O(SiMe3)2","","","- C68 H93 N3 Nb O6 P3 Si2 Sn W -","- C68 H93 N3 Nb O6 P3 Si2 Sn W -","- C136 H186 N6 Nb2 O12 P6 Si4 Sn2 W2 -","2","1","","Nicholas A. Piro; Christopher C. Cummins","P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes","Journal of the American Chemical Society","2008","130","","9524","9535","10.1021/ja802080m","","","0.71073","MoKα","","0.0591","0.0359","","","0.0662","0.0746","","","","","","1.043","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108078","12.553","0.002","16.226","0.003","19.007","0.004","67.754","0.003","84.259","0.003","87.128","0.004","3565","1.2","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[Mes*NPW(CO)5]P3Nb(N[Np]Ar)3 (Et2O)","","","- C65.11 H96.77 N4 Nb O5.78 P4 W -","- C65.1076 H96.769 N4 Nb O5.7769 P4 W -","- C130.215 H193.538 N8 Nb2 O11.5538 P8 W2 -","2","1","","Nicholas A. Piro; Christopher C. Cummins","P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes","Journal of the American Chemical Society","2008","130","","9524","9535","10.1021/ja802080m","","","0.71073","MoKα","","0.0478","0.0339","","","0.0727","0.0786","","","","","","1.03","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108079","13.9056","0.0012","21.2534","0.0018","23.425","0.002","90","","106.21","0.001","90","","6647.8","1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[W(CO)5]2(AdC(O)P3)Nb(N[Np]Ar)3 (C5H10)0.5","","","- C62.5 H81 N3 Nb O11 P3 W2 -","- C62.5 H81 N3 Nb O11 P3 W2 -","- C250 H324 N12 Nb4 O44 P12 W8 -","4","1","","Nicholas A. Piro; Christopher C. Cummins","P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes","Journal of the American Chemical Society","2008","130","","9524","9535","10.1021/ja802080m","","","0.71073","MoKα","","0.0361","0.0243","","","0.0521","0.0575","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108080","41.125","0.011","11.457","0.003","19.676","0.005","90","","93.174","0.005","90","","9257","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","AdCP2Mo(N[iPr]Ar)3 (toluene)","","","- C51 H71 Mo N3 P2 -","- C51 H71 Mo N3 P2 -","- C408 H568 Mo8 N24 P16 -","8","1","","Nicholas A. Piro; Christopher C. Cummins","P2Addition to Terminal Phosphide M\τbP Triple Bonds: A Rational Synthesis of cyclo-P3 Complexes","Journal of the American Chemical Society","2008","130","","9524","9535","10.1021/ja802080m","","","0.71073","MoKα","","0.0542","0.0365","","","0.0796","0.089","","","","","","1.036","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108081","10.6092","0.0006","13.4345","0.0008","14.855","0.0008","88.2376","0.0009","84.4833","0.0009","79.6293","0.0009","2072.8","0.2","105","2","105","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H52 N4 O10 S3 -","- C41 H52 N4 O10 S3 -","- C82 H104 N8 O20 S6 -","2","1","","Lauren M. Huffman; Shannon S. Stahl","Carbon-Nitrogen Bond Formation Involving Well-Defined Aryl-Copper(III) Complexes","Journal of the American Chemical Society","2008","130","","9196","9197","10.1021/ja802123p","","","0.71073","Mo-Kα","","0.0767","0.0526","","","0.134","0.1449","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108082","5.6367","0.0009","12.1719","0.0019","17.353","0.004","76.461","0.002","81.464","0.004","76.789","0.002","1121.2","0.4","100","0.1","100","0.1","","","","","","","","3","P -1","-P 1","2","milpp01","","","- C27.5 H22 N6 -","- C27.5 H22 N6 -","- C55 H44 N12 -","2","1","","Prakash B. Palde; Peter C. Gareiss; Benjamin L. Miller","Selective Recognition of Alkyl Pyranosides in Protic and Aprotic Solvents","Journal of the American Chemical Society","2008","130","","9566","9573","10.1021/ja802229f","","","0.71073","MoKα","","0.0903","0.0485","","","0.1081","0.1245","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108083","4.896","0.0013","39.526","0.01","21.594","0.006","90","","94.161","0.005","90","","4167.8","1.9","100","0.1","100","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","milpp02","","","- C24 H18 N6 -","- C24 H18 N6 -","- C192 H144 N48 -","8","2","","Prakash B. Palde; Peter C. Gareiss; Benjamin L. Miller","Selective Recognition of Alkyl Pyranosides in Protic and Aprotic Solvents","Journal of the American Chemical Society","2008","130","","9566","9573","10.1021/ja802229f","","","0.71073","MoKα","","0.1347","0.0656","","","0.1287","0.15","","","","","","0.981","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108084","10.2146","0.0004","14.2563","0.0007","15.4161","0.0008","90","","90.814","0.003","90","","2244.7","0.18","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H20 Cl2 N O P Pd -","- C23 H20 Cl2 N O P Pd -","- C92 H80 Cl8 N4 O4 P4 Pd4 -","4","1","","Seung Hwan Cho; Seung Jun Hwang; Sukbok Chang","Palladium-Catalyzed C-H Functionalization of Pyridine N-Oxides: Highly Selective Alkenylation and Direct Arylation with Unactivated Arenes","Journal of the American Chemical Society","2008","130","","9254","9256","10.1021/ja8026295","","","0.71073","MoKα","","0.0948","0.0455","","","0.0774","0.0903","","","","","","0.981","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108085","5.663","0.0009","16.205","0.003","16.938","0.003","90","","92.227","0.002","90","","1553.2","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 N O P -","- C17 H20 N O P -","- C68 H80 N4 O4 P4 -","4","1","","Thomas E. Lightburn; Michael T. Dombrowski; Kian L. Tan","Catalytic Scaffolding Ligands: An Efficient Strategy for Directing Reactions","Journal of the American Chemical Society","2008","130","","9210","9211","10.1021/ja803011d","","","0.71073","MoKα","","0.0615","0.0474","","","0.1172","0.127","","","","","","1.026","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108086","13.4974","0.0001","18.8077","0.0002","14.1387","0.0001","90","","96.092","0.001","90","","3568.91","0.05","193","2","193","2","","","","","","","chemical synthesis","6","P 1 21 1","P 2yb","4","CU05-038","Bis[(1R,2R)-2-(2-phenyl-1H-pyrrol-1-yl)cyclohexylamino]methaniminium Tetrakis[3,5-bis(trifluoromethyl)phenyl]borate Di(propan-2-ol) Solvate","","- C71 H68 B F24 N5 O2 -","- C71 H68 B F24 N5 O2 -","- C142 H136 B2 F48 N10 O4 -","2","1","","Christopher Uyeda; Eric N. Jacobsen","Enantioselective Claisen Rearrangements with a Hydrogen-Bond Donor Catalyst","Journal of the American Chemical Society","2008","130","","9228","9229","10.1021/ja803370x","","","0.71073","MoKα","","0.059","0.0436","","","0.1028","0.1119","","","","","","1.014","","","","has coordinates,has disorder","178826","2020-10-21","18:00:00",""
"4108087","10.988","0.0001","11.519","0.0001","39.162","0.0005","90","","90","","90","","4956.76","0.09","153","2","153","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C52 H48 Cu F6 N2 O P3 -","- C52 H48 Cu F6 N2 O P3 -","- C208 H192 Cu4 F24 N8 O4 P12 -","4","1","","Sonia Nieto; Vincent M. Lynch; Eric V. Anslyn; Hyunwoo Kim; Jik Chin","High-Throughput Screening of Identity, Enantiomeric Excess, and Concentration Using MLCT Transitions in CD Spectroscopy","Journal of the American Chemical Society","2008","130","","9232","9233","10.1021/ja803443j","","","0.71073","MoKα","","0.1121","0.0618","","","0.1483","0.1703","","","","","","1.137","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108088","5.6086","0.0005","13.9556","0.0012","21.634","0.0019","90","","90","","90","","1693.3","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O10 Se -","- C13 H20 O10 Se -","- C52 H80 O40 Se4 -","4","1","","Mohannad Abdo; Spencer Knapp","Biomimetic Seleninates and Selenonates","Journal of the American Chemical Society","2008","130","","9234","9235","10.1021/ja8034448","","","0.71073","MoKα","","0.0404","0.0371","","","0.09","0.0913","","","","","","1.006","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108089","11.415","0.002","11.921","0.002","19.023","0.003","90","","105.772","0.002","90","","2491.2","0.7","273.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C31 H24 O10 -","- C31 H25 O10 -","- C124 H100 O40 -","4","1","","Jean-Philip Lumb; Kevin C. Choong; Dirk Trauner","ortho-Quinone Methides from para-Quinones: Total Synthesis of Rubioncolin B","Journal of the American Chemical Society","2008","130","","9230","9231","10.1021/ja803498r","","","0.7107","MoKα","","0.0707","0.0421","","0.0553","","0.0515","","","","","","2.191","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108090","7.3557","0.0002","8.7509","0.0002","13.5113","0.0003","83.025","0.001","89.369","0.001","89.672","0.001","863.21","0.04","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 N4 O6 -","- C17 H16 N4 O6 -","- C34 H32 N8 O12 -","2","1","","Matthew J. Campbell; Patrick D. Pohlhaus; Geanna Min; Kohsuke Ohmatsu; Jeffrey S. Johnson","An ""Anti-Baldwin"" 3-Exo-Dig Cyclization: Preparation of Vinylidene Cyclopropanes from Electron-Poor Alkenes","Journal of the American Chemical Society","2008","130","","9180","9181","10.1021/ja803553a","","","1.54178","CuKα","","0.0326","0.03","","","0.0806","0.0823","","","","","","1.055","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108091","11.2466","0.0008","11.9082","0.0009","14.2975","0.001","90","","90","","90","","1914.8","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 N3 O4 S -","- C19 H25 N3 O4 S -","- C76 H100 N12 O16 S4 -","4","1","","Hua Yang; Rich G. Carter; Lev N. Zakharov","Enantioselective Total Synthesis of Lycopodine","Journal of the American Chemical Society","2008","130","","9238","9239","10.1021/ja803613w","","","0.71073","MoKα","","0.0424","0.0356","","","0.0816","0.0861","","","","","","1.086","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108092","9.3648","0.001","10.0518","0.0011","18.751","0.002","90","","90","","90","","1765.1","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 N O3 S -","- C19 H25 N O3 S -","- C76 H100 N4 O12 S4 -","4","1","","Hua Yang; Rich G. Carter; Lev N. Zakharov","Enantioselective Total Synthesis of Lycopodine","Journal of the American Chemical Society","2008","130","","9238","9239","10.1021/ja803613w","","","0.71073","MoKα","","0.0618","0.0436","","","0.0799","0.0876","","","","","","1.06","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108093","10.009","0.001","11.164","0.001","14.152","0.002","91.177","0.002","108.735","0.002","99.232","0.002","1473.8","0.3","152.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C33 H36 N2 O6 -","- C33 H36 N2 O6 -","- C66 H72 N4 O12 -","2","1","","Nathan D. Shapiro; F. Dean Toste","Synthesis of Azepines by a Gold-Catalyzed Intermolecular [4 + 3]-Annulation","Journal of the American Chemical Society","2008","130","","9244","9245","10.1021/ja803890t","","","0.7107","MoKα","","0.0777","0.0462","","0.068","","0.0601","","","","","","1.683","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108094","13.01","0.002","16.696","0.003","17.141","0.003","66.982","0.003","69.797","0.004","79.001","0.003","3209.3","0.9","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C58 H72 F3 N Na O6 P S2 -","- C58 H72 F3 N Na O6 P S2 -","- C116 H144 F6 N2 Na2 O12 P2 S4 -","2","1","","Cheol Hong Cheon; Hisashi Yamamoto","A Brønsted Acid Catalyst for the Enantioselective Protonation Reaction","Journal of the American Chemical Society","2008","130","","9246","9247","10.1021/ja8041542","","","0.71073","MoKα","","0.1507","0.062","","","0.1445","0.1693","","","","","","0.768","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108095","10.0957","0.0006","14.0633","0.0008","19.3858","0.0011","90","","90","","90","","2752.4","0.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C25 H27 Cl2 N O1.5 P Pd -","- C25 H27 Cl2 N O1.5 P Pd -","- C100 H108 Cl8 N4 O6 P4 Pd4 -","4","1","","Wen-Qiong Wu; Qian Peng; Da-Xuan Dong; Xue-Long Hou; Yun-Dong Wu","A Dramatic Switch of Enantioselectivity in Asymmetric Heck Reaction by Benzylic Substituents of Ligands","Journal of the American Chemical Society","2008","130","","9717","9725","10.1021/ja7104174","","","0.71073","MoKα","","0.0556","0.0449","","","0.1156","0.1197","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108096","10.2217","0.001","15.7882","0.0015","16.2334","0.0015","90","","90","","90","","2619.8","0.4","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C27 H30 Cl2 N O P Pd -","- C27 H30 Cl2 N O P Pd -","- C108 H120 Cl8 N4 O4 P4 Pd4 -","4","1","","Wen-Qiong Wu; Qian Peng; Da-Xuan Dong; Xue-Long Hou; Yun-Dong Wu","A Dramatic Switch of Enantioselectivity in Asymmetric Heck Reaction by Benzylic Substituents of Ligands","Journal of the American Chemical Society","2008","130","","9717","9725","10.1021/ja7104174","","","0.71073","MoKα","","0.0867","0.0488","","","0.0635","0.0713","","","","","","0.794","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108097","40.173","0.002","40.173","0.002","7.1602","0.0006","90","","90","","120","","10007.5","1.1","153","2","153","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H12 N O2 S4 -","- C24 H12 N O2 S4 -","- C432 H216 N18 O36 S72 -","18","1","","Joseph A. Letizia; Michael R. Salata; Caitlin M. Tribout; Antonio Facchetti; Mark A. Ratner; Tobin J. Marks","n-Channel Polymers by Design: Optimizing the Interplay of Solubilizing Substituents, Crystal Packing, and Field-Effect Transistor Characteristics in Polymeric Bithiophene-Imide Semiconductors","Journal of the American Chemical Society","2008","130","","9679","9694","10.1021/ja710815a","","","0.71073","MoKα","","0.0856","0.0692","","","0.1971","0.2132","","","","","","1.069","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108098","16.2706","0.0015","9.196","0.008","22.721","0.002","90","","94.146","0.002","90","","3391","3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H114 O8 S2 -","- C72 H114 O8 S2 -","- C144 H228 O16 S4 -","2","0.5","","Christian B. Nielsen; Alex Angerhofer; Khalil A. Abboud; John R. Reynolds","Discrete Photopatternable π-Conjugated Oligomers for Electrochromic Devices","Journal of the American Chemical Society","2008","130","","9734","9746","10.1021/ja7112273","","","0.71073","MoKα","","0.1108","0.0641","","","0.1464","0.1681","","","","","","1.004","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108099","10.3264","0.0009","5.9833","0.0005","16.681","0.0015","90","","92.386","0.002","90","","1029.76","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 O4 S2 -","- C24 H22 O4 S2 -","- C48 H44 O8 S4 -","2","0.5","","Christian B. Nielsen; Alex Angerhofer; Khalil A. Abboud; John R. Reynolds","Discrete Photopatternable π-Conjugated Oligomers for Electrochromic Devices","Journal of the American Chemical Society","2008","130","","9734","9746","10.1021/ja7112273","","","0.71073","MoKα","","0.0478","0.0373","","","0.0897","0.094","","","","","","1.075","","","","has coordinates","178826","2020-10-21","18:00:00",""
"4108100","10.223","0.003","10.223","0.003","14.493","0.005","90","","90","","90","","1514.7","0.8","293","2","293","2","","","","","","","","4","P 43 2 2","P 4cw 2c","95","","","","- C9 H5 O7 Y -","- C9 H3 O7 Y -","- C36 H12 O28 Y4 -","4","0.5","","Junhua Luo; Hongwu Xu; Yun Liu; Yusheng Zhao; Luke L. Daemen; Craig Brown; Tatiana V. Timofeeva; Shengqian Ma; Hong-Cai Zhou","Hydrogen Adsorption in a Highly Stable Porous Rare-Earth Metal-Organic Framework: Sorption Properties and Neutron Diffraction Studies","Journal of the American Chemical Society","2008","130","","9626","9627","10.1021/ja801411f","","","0.71073","MoKα","","0.0818","0.0773","","","0.193","0.1976","","","","","","1.099","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108101","37.4329","0.0014","19.7762","0.0008","18.5622","0.0007","90","","90","","90","","13741.2","0.9","100","","100","","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C24 H26 Ga10 N4 S16 -","- C24 H26 Ga10 N4 S16 -","- C192 H208 Ga80 N32 S128 -","8","1","","Paz Vaqueiro; M. Lucia Romero","Gallium-Sulfide Supertetrahedral Clusters as Building Blocks of Covalent Organic-Inorganic Networks","Journal of the American Chemical Society","2008","130","","9630","9631","10.1021/ja801619e","","","0.71073","MoKα","","0.1341","0.0424","","0.1155","0.0448","0.0448","","","","","","1.0998","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108102","12.4678","0.0012","13.6806","0.0013","20.385","0.002","81.599","0.006","88.542","0.005","82.967","0.005","3413.7","0.6","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H24 Ga10 N4 S16 -","- C25 H24 Ga10 N4 S16 -","- C50 H48 Ga20 N8 S32 -","2","1","","Paz Vaqueiro; M. Lucia Romero","Gallium-Sulfide Supertetrahedral Clusters as Building Blocks of Covalent Organic-Inorganic Networks","Journal of the American Chemical Society","2008","130","","9630","9631","10.1021/ja801619e","","","0.71073","MoKα","","0.1086","0.0636","","0.1552","0.0788","0.0788","","","","","","1.0767","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108103","7.242","0.002","13.408","0.004","17.835","0.005","90","","90","","90","","1731.8","0.9","208","2","208","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H6 Mn N O3 -","- C8 H6 Mn N O3 -","- C64 H48 Mn8 N8 O24 -","8","1","","Derek R. Laws; Daesung Chong; Karen Nash; Arnold L. Rheingold; William E. Geiger","Cymantrene Radical Cation Family: Spectral and Structural Characterization of the Half-Sandwich Analogues of Ferrocenium Ion","Journal of the American Chemical Society","2008","130","","9859","9870","10.1021/ja801930q","","","0.71073","MoKα","","0.04","0.0287","","","0.0679","0.0738","","","","","","1.049","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108104","16.467","0.002","11.6868","0.0017","18.85","0.003","90","","90","","90","","3627.6","0.9","208","2","208","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C37 H15 B F20 Mn O3 -","- C37 H15 B F20 Mn O3 -","- C148 H60 B4 F80 Mn4 O12 -","4","1","","Derek R. Laws; Daesung Chong; Karen Nash; Arnold L. Rheingold; William E. Geiger","Cymantrene Radical Cation Family: Spectral and Structural Characterization of the Half-Sandwich Analogues of Ferrocenium Ion","Journal of the American Chemical Society","2008","130","","9859","9870","10.1021/ja801930q","","","0.71073","MoKα","","0.0501","0.0429","","","0.1045","0.1109","","","","","","1.055","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108105","11.1365","0.0008","11.5717","0.0008","14.7086","0.001","101.326","0.001","111.616","0.001","102.739","0.001","1636.3","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H14 B F20 Mn N O7 -","- C32 H6 B F20 Mn N O3 -","- C64 H12 B2 F40 Mn2 N2 O6 -","2","1","","Derek R. Laws; Daesung Chong; Karen Nash; Arnold L. Rheingold; William E. Geiger","Cymantrene Radical Cation Family: Spectral and Structural Characterization of the Half-Sandwich Analogues of Ferrocenium Ion","Journal of the American Chemical Society","2008","130","","9859","9870","10.1021/ja801930q","","","0.71073","MoKα","","0.0603","0.0462","","","0.1099","0.1169","","","","","","1.062","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108106","12.213","0.003","12.858","0.003","17.607","0.004","98.337","0.004","95.007","0.004","100.011","0.004","2676","1.1","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H75 Cl2 Fe7 P5 S6 -","- C30 H75 Cl2 Fe7 P5 S6 -","- C60 H150 Cl4 Fe14 P10 S12 -","2","1","","Liang Deng; R. H. Holm","Stabilization of Fully Reduced Iron-Sulfur Clusters by Carbene Ligation: The [FenSn]0 Oxidation Levels (n= 4, 8)","Journal of the American Chemical Society","2008","130","","9878","9886","10.1021/ja802111w","","","0.71073","MoKα","","0.0618","0.0504","","","0.1396","0.1476","","","","","","0.982","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108107","11.7881","0.0007","14.1107","0.0008","15.45","0.0008","106.468","0.001","95.791","0.001","92.206","0.001","2445.9","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H120 Fe8 N12 S8 -","- C66 H120 Fe8 N12 S8 -","- C66 H120 Fe8 N12 S8 -","1","0.5","","Liang Deng; R. H. Holm","Stabilization of Fully Reduced Iron-Sulfur Clusters by Carbene Ligation: The [FenSn]0 Oxidation Levels (n= 4, 8)","Journal of the American Chemical Society","2008","130","","9878","9886","10.1021/ja802111w","","","0.71073","MoKα","","0.0711","0.0511","","","0.1892","0.2027","","","","","","1.113","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108108","14.47","0.002","20.703","0.004","18.767","0.003","90","","96.635","0.002","90","","5584.4","1.6","193","2","193","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C44 H80 Fe4 N8 S4 -","- C44 H80 Fe4 N8 S4 -","- C176 H320 Fe16 N32 S16 -","4","1","","Liang Deng; R. H. Holm","Stabilization of Fully Reduced Iron-Sulfur Clusters by Carbene Ligation: The [FenSn]0 Oxidation Levels (n= 4, 8)","Journal of the American Chemical Society","2008","130","","9878","9886","10.1021/ja802111w","","","0.71073","MoKα","","0.0255","0.0251","","","0.0663","0.0666","","","","","","1.035","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108109","9.5783","0.0011","11.7012","0.0014","17.972","0.002","90","","98.878","0.002","90","","1990.1","0.4","233","2","233","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H28 B9 Ga N -","- C13 H28 B9 Ga N -","- C52 H112 B36 Ga4 N4 -","4","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.1445","0.1011","","","0.2514","0.2928","","","","","","1.028","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108110","19.109","0.007","7.275","0.003","11.101","0.004","90","","90","","90","","1543.2","1","233","2","233","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C7 H24 Al B9 N -","- C7 H25 Al B9 N -","- C28 H100 Al4 B36 N4 -","4","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.1452","0.0794","","","0.1959","0.2294","","","","","","1.083","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108111","8.525","0.004","10.739","0.005","14.128","0.006","97.602","0.01","101.047","0.009","91.297","0.01","1256.8","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H37 Al B9 N -","- C21 H37 Al B9 N -","- C42 H74 Al2 B18 N2 -","2","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.1418","0.0591","","","0.1538","0.1988","","","","","","0.962","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108112","8.524","0.01","9.517","0.012","14.591","0.019","101.15","0.03","95.1","0.03","95.52","0.03","1149","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H33 Al B9 N -","- C20 H33 Al B9 N -","- C40 H66 Al2 B18 N2 -","2","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.2808","0.078","","","0.1542","0.2158","","","","","","0.736","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108113","11.8146","0.0008","13.8235","0.001","13.9164","0.001","90","","99.787","0.002","90","","2239.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H31 B9 Ga N -","- C19 H31 B9 Ga N -","- C76 H124 B36 Ga4 N4 -","4","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.1091","0.0501","","","0.1185","0.1407","","","","","","1.035","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108114","7.2048","0.001","16.46","0.002","11.8821","0.0016","90","","96.673","0.003","90","","1399.6","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H21 Al B9 N -","- C6 H21 Al B9 N -","- C24 H84 Al4 B36 N4 -","4","2","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.12","0.0579","","","0.1392","0.1658","","","","","","0.994","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108115","7.8871","0.0009","15.6252","0.0019","12.3519","0.0015","90","","92.013","0.003","90","","1521.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H23 Al B9 N -","- C7 H23 Al B9 N -","- C28 H92 Al4 B36 N4 -","4","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.1351","0.0662","","","0.1758","0.2109","","","","","","1.053","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108116","18.77","0.004","12.377","0.003","18.571","0.004","90","","109.212","0.004","90","","4074.1","1.6","233","2","233","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H56 Al2 B18 N2 -","- C30 H56 Al2 B18 N2 -","- C120 H224 Al8 B72 N8 -","4","1","","Jong-Dae Lee; Sung-Kwan Kim; Tae-Jin Kim; Won-Sik Han; Young-Joo Lee; Dae-Hwan Yoo; Minserk Cheong; Jaejung Ko; Sang Ook Kang","Dicarbollylamine Ligand as a Tunable Template for σ,σ- and π,σ-Bonding Modes: Syntheses, Structures, and Theoretical Studies of η5:η1-Coordinated Constrained-Geometry Group 13 Metal Complexes","Journal of the American Chemical Society","2008","130","","9904","9917","10.1021/ja802163q","","","0.71073","MoKα","","0.2688","0.1034","","","0.2426","0.3404","","","","","","0.913","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108117","10.6989","0.0007","11.4137","0.0007","12.2625","0.0008","74.158","0.006","76.395","0.006","83.4","0.005","1398.07","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H44 Ge K N O2 -","- C25 H44 Ge K N O2 -","- C50 H88 Ge2 K2 N2 O4 -","2","1","","Wenyuan Wang; Shenglai Yao; Christoph van Wüllen; Matthias Driess","A Cyclopentadienide Analogue Containing Divalent Germanium and a Heavy Cyclobutadiene-like Dianion with an Unusual Ge4 Core","Journal of the American Chemical Society","2008","130","","9640","9641","10.1021/ja802502b","","","0.71073","MoKα","","0.0538","0.0328","","","0.0638","0.0666","","","","","","0.94","","","","has coordinates","273129","2022-02-23","10:11:33",""
"4108118","9.1129","0.0006","11.3531","0.0007","19.0282","0.001","100.36","0.005","101.854","0.005","98.627","0.005","1859.2","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H59 Ge N3 -","- C41 H59 Ge N3 -","- C82 H118 Ge2 N6 -","2","1","","Wenyuan Wang; Shenglai Yao; Christoph van Wüllen; Matthias Driess","A Cyclopentadienide Analogue Containing Divalent Germanium and a Heavy Cyclobutadiene-like Dianion with an Unusual Ge4 Core","Journal of the American Chemical Society","2008","130","","9640","9641","10.1021/ja802502b","","","0.71073","MoKα","","0.0853","0.0399","","","0.0513","0.0566","","","","","","0.785","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108119","12.37","0.003","14.8433","0.0014","18.8725","0.0019","90","","96.311","0.014","90","","3444.2","1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C66 H100 Ge4 K2 N4 O2 -","- C66 H100 Ge4 K2 N4 O2 -","- C132 H200 Ge8 K4 N8 O4 -","2","0.5","","Wenyuan Wang; Shenglai Yao; Christoph van Wüllen; Matthias Driess","A Cyclopentadienide Analogue Containing Divalent Germanium and a Heavy Cyclobutadiene-like Dianion with an Unusual Ge4 Core","Journal of the American Chemical Society","2008","130","","9640","9641","10.1021/ja802502b","","","0.71073","MoKα","","0.0878","0.0429","","","0.0802","0.0885","","","","","","0.914","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108120","10.8466","0.0004","14.5211","0.0005","12.6067","0.0004","90","","109.175","0.002","90","","1875.45","0.11","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 O -","- C24 H28 O -","- C96 H112 O4 -","4","1","","Yu-Jun Zhao; Teck-Peng Loh","Bioinspired Polyene Cyclization Promoted by Intermolecular Chiral Acetal-SnCl4 or Chiral N-Acetal-TiCl4: Investigation of the Mechanism and Identification of the Key Intermediates","Journal of the American Chemical Society","2008","130","","10024","10029","10.1021/ja802896n","","","0.71073","MoKα","","0.0593","0.0459","","","0.1231","0.1335","","","","","","1.037","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108121","19.423","0.002","10.0634","0.0013","30.456","0.004","90","","94.994","0.004","90","","5930.4","1.3","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H41 N O3 S -","- C33 H41 N O3 S -","- C264 H328 N8 O24 S8 -","8","1","","Yu-Jun Zhao; Teck-Peng Loh","Bioinspired Polyene Cyclization Promoted by Intermolecular Chiral Acetal-SnCl4 or Chiral N-Acetal-TiCl4: Investigation of the Mechanism and Identification of the Key Intermediates","Journal of the American Chemical Society","2008","130","","10024","10029","10.1021/ja802896n","","","0.71073","MoKα","","0.1287","0.0775","","","0.2118","0.2494","","","","","","1.056","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108122","9.7288","0.0004","13.1736","0.0005","15.5623","0.0006","90","","90","","90","","1994.52","0.14","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H29 N O -","- C24 H29 N O -","- C96 H116 N4 O4 -","4","1","","Yu-Jun Zhao; Teck-Peng Loh","Bioinspired Polyene Cyclization Promoted by Intermolecular Chiral Acetal-SnCl4 or Chiral N-Acetal-TiCl4: Investigation of the Mechanism and Identification of the Key Intermediates","Journal of the American Chemical Society","2008","130","","10024","10029","10.1021/ja802896n","","","0.71073","MoKα","","0.0548","0.0484","","","0.1187","0.1262","","","","","","1.076","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108123","10.1814","0.0003","10.5773","0.0004","10.8061","0.0003","82.344","0.002","70.265","0.001","61.284","0.002","960.06","0.06","173","2","173","2","","","","","","","","5","P 1","P 1","1","","","","- C22 H21 N O3 S -","- C22 H21 N O3 S -","- C44 H42 N2 O6 S2 -","2","2","","Yu-Jun Zhao; Teck-Peng Loh","Bioinspired Polyene Cyclization Promoted by Intermolecular Chiral Acetal-SnCl4 or Chiral N-Acetal-TiCl4: Investigation of the Mechanism and Identification of the Key Intermediates","Journal of the American Chemical Society","2008","130","","10024","10029","10.1021/ja802896n","","","0.71073","MoKα","","0.0507","0.0401","","","0.0857","0.0987","","","","","","1.032","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108124","9.6179","0.0004","10.9147","0.0004","18.6004","0.0006","90","","90","","90","","1952.6","0.13","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H21 N O3 S -","- C23 H21 N O3 S -","- C92 H84 N4 O12 S4 -","4","1","","Yu-Jun Zhao; Teck-Peng Loh","Bioinspired Polyene Cyclization Promoted by Intermolecular Chiral Acetal-SnCl4 or Chiral N-Acetal-TiCl4: Investigation of the Mechanism and Identification of the Key Intermediates","Journal of the American Chemical Society","2008","130","","10024","10029","10.1021/ja802896n","","","0.71073","MoKα","","0.0437","0.0373","","","0.091","0.096","","","","","","1.034","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108125","7.8528","0.0004","8.0068","0.0004","24.7105","0.0013","90","","90","","90","","1553.69","0.14","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H17 N O3 S -","- C17 H17 N O3 S -","- C68 H68 N4 O12 S4 -","4","1","","Yu-Jun Zhao; Teck-Peng Loh","Bioinspired Polyene Cyclization Promoted by Intermolecular Chiral Acetal-SnCl4 or Chiral N-Acetal-TiCl4: Investigation of the Mechanism and Identification of the Key Intermediates","Journal of the American Chemical Society","2008","130","","10024","10029","10.1021/ja802896n","","","0.71073","MoKα","","0.0669","0.0547","","","0.1433","0.1663","","","","","","1.091","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108126","7.2273","0.0011","9.3866","0.0014","10.973","0.0016","90","","96.481","0.002","90","","739.65","0.19","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H14 I N O -","- C16 H14 I N O -","- C32 H28 I2 N2 O2 -","2","1","","Donna K. Friel; Marc L. Snapper; Amir H. Hoveyda","Aluminum-Catalyzed Asymmetric Alkylations of Pyridyl-Substituted Alkynyl Ketones with Dialkylzinc Reagents","Journal of the American Chemical Society","2008","130","","9942","9951","10.1021/ja802935w","","","0.71073","MoKα","","0.0269","0.0252","","","0.0581","0.0589","","","","","","1.063","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108127","9.3494","0.0002","9.6354","0.0002","13.2387","0.0003","90","","90","","90","","1192.61","0.04","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 N O -","- C15 H13 N O -","- C60 H52 N4 O4 -","4","1","","Donna K. Friel; Marc L. Snapper; Amir H. Hoveyda","Aluminum-Catalyzed Asymmetric Alkylations of Pyridyl-Substituted Alkynyl Ketones with Dialkylzinc Reagents","Journal of the American Chemical Society","2008","130","","9942","9951","10.1021/ja802935w","","","1.54178","CuKα","","0.0262","0.026","","","0.0663","0.0666","","","","","","1.085","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108128","24.8817","0.0008","24.8817","0.0008","24.8817","0.0008","90","","90","","90","","15404.2","0.9","298","2","298","2","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","","","- C75 H96 S3 -","- C75 H96 S3 -","- C600 H768 S24 -","8","0.333333","","Jin-Liang Wang; Jing Yan; Zheng-Ming Tang; Qi Xiao; Yuguo Ma; Jian Pei","Gradient Shape-Persistent π-Conjugated Dendrimers for Light-Harvesting: Synthesis, Photophysical Properties, and Energy Funneling","Journal of the American Chemical Society","2008","130","","9952","9962","10.1021/ja803109r","","","0.71073","MoKα","","0.1615","0.0689","","","0.1704","0.1964","","","","","","0.96","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108129","10.5437","0.0008","10.5437","0.0008","26.876","0.002","90","","90","","90","","2987.8","0.4","150","2","150","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C62 H50 Cl4 N20 O Ru5 -","- C62 H48 Cl4 N20 O Ru5 -","- C124 H96 Cl8 N40 O2 Ru10 -","2","0.125","","Caixia Yin; Gin-Chen Huang; Ching-Kuo Kuo; Ming-Dung Fu; Hao-Cheng Lu; Jhih-Hong Ke; Kai-Neng Shih; Yi-Lin Huang; Gene-Hsiang Lee; Chen-Yu Yeh; Chun-hsien Chen; Shie-Ming Peng","Extended Metal-Atom Chains with an Inert Second Row Transition Metal: [Ru5(μ5-tpda)4X2] (tpda2-= tripyridyldiamido dianion, X = Cl and NCS)","Journal of the American Chemical Society","2008","130","","10090","10092","10.1021/ja8016818","","","0.71073","MoKα","","0.1006","0.0808","","","0.2408","0.2577","","","","","","1.078","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108130","10.533","0.0007","10.533","0.0007","26.1558","0.0017","90","","90","","90","","2901.8","0.3","150","2","150","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C62 H44 N22 Ru5 S2 -","- C62 H44 N22 Ru5 S2 -","- C124 H88 N44 Ru10 S4 -","2","0.125","","Caixia Yin; Gin-Chen Huang; Ching-Kuo Kuo; Ming-Dung Fu; Hao-Cheng Lu; Jhih-Hong Ke; Kai-Neng Shih; Yi-Lin Huang; Gene-Hsiang Lee; Chen-Yu Yeh; Chun-hsien Chen; Shie-Ming Peng","Extended Metal-Atom Chains with an Inert Second Row Transition Metal: [Ru5(μ5-tpda)4X2] (tpda2-= tripyridyldiamido dianion, X = Cl and NCS)","Journal of the American Chemical Society","2008","130","","10090","10092","10.1021/ja8016818","","","0.71073","MoKα","","0.1069","0.0834","","","0.2539","0.2791","","","","","","1.054","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108131","21.6686","0.0007","27.6614","0.0012","11.7069","0.0003","90","","91.697","0.002","90","","7013.8","0.4","150","2","150","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C100 H116 Cl29 N20 O16 Ru9 -","- C100 H116 Cl29 N20 O16 Ru9 -","- C200 H232 Cl58 N40 O32 Ru18 -","2","0.25","","Caixia Yin; Gin-Chen Huang; Ching-Kuo Kuo; Ming-Dung Fu; Hao-Cheng Lu; Jhih-Hong Ke; Kai-Neng Shih; Yi-Lin Huang; Gene-Hsiang Lee; Chen-Yu Yeh; Chun-hsien Chen; Shie-Ming Peng","Extended Metal-Atom Chains with an Inert Second Row Transition Metal: [Ru5(μ5-tpda)4X2] (tpda2-= tripyridyldiamido dianion, X = Cl and NCS)","Journal of the American Chemical Society","2008","130","","10090","10092","10.1021/ja8016818","","","0.71073","MoKα","","0.0915","0.0634","","","0.1676","0.1931","","","","","","1.059","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108132","5.19","0.002","17.154","0.006","10.861","0.004","90","","90.83","0.03","90","","966.8","0.6","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H4 Au2 F10 N2 -","- C20 H4 Au2 F10 N2 -","- C40 H8 Au4 F20 N4 -","2","0.5","","Hajime Ito; Tomohisa Saito; Naoya Oshima; Noboru Kitamura; Shoji Ishizaka; Yukio Hinatsu; Makoto Wakeshima; Masako Kato; Kiyoshi Tsuge; Masaya Sawamura","Reversible Mechanochromic Luminescence of [(C6F5Au)2(μ-1,4-Diisocyanobenzene)]","Journal of the American Chemical Society","2008","130","","10044","10045","10.1021/ja8019356","","","0.7107","MoKα","","","0.0355","","","","0.0976","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108133","14.4141","0.0007","15.6207","0.0008","17.4973","0.0009","73.652","0.001","79.656","0.001","62.921","0.001","3359.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C77 H61 B F20 Hf N2 -","- C63 H45 B F20 Hf N2 -","- C126 H90 B2 F40 Hf2 N4 -","2","1","","Cristiano Zuccaccia; Alceo Macchioni; Vincenzo Busico; Roberta Cipullo; Giovanni Talarico; Francesca Alfano; Harold W. Boone; Kevin A. Frazier; Phillip D. Hustad; James C. Stevens; Paul C. Vosejpka; Khalil A. Abboud","Intra- and Intermolecular NMR Studies on the Activation of Arylcyclometallated Hafnium Pyridyl-Amido Olefin Polymerization Precatalysts","Journal of the American Chemical Society","2008","130","","10354","10368","10.1021/ja802072n","","","0.71073","MoKα","","0.0294","0.0251","","","0.0629","0.0639","","","","","","0.99","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108134","14.406","0.002","12.042","0.002","14.641","0.002","90","","117.741","0.004","90","","2247.9","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","[(C2H5)4N][C(NH2)3]7[3(CO3)][C3N2H2(COO)2]","","","- C23 H64 N24 O13 -","- C23 H64 N24 O13 -","- C46 H128 N48 O26 -","2","1","","Jie Han; Chung-Wah Yau; Chi-Keung Lam; Thomas C. W. Mak","Designed Supramolecular Assembly of Hydrogen-Bonded Anionic Rosette Layers","Journal of the American Chemical Society","2008","130","","10315","10326","10.1021/ja802425q","","","0.71073","MoKα","","0.1559","0.0627","","","0.1313","0.1646","","","","","","1.053","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108135","16.024","0.006","13.854","0.005","11.651","0.004","90","","90","","90","","2586.5","1.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","[(C3H7)4N][C(NH2)3]CO3[B(OH)3]2","","","- C14 H40 B2 N4 O9 -","- C14 H40 B2 N4 O9 -","- C56 H160 B8 N16 O36 -","4","0.5","","Jie Han; Chung-Wah Yau; Chi-Keung Lam; Thomas C. W. Mak","Designed Supramolecular Assembly of Hydrogen-Bonded Anionic Rosette Layers","Journal of the American Chemical Society","2008","130","","10315","10326","10.1021/ja802425q","","","0.71073","MoKα","","0.1214","0.0688","","","0.2183","0.2621","","","","","","1.093","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108136","16.057","0.002","16.991","0.002","19.045","0.002","90","","90","","90","","5195.9","1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","[(C4H9)4N][C(NH2)3][C4O2S2]","","","- C21 H42 N4 O2 S2 -","- C21 H42 N4 O2 S2 -","- C168 H336 N32 O16 S16 -","8","1","","Jie Han; Chung-Wah Yau; Chi-Keung Lam; Thomas C. W. Mak","Designed Supramolecular Assembly of Hydrogen-Bonded Anionic Rosette Layers","Journal of the American Chemical Society","2008","130","","10315","10326","10.1021/ja802425q","","","0.71073","MoKα","","0.1273","0.0552","","","0.1513","0.2096","","","","","","1.007","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108137","13.121","0.004","10.154","0.003","20.248","0.006","90","","95.209","0.007","90","","2686.5","1.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","[(C2H5)4N][C(NH2)3][(C6H3)2(COOH)2(COO)]","","","- C50 H68 N8 O16 -","- C50 H48 N8 O16 -","- C100 H96 N16 O32 -","2","1","","Jie Han; Chung-Wah Yau; Chi-Keung Lam; Thomas C. W. Mak","Designed Supramolecular Assembly of Hydrogen-Bonded Anionic Rosette Layers","Journal of the American Chemical Society","2008","130","","10315","10326","10.1021/ja802425q","","","0.71073","MoKα","","0.1177","0.0668","","","0.1834","0.2139","","","","","","1.002","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108138","12.2393","0.0017","15.769","0.002","16.204","0.002","90","","101.315","0.003","90","","3066.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[(C3H7)4N][C(NH2)3][(C6H3)2(COOH)2(COO)2]","","","- C29 H42 N4 O8 -","- C29 H42 N4 O8 -","- C116 H168 N16 O32 -","4","1","","Jie Han; Chung-Wah Yau; Chi-Keung Lam; Thomas C. W. Mak","Designed Supramolecular Assembly of Hydrogen-Bonded Anionic Rosette Layers","Journal of the American Chemical Society","2008","130","","10315","10326","10.1021/ja802425q","","","0.71073","MoKα","","0.0979","0.0474","","","0.1083","0.1373","","","","","","1.002","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108139","11.5638","0.0006","13.8887","0.0008","18.3931","0.0011","82.969","0.0016","73.271","0.0014","75.505","0.0015","2734.9","0.3","183.1","","","","","","","","","","","6","P 1","P 1","1","","","","- C69 H62 Cl2 Ir N2 O5 -","- C68.5 H56 Cl Ir N2 O5 -","- C137 H112 Cl2 Ir2 N4 O10 -","2","2","","Hidehiro Suematsu; Shigefumi Kanchiku; Tatsuya Uchida; Tsutomu Katsuki","Construction of Aryliridium-Salen Complexes: Enantio- and Cis-Selective Cyclopropanation of Conjugated and Nonconjugated Olefins","Journal of the American Chemical Society","2008","130","","10327","10337","10.1021/ja802561t","","","0.71075","MoKα","","","0.0475","","","","0.1398","","","","","","0.978","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108140","17.1972","0.0004","9.7664","0.0003","20.8704","0.0005","90","","90","","90","","3505.28","0.16","296.1","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C10 H10 Cl14 Mo6 N2 O8 -","- C10 H10 Cl14 Mo6 N2 O8 -","- C40 H40 Cl56 Mo24 N8 O32 -","4","1","","Kei Inumaru; Takashi Kikudome; Hiroshi Fukuoka; Shoji Yamanaka","Reversible Emergence of a Self-Assembled Layered Structure From Three-Dimensional Isotropic Ionic Crystal of a Cluster Compound (4-HNC5H4OH)2Mo6Cl14 Driven By Absorption of Water and Alcohols","Journal of the American Chemical Society","2008","130","","10038","10039","10.1021/ja802752y","","","0.71069","MoKα","","","0.0407","","","","0.048","","","","","","2.704","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108141","8.9148","0.0004","9.6561","0.0005","17.6885","0.0007","90","","94.7019","0.0011","90","","1517.54","0.12","296.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl14 Mo6 N2 O2 -","- C10 H10 Cl14 Mo6 N2 O2 -","- C20 H20 Cl28 Mo12 N4 O4 -","2","0.5","","Kei Inumaru; Takashi Kikudome; Hiroshi Fukuoka; Shoji Yamanaka","Reversible Emergence of a Self-Assembled Layered Structure From Three-Dimensional Isotropic Ionic Crystal of a Cluster Compound (4-HNC5H4OH)2Mo6Cl14 Driven By Absorption of Water and Alcohols","Journal of the American Chemical Society","2008","130","","10038","10039","10.1021/ja802752y","","","0.71075","MoKα","","","0.0304","","","","0.0519","","","","","","3.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108142","10.0089","0.0003","13.3937","0.0004","21.0503","0.0007","90","","99.197","0.003","90","","2785.65","0.15","193","2","193","2","","","","","","","chemical synthesis","7","P 1 21/n 1","-P 2yn","14","TF04054","(Benzo[h]quinolinato){(2-nitrophenyl-sulfonyl)[(2-(pyridine-2-yl)phenyl] amido}-difluoropalladium(IV) Acetonitrile Solvate","","- C32 H23 F2 N5 O4 Pd S -","- C32 H23 F2 N5 O4 Pd S -","- C128 H92 F8 N20 O16 Pd4 S4 -","4","1","","Takeru Furuya; Tobias Ritter","Carbon-Fluorine Reductive Elimination from a High-Valent Palladium Fluoride","Journal of the American Chemical Society","2008","130","","10060","10061","10.1021/ja803187x","","","0.71073","MoKα","","0.0728","0.0383","","","0.0703","0.0829","","","","","","1.042","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108143","20.517","0.003","8.353","0.002","19.928","0.003","90","","90","","90","","3415.2","1.1","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C18 H36 Cl9 Cr3 N4 O2 -","- C18 H36 Cl9 Cr3 N4 O2 -","- C72 H144 Cl36 Cr12 N16 O8 -","4","0.5","","Bert Mallick; Harald Kierspel; Anja-Verena Mudring","(CrCl3)3@2[C4mim][OMe]- Molecular Cluster-Type Chromium(III) Chloride Stabilized in a Salt Matrix","Journal of the American Chemical Society","2008","130","","10068","10069","10.1021/ja803322k","","","0.71073","MoKα","","0.1384","0.045","","","0.0849","0.1045","","","","","","0.693","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108144","34.8354","0.0004","8.90027","0.00015","9.35124","0.00008","90","","93.8815","0.001","90","","2892.65","0.06","173","2","173","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C29 H36 O13 -","- C29 H36 O13 -","- C116 H144 O52 -","4","1","","Ismael Navarro; Jean-François Basset; Séverine Hebbe; Sarah M. Major; Thomas Werner; Catherine Howsham; Jan Bräckow; Anthony G. M. Barrett","Biomimetic Synthesis of Resorcylate Natural Products Utilizing Late Stage Aromatization: Concise Total Syntheses of the Marine Antifungal Agents 15G256ι and 15G256β","Journal of the American Chemical Society","2008","130","","10293","10298","10.1021/ja803445u","","","1.54184","CuKα","","0.0394","0.0283","","","0.0644","0.0675","","","","","","0.915","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108145","27.5603","0.0018","9.3418","0.0005","15.5154","0.001","90","","103.102","0.0019","90","","3890.6","0.4","153.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 O5 Si2 -","- C18 O5 Si2 -","- C144 O40 Si16 -","8","1","","Hongzhi Liu; Shin-ichi Kondo; Nobuhiro Takeda; Masafumi Unno","Synthesis of Octacarboxy Spherosilicate","Journal of the American Chemical Society","2008","130","","10074","10075","10.1021/ja803513n","","","0.7107","MoKα","","","0.064","","","","0.1266","","","","","","3.496","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108146","15.359","0.003","12.065","0.002","14.452","0.003","90","","90","","90","","2678","0.9","100","2","100","2","","","","","","","","6","P c a 21","P 2c -2ac","29","rlh2044","","","- C26 H33 Co O8 S Si -","- C26 H33 Co O8 S Si -","- C104 H132 Co4 O32 S4 Si4 -","4","1","","Holland, Ryan L.; Bunker, Kevin D.; Chen, Christopher H.; DiPasquale, Antonio G.; Rheingold, Arnold L.; Baldridge, Kim K.; O'Connor, Joseph M.","Reactions of a Metallacyclobutene Complex with Alkenes","Journal of the American Chemical Society","2008","130","31","10093","10095","10.1021/ja803701z","","","0.71073","MoKα","","0.0577","0.0458","","","0.0916","0.0982","","","","","","1.019","","","","has coordinates","278042","2022-09-21","13:02:35",""
"4108147","8.505","0.0007","22.626","0.0018","14.239","0.0011","90","","94.922","0.001","90","","2730","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","6-ZZ","","","- C26 H33 Co O8 S Si -","- C26 H33 Co O8 S Si -","- C104 H132 Co4 O32 S4 Si4 -","4","1","","Holland, Ryan L.; Bunker, Kevin D.; Chen, Christopher H.; DiPasquale, Antonio G.; Rheingold, Arnold L.; Baldridge, Kim K.; O'Connor, Joseph M.","Reactions of a Metallacyclobutene Complex with Alkenes","Journal of the American Chemical Society","2008","130","31","10093","10095","10.1021/ja803701z","","","0.71073","MoKα","","0.0273","0.0261","","","0.0695","0.0703","","","","","","1.037","","","","has coordinates","219215","2020-10-21","18:00:00",""
"4108148","9.216","0.0004","11.216","0.0005","13.522","0.0009","101.39","0.001","101.14","0.001","112.029","0.001","1213.98","0.11","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H27 Co N2 O4 S Si -","- C24 H27 Co N2 O4 S Si -","- C48 H54 Co2 N4 O8 S2 Si2 -","2","1","","Holland, Ryan L.; Bunker, Kevin D.; Chen, Christopher H.; DiPasquale, Antonio G.; Rheingold, Arnold L.; Baldridge, Kim K.; O'Connor, Joseph M.","Reactions of a Metallacyclobutene Complex with Alkenes","Journal of the American Chemical Society","2008","130","31","10093","10095","10.1021/ja803701z","","","0.71073","MoKα","","0.0393","0.0299","","","0.0673","0.072","","","","","","1.028","","","","has coordinates","219215","2020-10-21","18:00:00",""
"4108149","14.884","0.002","11.4118","0.0018","15.75","0.002","90","","98.671","0.002","90","","2644.6","0.6","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","8-ZE","","","- C26 H32 Co N O6 S Si -","- C26 H32 Co N O6 S Si -","- C104 H128 Co4 N4 O24 S4 Si4 -","4","1","","Holland, Ryan L.; Bunker, Kevin D.; Chen, Christopher H.; DiPasquale, Antonio G.; Rheingold, Arnold L.; Baldridge, Kim K.; O'Connor, Joseph M.","Reactions of a Metallacyclobutene Complex with Alkenes","Journal of the American Chemical Society","2008","130","31","10093","10095","10.1021/ja803701z","","","0.71073","MoKα","","0.0479","0.033","","","0.0757","0.0817","","","","","","0.984","","","","has coordinates","219215","2020-10-21","18:00:00",""
"4108150","11.309","0.002","11.898","0.004","17.955","0.005","90","0.004","91.096","0.004","90","0.004","2415.5","1.1","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","9-exo","","","- C24 H27 Co O7 S Si -","- C24 H27 Co O7 S Si -","- C96 H108 Co4 O28 S4 Si4 -","4","1","","Holland, Ryan L.; Bunker, Kevin D.; Chen, Christopher H.; DiPasquale, Antonio G.; Rheingold, Arnold L.; Baldridge, Kim K.; O'Connor, Joseph M.","Reactions of a Metallacyclobutene Complex with Alkenes","Journal of the American Chemical Society","2008","130","31","10093","10095","10.1021/ja803701z","","","0.71073","MoKα","","0.0305","0.0277","","","0.0736","0.0758","","","","","","1.029","","","","has coordinates","219215","2020-10-21","18:00:00",""
"4108151","8.293","0.002","16.275","0.004","19.621","0.005","73.484","0.004","81.053","0.004","87.93","0.004","2508","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H27 Co O7 S Si -","- C24 H27 Co O7 S Si -","- C96 H108 Co4 O28 S4 Si4 -","4","2","","Holland, Ryan L.; Bunker, Kevin D.; Chen, Christopher H.; DiPasquale, Antonio G.; Rheingold, Arnold L.; Baldridge, Kim K.; O'Connor, Joseph M.","Reactions of a Metallacyclobutene Complex with Alkenes","Journal of the American Chemical Society","2008","130","31","10093","10095","10.1021/ja803701z","","","0.71073","MoKα","","0.0662","0.0456","","","0.1044","0.1143","","","","","","1.029","","","","has coordinates","219215","2020-10-21","18:00:00",""
"4108152","10.9095","0.0005","8.7279","0.0003","11.7292","0.0004","90","","93.999","0.002","90","","1114.1","0.07","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H23 N O6 S2 -","- C24 H23 N O6 S2 -","- C48 H46 N2 O12 S4 -","2","1","","Ana López-Pérez; Javier Adrio; Juan C. Carretero","Bis-Sulfonyl Ethylene as Masked Acetylene Equivalent in Catalytic Asymmetric [3 + 2] Cycloaddition of Azomethine Ylides","Journal of the American Chemical Society","2008","130","","10084","10085","10.1021/ja804021m","","","1.54178","CuKα","","0.0402","0.0385","","","0.0961","0.0975","","","","","","1.022","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108153","10.1333","0.0016","6.8285","0.0011","15.7143","0.0016","90","","90","","90","","1087.4","0.3","200","2","200","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C11 H14 B N3 -","- C11 H14 B N3 -","- C44 H56 B4 N12 -","4","0.5","","Shau-Hua Ueng; Malika Makhlouf Brahmi; Étienne Derat; Louis Fensterbank; Emmanuel Lacôte; Max Malacria; Dennis P. Curran","Complexes of Borane and N-Heterocyclic Carbenes: A New Class of Radical Hydrogen Atom Donor","Journal of the American Chemical Society","2008","130","","10082","10083","10.1021/ja804150k","","","0.71073","MoKα","","0.0922","0.0441","","","0.0981","0.1191","","","","","","1.044","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108154","10.714","0.003","12.387","0.004","17.28","0.005","90","","107.576","0.004","90","","2186.2","1.1","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Platinum complex","Platinum complex","","- C25 H27 B N2 Pt -","- C25 H27 B N2 Pt -","- C100 H108 B4 N8 Pt4 -","4","1","","Eugene Khaskin; Peter Y. Zavalij; Andrei N. Vedernikov","Bidirectional Transfer of Phenyl and Methyl Groups between PtIV and Boron in Platinum Dipyridylborato Complexes","Journal of the American Chemical Society","2008","130","","10088","10089","10.1021/ja804222c","","","0.71073","MoKα","","0.0217","0.0179","","","0.0399","0.0412","","","","","","1","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108155","8.9464","0.0013","10.5473","0.0016","23.542","0.004","90.097","0.002","99.641","0.002","93.501","0.002","2185.8","0.6","220","2","220","2","","","","","","","","5","P -1","-P 1","2","Platinum complex","Platinum complex","","- C25 H27 B N2 Pt -","- C25 H27 B N2 Pt -","- C100 H108 B4 N8 Pt4 -","4","2","","Eugene Khaskin; Peter Y. Zavalij; Andrei N. Vedernikov","Bidirectional Transfer of Phenyl and Methyl Groups between PtIV and Boron in Platinum Dipyridylborato Complexes","Journal of the American Chemical Society","2008","130","","10088","10089","10.1021/ja804222c","","","0.71073","MoKα","","0.0433","0.0281","","","0.0633","0.0696","","","","","","1","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108156","19.4008","0.0006","15.457","0.0005","16.073","0.0005","90","","93.2608","0.0004","90","","4812.1","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Pt-complex","Pt-complex","","- C27 H31 B N2 O Pt -","- C27 H31 B N2 O Pt -","- C216 H248 B8 N16 O8 Pt8 -","8","2","","Eugene Khaskin; Peter Y. Zavalij; Andrei N. Vedernikov","Bidirectional Transfer of Phenyl and Methyl Groups between PtIV and Boron in Platinum Dipyridylborato Complexes","Journal of the American Chemical Society","2008","130","","10088","10089","10.1021/ja804222c","","","0.71073","MoKα","","0.0239","0.0206","","","0.0453","0.0461","","","","","","1","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108157","16.516","0.006","12.874","0.004","17.54","0.006","90","","90.255","0.005","90","","3729","2","156","2","156","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C34 H54 Al Si3 U -","- C34 H54 Al Si3 U -","- C136 H216 Al4 Si12 U4 -","4","2","","Stefan G. Minasian; Jamin L. Krinsky; Valerie A. Williams; John Arnold","A Heterobimetallic Complex With an Unsupported Uranium(III)-Aluminum(I) Bond: (CpSiMe3)3U-AlCp* (Cp* = C5Me5)","Journal of the American Chemical Society","2008","130","","10086","10087","10.1021/ja8042382","","","0.71073","MoKα","","0.061","0.0372","","","0.0577","0.0604","","","","","","0.664","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108158","30.3344","0.0004","49.5012","0.0007","29.0565","0.0004","90","","96.785","0.001","90","","43325.4","1","35","2","35","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H488 Mo138 N40 O584 -","- Mo138 O624 -","- Mo276 O1248 -","2","0.25","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.0978","0.0672","","","0.2125","0.2273","","","","","","1.04","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108159","26.9098","0.0006","42.9546","0.0014","29.485","0.0009","90","","94.283","0.001","90","","33986.5","1.7","123","2","123","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H412 Mo138 N40 O546 -","- Mo138 O586 -","- Mo276 O1172 -","2","0.25","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.1237","0.0695","","","0.1987","0.2343","","","","","","1.032","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108160","27.7619","0.0005","42.6994","0.001","30.2459","0.0007","90","","95.858","0.001","90","","35666.8","1.3","123","2","123","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H396 Mo138 N28 O556 -","- Mo138 O584 -","- Mo276 O1168 -","2","0.25","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.1149","0.063","","","0.1922","0.2081","","","","","","0.99","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108161","42.148","0.004","40.138","0.005","26.191","0.003","90","","69.62","0.004","90","","41535","8","35","2","35","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H308 Mo142 N28 O524 -","- Mo142 O552 -","- Mo284 O1104 -","2","0.25","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.2349","0.1201","","","0.3395","0.3932","","","","","","1.029","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108162","42.0599","0.0007","40.045","0.0005","22.545","0.0003","90","","94.587","0.001","90","","37850.7","0.9","123","2","123","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H598 Mo142 N40 O651 -","- Mo142 O691 -","- Mo284 O1382 -","2","0.25","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.0726","0.0564","","","0.1828","0.2055","","","","","","1.071","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108163","59.1887","0.0005","47.1521","0.0005","31.864","0.0003","90","","70.305","0.001","90","","83726","1.5","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- H411 Mo148 N27 O595 -","- Mo148 O622 -","- Mo592 O2488 -","4","0.5","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.1475","0.0838","","","0.2469","0.2744","","","","","","1.002","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108164","33.4487","0.0005","53.5509","0.001","26.6741","0.0005","90","","72.8254","0.001","90","","45648.4","1.4","123","2","123","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H545 Mo150 N35 O656 -","- Mo150 O691 -","- Mo300 O1382 -","2","0.25","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.1136","0.0743","","","0.2354","0.2826","","","","","","1.033","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108165","30.163","0.0005","34.0804","0.0004","46.7339","0.0007","93.9918","0.0007","94.4527","0.0009","95.37","0.001","47542.5","1.2","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- H978.5 Mo151 N26.25 O628.75 -","- Mo151 O655 -","- Mo302 O1310 -","2","1","","Sayaka Shishido; Tomoji Ozeki","The pH Dependent Nuclearity Variation of {Mo154-x}-type Polyoxomolybdates and Tectonic Effect on Their Aggregations","Journal of the American Chemical Society","2008","130","","10588","10595","10.1021/ja800784a","","","0.689","synchrotron","","0.1693","0.1209","","","0.3592","0.4008","","","","","","1.011","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108166","17.3241","0.0006","13.0746","0.0006","21.2901","0.0008","90","","100.834","0.003","90","","4736.4","0.3","180","2","180","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H64 F6 O8 P4 Pd2 S2 -","- C40 H64 F6 O8 P4 Pd2 S2 -","- C160 H256 F24 O32 P16 Pd8 S8 -","4","1","","Miguel Baya; Jennifer Houghton; Denes Konya; Yohan Champouret; Jean-Claude Daran; Karina Q. Almeida Leñero; Lodewijk Schoon; Wilhelmus P. Mul; A. Bart van Oort; Nicolaas Meijboom; Eite Drent; A. Guy Orpen; Rinaldo Poli","Pd(I) Phosphine Carbonyl and Hydride Complexes Implicated in the Palladium-Catalyzed Oxo Process","Journal of the American Chemical Society","2008","130","","10612","10624","10.1021/ja8012903","","","0.71073","MoKα","","0.0577","0.0509","","","0.115","0.1203","","","","","","1.08","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108167","23.452","0.003","23.452","0.003","10.6808","0.0015","90","","90","","120","","5087.4","1.2","173","2","173","2","","","","","","","synthesis as described","7","P 63","P 6c","173","","","","- C56 H96 F6 O6 P6 Pd3 S2 -","- C56 H96 F6 O6 P6 Pd3 S2 -","- C168 H288 F18 O18 P18 Pd9 S6 -","3","0.5","","Miguel Baya; Jennifer Houghton; Denes Konya; Yohan Champouret; Jean-Claude Daran; Karina Q. Almeida Leñero; Lodewijk Schoon; Wilhelmus P. Mul; A. Bart van Oort; Nicolaas Meijboom; Eite Drent; A. Guy Orpen; Rinaldo Poli","Pd(I) Phosphine Carbonyl and Hydride Complexes Implicated in the Palladium-Catalyzed Oxo Process","Journal of the American Chemical Society","2008","130","","10612","10624","10.1021/ja8012903","","","0.71073","MoKα","","0.0888","0.0752","","","0.1853","0.1907","","","","","","1.106","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108168","44.5742","0.0018","11.356","0.0007","23.1131","0.0012","90","","100.165","0.004","90","","11515.9","1","180","2","180","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H33 F6 O8.5 P2 Pd S2 -","- C20 H33 F6 O8.5 P2 Pd S2 -","- C320 H528 F96 O136 P32 Pd16 S32 -","16","2","","Miguel Baya; Jennifer Houghton; Denes Konya; Yohan Champouret; Jean-Claude Daran; Karina Q. Almeida Leñero; Lodewijk Schoon; Wilhelmus P. Mul; A. Bart van Oort; Nicolaas Meijboom; Eite Drent; A. Guy Orpen; Rinaldo Poli","Pd(I) Phosphine Carbonyl and Hydride Complexes Implicated in the Palladium-Catalyzed Oxo Process","Journal of the American Chemical Society","2008","130","","10612","10624","10.1021/ja8012903","","","0.71073","MoKα","","0.0663","0.0486","","","0.1243","0.1363","","","","","","1.059","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108169","9.9583","0.0003","10.4988","0.0003","15.7961","0.0004","90","","98.407","0.002","90","","1633.74","0.08","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 Au2 N4 Zn -","- C4 Au2 N4 Zn -","- C32 Au16 N32 Zn8 -","8","1","","Michael J. Katz; Taramatee Ramnial; Hua-Zhong Yu; Daniel B. Leznoff","Polymorphism of Zn[Au(CN)2]2 and Its Luminescent Sensory Response to NH3 Vapor","Journal of the American Chemical Society","2008","130","","10662","10673","10.1021/ja801773p","","","0.71073","MoKα","","0.0645","0.0358","","0.0611","0.0553","0.0543","","","","","","1.2462","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108170","8.9006","0.0001","16.8152","0.0002","14.3808","0.0002","90","","100.6","0.001","90","","2115.58","0.05","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 Au2 N4 Zn -","- C4 Au2 N4 Zn -","- C32 Au16 N32 Zn8 -","8","1","","Michael J. Katz; Taramatee Ramnial; Hua-Zhong Yu; Daniel B. Leznoff","Polymorphism of Zn[Au(CN)2]2 and Its Luminescent Sensory Response to NH3 Vapor","Journal of the American Chemical Society","2008","130","","10662","10673","10.1021/ja801773p","","","0.71073","MoKα","","0.0599","0.0435","","0.0661","0.0574","0.0563","","","","","","1.1415","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108171","8.262","0.005","12.264","0.005","13.394","0.004","100.215","0.03","95.23","0.04","104.52","0.04","1279.8","1.1","30","1","30","1","","","","","","","","6","P -1","-P 1","2","","","","- C22 H44 B Ir O2 P2 -","- C22 H44 B Ir O2 P2 -","- C44 H88 B2 Ir2 O4 P4 -","2","1","","Travis J. Hebden; Melanie C. Denney; Vincent Pons; Paula M. B. Piccoli; Thomas F. Koetzle; Arthur J. Schultz; Werner Kaminsky; Karen I. Goldberg; D. Michael Heinekey","σ-Borane Complexes of Iridium: Synthesis and Structural Characterization","Journal of the American Chemical Society","2008","130","","10812","10820","10.1021/ja801898m","powder diffraction","neutron","","neutron","","0.197","0.186","","","","0.189","","","2.54","","","2.54","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4108172","41.2238","0.0002","11.1233","0.0002","14.6122","0.0003","90","","90.3735","0.0006","90","","6700.2","0.19","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","TJHI82Ax1","TJHI82Ax1","","- C60 H112 B2 Ir2 O9 P4 -","- C60 H112 B2 Ir2 O9 P4 -","- C240 H448 B8 Ir8 O36 P16 -","4","0.5","","Travis J. Hebden; Melanie C. Denney; Vincent Pons; Paula M. B. Piccoli; Thomas F. Koetzle; Arthur J. Schultz; Werner Kaminsky; Karen I. Goldberg; D. Michael Heinekey","σ-Borane Complexes of Iridium: Synthesis and Structural Characterization","Journal of the American Chemical Society","2008","130","","10812","10820","10.1021/ja801898m","","","0.71073","MoKα","","0.0656","0.0501","","","0.1195","0.1313","","","","","","1.077","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108173","15.4564","0.0006","22.1904","0.001","7.4161","0.0002","90","","90","","90","","2543.6","0.17","160","1","160","1","","","","","","","","2","P c a 21","P 2c -2ac","29","","","","- C38 H22 -","- C38 H22 -","- C152 H88 -","4","1","","Yao-Ting Wu; Davide Bandera; Roman Maag; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Multiethynyl Corannulenes: Synthesis, Structure, and Properties","Journal of the American Chemical Society","2008","130","","10729","10739","10.1021/ja802334n","","","0.71073","MoKα","","0.0656","0.0433","","","0.0947","0.1059","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108174","7.4846","0.0005","43.341","0.003","13.6837","0.001","90","","90","","90","","4438.9","0.5","260","1","260","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C60 H45 O1.5 -","- C60 H42 -","- C240 H168 -","4","0.5","","Yao-Ting Wu; Davide Bandera; Roman Maag; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Multiethynyl Corannulenes: Synthesis, Structure, and Properties","Journal of the American Chemical Society","2008","130","","10729","10739","10.1021/ja802334n","","","0.71073","MoKα","","0.1236","0.0819","","","0.2341","0.2663","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108175","33.4143","0.0012","7.8392","0.0003","41.0964","0.0016","90","","109.877","0.0008","90","","10123.5","0.7","260","1","260","1","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C70 H50 -","- C70 H50 -","- C560 H400 -","8","2","","Yao-Ting Wu; Davide Bandera; Roman Maag; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Multiethynyl Corannulenes: Synthesis, Structure, and Properties","Journal of the American Chemical Society","2008","130","","10729","10739","10.1021/ja802334n","","","0.71073","MoKα","","0.153","0.0635","","","0.1356","0.1798","","","","","","1.026","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108176","17.8356","0.0005","22.9372","0.0007","3.8032","0.0001","90","","90","","90","","1555.88","0.08","160","1","160","1","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C20 H6 Br4 -","- C20 H6 Br4 -","- C80 H24 Br16 -","4","1","","Yao-Ting Wu; Davide Bandera; Roman Maag; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Multiethynyl Corannulenes: Synthesis, Structure, and Properties","Journal of the American Chemical Society","2008","130","","10729","10739","10.1021/ja802334n","","","0.71073","MoKα","","0.0523","0.0354","","","0.0693","0.0749","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108177","9.7017","0.0005","17.8773","0.0011","16.4921","0.0009","90","","92.371","0.002","90","","2857.9","0.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","phenyltris-(1-tert-butyl-imidazol-2-ylidene)boratoiron(ii)chloride","","- C27 H38 B Cl Fe N6 -","- C27 H38 B Cl Fe N6 -","- C108 H152 B4 Cl4 Fe4 N24 -","4","1","","Jeremiah J. Scepaniak; Meita D. Fulton; Ranko P. Bontchev; Eileen N. Duesler; Martin L. Kirk; Jeremy M. Smith","Structural and Spectroscopic Characterization of an Electrophilic Iron Nitrido Complex","Journal of the American Chemical Society","2008","130","","10515","10517","10.1021/ja8027372","","","0.71073","MoKα","","0.0491","0.0361","","","0.0915","0.1127","","","","","","1.193","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108178","18.1318","0.0006","18.1789","0.0006","18.3767","0.0006","90","","90","","90","","6057.3","0.3","223","2","223","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C29 H41 B Fe N8 -","- C29 H41 B Fe N8 -","- C232 H328 B8 Fe8 N64 -","8","1","","Jeremiah J. Scepaniak; Meita D. Fulton; Ranko P. Bontchev; Eileen N. Duesler; Martin L. Kirk; Jeremy M. Smith","Structural and Spectroscopic Characterization of an Electrophilic Iron Nitrido Complex","Journal of the American Chemical Society","2008","130","","10515","10517","10.1021/ja8027372","","","0.71073","MoKα","","0.0632","0.0378","","","0.0953","0.1108","","","","","","1","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108179","14.2125","0.001","14.4329","0.001","20.4911","0.0014","91.653","0.004","97.227","0.004","91.83","0.004","4165.5","0.5","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","Triphenylphosphamidophenyltris(1-mesitylimidazol-2-ylidene)boratoiron(II).","","- C180 H212 B4 Fe4 N28 P4 -","- C180 H212 B4 Fe4 N28 P4 -","- C180 H212 B4 Fe4 N28 P4 -","1","0.5","","Jeremiah J. Scepaniak; Meita D. Fulton; Ranko P. Bontchev; Eileen N. Duesler; Martin L. Kirk; Jeremy M. Smith","Structural and Spectroscopic Characterization of an Electrophilic Iron Nitrido Complex","Journal of the American Chemical Society","2008","130","","10515","10517","10.1021/ja8027372","","","0.71073","MoKα","","0.0447","0.0359","","","0.0997","0.1186","","","","","","1.173","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108180","15.2582","0.0018","15.2582","0.0018","6.6579","0.0009","90","","90","","120","","1342.4","0.3","291","2","291","2","","","","","","","","6","P 3","P 3","143","","","","- C33 H66 Br8 Cu8 N6 O3 -","- C33 H66 Br8 Cu8 N6 O3 -","- C33 H66 Br8 Cu8 N6 O3 -","1","0.333333","","Wen Zhang; Ren-Gen Xiong; Songping D. Huang","3D Framework Containing Cu4Br4 Cubane as Connecting Node with Strong Ferroelectricity","Journal of the American Chemical Society","2008","130","","10468","10469","10.1021/ja803021v","","","0.71073","MoKα","","0.0601","0.0482","","","0.0956","0.098","","","","","","1.068","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108181","28.8303","0.0002","28.8303","0.0002","110.4313","0.0009","90","","90","","120","","79491.6","1","200","2","200","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C255 H552 Cl12 Fe64 N32 O327 -","- C255 Cl12.02 Fe64 N32 O327.05 -","- C1530 Cl72.12 Fe384 N192 O1962.3 -","6","0.166667","","Tao Liu; Yan-Juan Zhang; Zhe-Ming Wang; Song Gao","A 64-Nuclear Cubic Cage Incorporating Propeller-like FeIII8 Apices and HCOO- Edges","Journal of the American Chemical Society","2008","130","","10500","10501","10.1021/ja803846z","","","0.71073","MoKα","","0.1141","0.0607","","","0.1634","0.1897","","","","","","0.971","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108182","20.5536","0.0004","20.5536","0.0004","34.614","0.001","90","","90","","120","","12663.6","0.5","180","2","180","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C51 H109 Cl3 Fe8 N7 O45.5 -","- C51 H108 Cl3 Fe8 N7 O45.5 -","- C306 H648 Cl18 Fe48 N42 O273 -","6","0.333333","","Tao Liu; Yan-Juan Zhang; Zhe-Ming Wang; Song Gao","A 64-Nuclear Cubic Cage Incorporating Propeller-like FeIII8 Apices and HCOO- Edges","Journal of the American Chemical Society","2008","130","","10500","10501","10.1021/ja803846z","","","0.71073","MoKα","","0.1142","0.0564","","","0.1471","0.1808","","","","","","1.006","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4108183","11.689","0.018","8.154","0.013","16.11","0.02","90","","94.01","0.02","90","","1532","4","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C11 H10 Br F6 O4 P -","- C11 H10 Br F6 O4 P -","- C44 H40 Br4 F24 O16 P4 -","4","2","","Joshua P. Abell; Hisashi Yamamoto","Catalytic Enantioselective Pudovik Reaction of Aldehydes and Aldimines with Tethered Bis(8-quinolinato) (TBOx) Aluminum Complex","Journal of the American Chemical Society","2008","130","","10521","10523","10.1021/ja803859p","","","0.71073","MoKα","","0.0636","0.0392","","","0.0842","0.0897","","","","","","0.896","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108184","9.4671","0.0009","6.2402","0.0008","12.0915","0.0012","90","","108.33","0.003","90","","678.08","0.13","173.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H16 O -","- C19 H16 O -","- C38 H32 O2 -","2","1","","Koji Fukamizu; Yoshihiro Miyake; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Enantioselective Carbon-Carbon Bond Forming Reaction via Allenylidene-Ene Process: Synthetic Approach to Chiral Heterocycles Such As Chromane, Thiochromane, and 1,2,3,4-Tetrahydroquinoline Derivatives","Journal of the American Chemical Society","2008","130","","10498","10499","10.1021/ja8038745","","","0.71075","MoKα","","","0.0699","","","","0.121","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108185","11.2974","0.0007","11.7303","0.0008","12.8223","0.0006","103.283","0.004","97.9031","0.0011","98.387","0.0016","1610.08","0.17","173.1","","","","","","","","","","","5","P 1","P 1","1","","","","- C65 H74 Cl8 Ru2 S2 -","- C65 H74 Cl8 Ru2 S2 -","- C65 H74 Cl8 Ru2 S2 -","1","1","","Koji Fukamizu; Yoshihiro Miyake; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Enantioselective Carbon-Carbon Bond Forming Reaction via Allenylidene-Ene Process: Synthetic Approach to Chiral Heterocycles Such As Chromane, Thiochromane, and 1,2,3,4-Tetrahydroquinoline Derivatives","Journal of the American Chemical Society","2008","130","","10498","10499","10.1021/ja8038745","","","0.71069","MoKα","","","0.0341","","","","0.0566","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108186","9.9845","0.0009","20.7418","0.0015","25.4506","0.0019","90","","90","","90","","5270.7","0.7","173.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H17 Cl O -","- C23 H17 Cl O -","- C276 H204 Cl12 O12 -","12","3","","Koji Fukamizu; Yoshihiro Miyake; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Enantioselective Carbon-Carbon Bond Forming Reaction via Allenylidene-Ene Process: Synthetic Approach to Chiral Heterocycles Such As Chromane, Thiochromane, and 1,2,3,4-Tetrahydroquinoline Derivatives","Journal of the American Chemical Society","2008","130","","10498","10499","10.1021/ja8038745","","","0.71075","MoKα","","","0.0426","","","","0.2058","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108187","12.1159","0.0002","16.7643","0.0003","17.162","0.0004","89.461","0.001","72.917","0.001","71.945","0.001","3155.18","0.11","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H68 Cl5 N3 O12 S3 -","- C61 H68 Cl5 N3 O12 S3 -","- C122 H136 Cl10 N6 O24 S6 -","2","1","","Dong-Gyu Cho; Patrick Plitt; Sung Kuk Kim; Vincent Lynch; Seong-Jin Hong; Chang-Hee Lee; Jonathan L. Sessler","Dioxabenzosapphyrin: A New Benzodifuran-Derived Sapphyrin Analogue","Journal of the American Chemical Society","2008","130","","10502","10503","10.1021/ja804090w","","","0.71073","MoKα","","0.1761","0.0773","","","0.1503","0.189","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108188","10.1937","0.0017","14.149","0.002","13.872","0.002","90","","101.328","0.002","90","","1961.8","0.5","123.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 B Cl N8 O Ru -","- C17 H18 B Cl N8 O Ru -","- C68 H72 B4 Cl4 N32 O4 Ru4 -","4","1","","Yasuhiro Arikawa; Taiki Asayama; Kazuki Itatani; Masayoshi Onishi","N-C Bond Formation of NO Ligands on Ruthenium Complexes with Concurrent Vinylic C-H Activation and Subsequent Proton-Induced Reactivities of the Resulting Nitrosovinyl Species","Journal of the American Chemical Society","2008","130","","10508","10509","10.1021/ja804095u","","","0.7107","MoKα","","","0.0259","","","","0.0769","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108189","9.8644","0.0005","19.8973","0.0009","14.6625","0.0008","90","","106.73","0.0005","90","","2756.1","0.2","296.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 B Cl N8 O Ru -","- C24 H15 B Cl N8 O Ru -","- C96 H60 B4 Cl4 N32 O4 Ru4 -","4","1","","Yasuhiro Arikawa; Taiki Asayama; Kazuki Itatani; Masayoshi Onishi","N-C Bond Formation of NO Ligands on Ruthenium Complexes with Concurrent Vinylic C-H Activation and Subsequent Proton-Induced Reactivities of the Resulting Nitrosovinyl Species","Journal of the American Chemical Society","2008","130","","10508","10509","10.1021/ja804095u","","","0.7107","MoKα","","","0.0419","","","","0.1244","","","","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108190","9.923","0.004","12.622","0.005","13.472","0.005","69.01","0.02","70.12","0.02","66.72","0.02","1407.8","1","296.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C20 H26 B2 Cl2 F4 N8 O3 Ru -","- C20 H24 B2 Cl2 F4 N8 O3 Ru -","- C40 H48 B4 Cl4 F8 N16 O6 Ru2 -","2","1","","Yasuhiro Arikawa; Taiki Asayama; Kazuki Itatani; Masayoshi Onishi","N-C Bond Formation of NO Ligands on Ruthenium Complexes with Concurrent Vinylic C-H Activation and Subsequent Proton-Induced Reactivities of the Resulting Nitrosovinyl Species","Journal of the American Chemical Society","2008","130","","10508","10509","10.1021/ja804095u","","","0.7107","MoKα","","","0.0584","","","","0.1533","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108191","15.9983","0.001","13.3268","0.0007","16.9705","0.0011","90","","100.218","0.001","90","","3560.8","0.4","296.1","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C37 H32 B Cl N8 P Ru -","- C37 H32 B Cl N8 P Ru -","- C148 H128 B4 Cl4 N32 P4 Ru4 -","4","2","","Yasuhiro Arikawa; Taiki Asayama; Kazuki Itatani; Masayoshi Onishi","N-C Bond Formation of NO Ligands on Ruthenium Complexes with Concurrent Vinylic C-H Activation and Subsequent Proton-Induced Reactivities of the Resulting Nitrosovinyl Species","Journal of the American Chemical Society","2008","130","","10508","10509","10.1021/ja804095u","","","0.7107","MoKα","","","0.0454","","","","0.1181","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108192","13.055","0.001","21.179","0.002","21.966","0.002","90","","90","","90","","6073.4","0.9","293","2","293","2","","","","","","","","7","F m m m","-F 2 2","69","","","","- C13 H27 Co Mo11 N8 O44 P -","- C13 H20 Co Mo11 N8 O44 P -","- C52 H80 Co4 Mo44 N32 O176 P4 -","4","0.125","","Guanggang Gao; Fengyan Li; Lin Xu; Xizheng Liu; Yanyan Yang","CO2 Coordination by Inorganic Polyoxoanion in Water","Journal of the American Chemical Society","2008","130","","10838","10839","10.1021/ja801560t","","","0.71073","MoKα","","0.0466","0.0387","","","0.103","0.1097","","","","","","1.011","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108193","13.039","0.001","21.333","0.002","21.889","0.002","90","","90","","90","","6088.7","0.9","293","2","293","2","","","","","","","","7","F m m m","-F 2 2","69","","","","- C13 H28 Co Mo11 N8 O44 Si -","- C13 H20 Co Mo11 N8 O44 Si -","- C52 H80 Co4 Mo44 N32 O176 Si4 -","4","0.125","","Guanggang Gao; Fengyan Li; Lin Xu; Xizheng Liu; Yanyan Yang","CO2 Coordination by Inorganic Polyoxoanion in Water","Journal of the American Chemical Society","2008","130","","10838","10839","10.1021/ja801560t","","","0.71073","MoKα","","0.0621","0.0561","","","0.1118","0.1383","","","","","","1.051","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108194","18.4923","0.0002","19.6458","0.0004","20.4339","0.0004","86.311","0.001","66.573","0.001","64.109","0.001","6074","0.2","173","0.1","173","0.1","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C245 H218 Cl8 Cu4 F24 N20 O32 P4 -","- C245 H218 Cl8 Cu4 F24 N20 O32 P4 -","- C245 H218 Cl8 Cu4 F24 N20 O32 P4 -","1","0.5","","Julien Frey; Christian Tock; Jean-Paul Collin; Valérie Heitz; Jean-Pierre Sauvage; Kari Rissanen","Cyclic [2]Pseudorotaxane Tetramers Consisting of Two Rigid Rods Threaded through Two Bis-Macrocycles: Copper(I)-Templated Synthesis and X-ray Structure Studies","Journal of the American Chemical Society","2008","130","","11013","11022","10.1021/ja801924y","","x-ray","0.71073","MoKα","","0.1656","0.1149","","","0.3003","0.3531","","","","","","1.093","","","","has coordinates,has disorder","178827","2020-10-21","18:00:00",""
"4108195","18.5429","0.0018","7.2296","0.0007","28.476","0.003","90","","90","","90","","3817.4","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H31 Cl N2 O2 -","- C18 H31 Cl N2 O2 -","- C144 H248 Cl8 N16 O16 -","8","1","","Hiyam Hamaed; Jenna M. Pawlowski; Benjamin F.T. Cooper; Riqiang Fu; S. Holger Eichhorn; Robert W. Schurko","Application of Solid-State 35Cl NMR to the Structural Characterization of Hydrochloride Pharmaceuticals and their Polymorphs","Journal of the American Chemical Society","2008","130","","11056","11065","10.1021/ja802486q","","","0.71073","MoKα","","0.1342","0.0808","","","0.1671","0.197","","","","","","1.173","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108196","8.391","0.002","7.015","0.0017","26.163","0.006","90","","91.414","0.003","90","","1539.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H25 Cl N2 O2 -","- C14 H25 Cl N2 O2 -","- C56 H100 Cl4 N8 O8 -","4","1","","Hiyam Hamaed; Jenna M. Pawlowski; Benjamin F.T. Cooper; Riqiang Fu; S. Holger Eichhorn; Robert W. Schurko","Application of Solid-State 35Cl NMR to the Structural Characterization of Hydrochloride Pharmaceuticals and their Polymorphs","Journal of the American Chemical Society","2008","130","","11056","11065","10.1021/ja802486q","","","0.71073","MoKα","","0.1897","0.1396","","","0.269","0.2812","","","","","","1.457","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108197","14.009","0.002","8.2472","0.0012","24.853","0.004","90","","90","","90","","2871.4","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H21 Cl N2 O2 -","- C13 H21 Cl N2 O2 -","- C104 H168 Cl8 N16 O16 -","8","1","","Hiyam Hamaed; Jenna M. Pawlowski; Benjamin F.T. Cooper; Riqiang Fu; S. Holger Eichhorn; Robert W. Schurko","Application of Solid-State 35Cl NMR to the Structural Characterization of Hydrochloride Pharmaceuticals and their Polymorphs","Journal of the American Chemical Society","2008","130","","11056","11065","10.1021/ja802486q","","","0.71073","MoKα","","0.0621","0.0428","","","0.1161","0.1231","","","","","","1.089","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108198","7.3436","0.001","8.5082","0.0012","13.634","0.0019","105.542","0.001","91.863","0.001","99.581","0.001","806.6","0.19","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H25 Cl N2 O2 -","- C15 H25 Cl N2 O2 -","- C30 H50 Cl2 N4 O4 -","2","1","","Hiyam Hamaed; Jenna M. Pawlowski; Benjamin F.T. Cooper; Riqiang Fu; S. Holger Eichhorn; Robert W. Schurko","Application of Solid-State 35Cl NMR to the Structural Characterization of Hydrochloride Pharmaceuticals and their Polymorphs","Journal of the American Chemical Society","2008","130","","11056","11065","10.1021/ja802486q","","","0.71073","MoKα","","0.0677","0.0599","","","0.1399","0.1462","","","","","","1.239","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108199","9.801","0.002","6.4441","0.0013","21.491","0.004","90","","97.21","0.03","90","","1346.6","0.5","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C31 H38 O4 -","- C31 H38 O4 -","- C62 H76 O8 -","2","1","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.089","0.0625","","","0.1247","0.1346","","","","","","1.074","","","","has coordinates","178827","2020-10-21","18:00:00",""
"4108200","6.9407","0.0014","10.272","0.002","19.15","0.004","99.51","0.03","90.95","0.03","99.87","0.03","1325.2","0.5","153","2","153","2","","","","","","","","3","P 1","P 1","1","","","","- C31 H38 O4 -","- C31 H38 O4 -","- C62 H76 O8 -","2","2","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.1242","0.0855","","","0.161","0.1794","","","","","","1.067","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108201","9.84","0.002","6.75","0.0013","18.509","0.004","90","","104.63","0.03","90","","1189.5","0.5","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H32 O4 -","- C26 H32 O4 -","- C52 H64 O8 -","2","1","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.1175","0.0743","","","0.1523","0.1693","","","","","","1.113","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108202","6.3993","0.0009","6.3993","0.0009","36.513","0.007","90","","90","","90","","1495.2","0.4","296","2","296","2","","","","","","","","3","P 43","P 4cw","78","","","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","1","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.0886","0.0702","","","0.1456","0.153","","","","","","1.244","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108203","7.1676","0.0014","14.586","0.003","21.276","0.004","90","","90","","90","","2224.3","0.8","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 N2 O9 -","- C23 H20 N2 O9 -","- C92 H80 N8 O36 -","4","1","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.0479","0.045","","","0.1039","0.1053","","","","","","1.173","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108204","10.971","0.002","7.6978","0.0015","11.741","0.002","90","","97.31","0.03","90","","983.5","0.3","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H22 O5 -","- C23 H22 O5 -","- C46 H44 O10 -","2","1","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.1132","0.0817","","","0.1359","0.1473","","","","","","1.185","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108205","9.6153","0.0019","11.973","0.002","23.881","0.005","90","","90","","90","","2749.3","0.9","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C31 H40 O5 -","- C31 H40 O5 -","- C124 H160 O20 -","4","1","","K. C. Nicolaou; T. Robert Wu; David Sarlah; David M. Shaw; Eric Rowcliffe; Dennis R. Burton","Total Synthesis, Revised Structure, and Biological Evaluation of Biyouyanagin A and Analogues Thereof","Journal of the American Chemical Society","2008","130","","11114","11121","10.1021/ja802805c","","","0.71073","MoKα","","0.1153","0.0726","","","0.1098","0.1203","","","","","","1.089","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108206","15.6083","0.0004","15.6083","0.0004","76.462","0.005","90","","90","","120","","16132","1.2","150","2","150","2","","","","","","","M. Manoli MMD91","6","R -3 :H","-R 3","148","","","","- C88 H212 Br3 Mn10 N10 O25 -","- C39.97 H99.81 Br6.01 Mn10 N9.99 O24.97 -","- C239.82 H598.86 Br36.06 Mn60 N59.94 O149.82 -","6","0.333333","","Maria Manoli; Anna Collins; Simon Parsons; Andrea Candini; Marco Evangelisti; Euan K. Brechin","Mixed-Valent Mn Supertetrahedra and Planar Discs as Enhanced Magnetic Coolers","Journal of the American Chemical Society","2008","130","","11129","11139","10.1021/ja802829d","","","0.71073","MoKα","","0.0641","0.0464","","","0.1247","0.1305","","","","","","1.051","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108207","15.82","0.0003","15.82","0.0003","77.614","0.003","90","","90","","120","","16822.2","0.8","150","","150","","","","","","","","Maria Manoli, MMD208","6","R -3 :H","-R 3","148","","","","- C70 H169.8 I7.2 Mn10 N10 O25.8 -","- C40 H99.7998 I5.2 Mn10 N9.9999 O25.8001 -","- C240 H598.799 I31.2 Mn60 N59.9994 O154.801 -","6","0.333333","","Maria Manoli; Anna Collins; Simon Parsons; Andrea Candini; Marco Evangelisti; Euan K. Brechin","Mixed-Valent Mn Supertetrahedra and Planar Discs as Enhanced Magnetic Coolers","Journal of the American Chemical Society","2008","130","","11129","11139","10.1021/ja802829d","","","0.71073","MoKα","","0.143","0.0779","","0.1548","0.0812","0.0812","","","","","","1.0139","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108208","25.6712","0.001","17.0984","0.0007","26.2611","0.0011","90","","96.036","0.002","90","","11463","0.8","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H162 I8 Mn10 N8 O38 -","- C40 H90 I8 Mn10 N8 O26 -","- C160 H360 I32 Mn40 N32 O104 -","4","1","","Maria Manoli; Anna Collins; Simon Parsons; Andrea Candini; Marco Evangelisti; Euan K. Brechin","Mixed-Valent Mn Supertetrahedra and Planar Discs as Enhanced Magnetic Coolers","Journal of the American Chemical Society","2008","130","","11129","11139","10.1021/ja802829d","","","0.71073","MoKα","","0.0992","0.058","","0.161","0.1296","0.161","","","","","","0.8972","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108209","25.5208","0.0006","16.2775","0.0004","26.0702","0.0006","90","","90","","90","","10829.9","0.4","150","","150","","","","","","","","Maria Monoli, MME103","6","P b c n","-P 2n 2ab","60","","","","- C56 H148 I8 Mn10 N8 O32 -","- C48 H124 I8 Mn10 N8 O28 -","- C192 H496 I32 Mn40 N32 O112 -","4","0.5","","Maria Manoli; Anna Collins; Simon Parsons; Andrea Candini; Marco Evangelisti; Euan K. Brechin","Mixed-Valent Mn Supertetrahedra and Planar Discs as Enhanced Magnetic Coolers","Journal of the American Chemical Society","2008","130","","11129","11139","10.1021/ja802829d","","","0.71073","MoKα","","0.1123","0.0629","","0.1531","0.1398","0.1531","","","","","","0.8833","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108210","13.1676","0.0004","22.4","0.0006","21.4912","0.0006","90","","91.92","0.002","90","","6335.4","0.3","150","","150","","","","","","","","M Manoli, MME102","4","P 1 21/n 1","-P 2yn","14","","","","- C29 I4 Mn7 O24 -","- C29 I4 Mn7 O24 -","- C116 I16 Mn28 O96 -","4","1","","Maria Manoli; Anna Collins; Simon Parsons; Andrea Candini; Marco Evangelisti; Euan K. Brechin","Mixed-Valent Mn Supertetrahedra and Planar Discs as Enhanced Magnetic Coolers","Journal of the American Chemical Society","2008","130","","11129","11139","10.1021/ja802829d","","","0.71073","MoKα","","0.2025","0.167","","0.3949","0.3676","0.3949","","","","","","1.0398","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108211","28.272","0.012","5.075","0.002","37.126","0.015","90","","110.669","0.007","90","","4984","4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H48 N6 O21 S3 -","- C36 H30 N6 O18 -","- C144 H120 N24 O72 -","4","1","","Orion B. Berryman; Aaron C. Sather; Benjamin P. Hay; Jeffrey S. Meisner; Darren W. Johnson","Solution Phase Measurement of Both Weak σ and C-H...X-Hydrogen Bonding Interactions in Synthetic Anion Receptors","Journal of the American Chemical Society","2008","130","","10895","10897","10.1021/ja8035652","","","0.71073","MoKα","","0.1736","0.0857","","","0.2289","0.2637","","","","","","0.946","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108212","5.6949","0.0012","19.833","0.004","33.883","0.007","84.106","0.004","85.278","0.005","81.873","0.005","3759.6","1.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H30 N6 O18 -","- C36 H30 N6 O18 -","- C144 H120 N24 O72 -","4","2","","Orion B. Berryman; Aaron C. Sather; Benjamin P. Hay; Jeffrey S. Meisner; Darren W. Johnson","Solution Phase Measurement of Both Weak σ and C-H...X-Hydrogen Bonding Interactions in Synthetic Anion Receptors","Journal of the American Chemical Society","2008","130","","10895","10897","10.1021/ja8035652","","","0.71073","MoKα","","0.109","0.0566","","","0.1135","0.1436","","","","","","1.007","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108213","11.9572","0.0008","6.0501","0.0004","16.5672","0.0014","90","","110.727","0.004","90","","1120.94","0.14","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","TRN-4-128-44","","","- C23 H25 I N3 O4 -","- C23 H25 I N3 O4 -","- C46 H50 I2 N6 O8 -","2","1","","Timothy Newhouse; Phil S. Baran","Total Synthesis of (\±)-Psychotrimine","Journal of the American Chemical Society","2008","130","","10886","10887","10.1021/ja8042307","","","1.54178","CuKα","","0.0299","0.0283","","","0.072","0.0727","","","","","","1.024","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4108214","10.831","0.0014","11.5758","0.0015","12.4242","0.0016","85.161","0.002","75.771","0.003","83.546","0.003","1497.8","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H39 B F P -","- C37 H39 B F P -","- C74 H78 B2 F2 P2 -","2","1","","Todd W. Hudnall; Young-Min Kim; Magnus W. P. Bebbington; Didier Bourissou; François P. Gabbaï","Fluoride Ion Chelation By a Bidentate Phosphonium/Borane Lewis Acid","Journal of the American Chemical Society","2008","130","","10890","10891","10.1021/ja804492y","","","0.71073","MoKα","","0.0698","0.0463","","","0.1065","0.1137","","","","","","1.008","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108215","17.29","0.002","8.6503","0.0012","23.517","0.003","90","","109.703","0.001","90","","3311.4","0.7","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H43 B I O P -","- C38 H43 B I O P -","- C152 H172 B4 I4 O4 P4 -","4","1","","Todd W. Hudnall; Young-Min Kim; Magnus W. P. Bebbington; Didier Bourissou; François P. Gabbaï","Fluoride Ion Chelation By a Bidentate Phosphonium/Borane Lewis Acid","Journal of the American Chemical Society","2008","130","","10890","10891","10.1021/ja804492y","","","0.71073","MoKα","","0.0314","0.0262","","","0.0789","0.0944","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108216","11.7586","0.0007","12.5994","0.0008","13.1209","0.0008","92.034","0.001","94.13","0.001","108.557","0.001","1834.5","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H53 Ir O P2 -","- C41 H53 Ir O P2 -","- C82 H106 Ir2 O2 P4 -","2","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0306","0.0276","","","0.0721","0.074","","","","","","1.007","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108217","12.375","0.001","11.371","0.001","22.904","0.002","90","","91.821","0.002","90","","3221.3","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H48 Ir O P2 -","- C34 H48 Ir O P2 -","- C136 H192 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0622","0.0498","","","0.1239","0.1318","","","","","","1.002","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108218","10.7947","0.0006","11.3126","0.0006","15.4888","0.0008","106.138","0.002","97.056","0.001","110.11","0.001","1655.37","0.16","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H56 B F4 Ir O2 P2 -","- C29 H56 B F4 Ir O2 P2 -","- C58 H112 B2 F8 Ir2 O4 P4 -","2","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0303","0.0275","","","0.063","0.0641","","","","","","1","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108219","17.5108","0.001","17.3197","0.001","20.0351","0.0011","90","","90","","90","","6076.3","0.6","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H47 Br2 Ir P2 -","- C30 H47 Br2 Ir P2 -","- C240 H376 Br16 Ir8 P16 -","8","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0459","0.0378","","","0.1206","0.1265","","","","","","1.061","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108220","9.9228","0.0004","16.81","0.0007","10.3137","0.0004","90","","99.89","0.001","90","","1694.78","0.12","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H53 Ir O P2 -","- C37 H53 Ir O P2 -","- C74 H106 Ir2 O2 P4 -","2","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0177","0.0169","","","0.0419","0.0419","","","","","","0.882","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108221","11.7312","0.0007","20.4871","0.0013","29.5148","0.0018","90","","90","","90","","7093.5","0.8","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C39 H55 Ir O P2 -","- C39 H55 Ir O P2 -","- C312 H440 Ir8 O8 P16 -","8","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0526","0.0376","","","0.0812","0.0877","","","","","","1.001","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108222","11.3065","0.0006","16.6734","0.0009","17.1406","0.0009","90","","93.327","0.001","90","","3225.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H53 Ir O P2 -","- C34 H53 Ir O P2 -","- C136 H212 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.028","0.0241","","","0.0601","0.0624","","","","","","1.002","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108223","9.4658","0.001","24.54","0.003","15.3058","0.0016","90","","96.002","0.002","90","","3535.9","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H53 Ir O P2 -","- C39 H53 Ir O P2 -","- C156 H212 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0922","0.0477","","","0.0704","0.0798","","","","","","1.001","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108224","16.2384","0.0004","16.2384","0.0004","20.068","0.001","90","","90","","120","","4582.7","0.3","100","2","100","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C29 H53.666667 Ir O P2 -","- C29 H53.6667 Ir O P2 -","- C174 H322 Ir6 O6 P12 -","6","0.5","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0396","0.0298","","","0.069","0.0724","","","","","","1.059","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108225","12.933","0.0009","19.0074","0.0014","24.724","0.0018","90","","90","","90","","6077.7","0.8","100","2","100","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C32 H49 Ir O P2 -","- C32 H49 Ir O P2 -","- C256 H392 Ir8 O8 P16 -","8","0.25","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.0312","0.0271","","","0.0612","0.0627","","","","","","1.075","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108226","13.244","0.0006","15.2021","0.0007","16.7996","0.0008","90","","110.383","0.001","90","","3170.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H48 I Ir P2 -","- C32 H48 I Ir P2 -","- C128 H192 I4 Ir4 P8 -","4","1","","Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir","Journal of the American Chemical Society","2008","130","","11317","11327","10.1021/ja800434r","","","0.71073","MoKα","","0.019","0.0171","","","0.0384","0.039","","","","","","0.998","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108227","13.2337","0.0004","11.8332","0.0003","9.8015","0.0003","90","","90","","90","","1534.89","0.08","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C16 H22 Si2 V -","- C16 H22 Si2 V -","- C64 H88 Si8 V4 -","4","0.5","","Holger Braunschweig; Martin Kaupp; Christopher J. Adams; Thomas Kupfer; Krzysztof Radacki; Sandra Schinzel","Synthesis, Reactivity, and Electronic Structure of [n]Vanadoarenophanes: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","11376","11393","10.1021/ja802034p","","","0.71073","MoKα","","0.0282","0.0269","","","0.0737","0.0748","","","","","","1.087","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108228","9.6364","0.0007","11.5492","0.0008","16.9744","0.0012","90","","90","","90","","1889.1","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 B2 N2 V -","- C20 H28 B2 N2 V -","- C80 H112 B8 N8 V4 -","4","1","","Holger Braunschweig; Martin Kaupp; Christopher J. Adams; Thomas Kupfer; Krzysztof Radacki; Sandra Schinzel","Synthesis, Reactivity, and Electronic Structure of [n]Vanadoarenophanes: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","11376","11393","10.1021/ja802034p","","","0.71073","MoKα","","0.0335","0.0323","","","0.0874","0.0886","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108229","17.62","0.0003","8.8212","0.0002","9.8947","0.0002","90","","91.371","0.001","90","","1537.49","0.05","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 B2 N2 V -","- C16 H22 B2 N2 V -","- C64 H88 B8 N8 V4 -","4","1","","Holger Braunschweig; Martin Kaupp; Christopher J. Adams; Thomas Kupfer; Krzysztof Radacki; Sandra Schinzel","Synthesis, Reactivity, and Electronic Structure of [n]Vanadoarenophanes: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","11376","11393","10.1021/ja802034p","","","0.71073","MoKα","","0.037","0.0335","","","0.0918","0.0958","","","","","","1.046","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108230","10.1225","0.0007","12.487","0.0008","19.2872","0.0012","93.159","0.004","90.694","0.004","93.629","0.004","2429","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H76 Li4 O7 V2 -","- C52 H76 Li4 O7 V2 -","- C104 H152 Li8 O14 V4 -","2","1","","Holger Braunschweig; Martin Kaupp; Christopher J. Adams; Thomas Kupfer; Krzysztof Radacki; Sandra Schinzel","Synthesis, Reactivity, and Electronic Structure of [n]Vanadoarenophanes: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","11376","11393","10.1021/ja802034p","","","0.71073","MoKα","","0.1143","0.0688","","","0.1456","0.1695","","","","","","1.048","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108231","11.5345","0.0007","15.7328","0.001","17.2495","0.0012","90","","90","","90","","3130.3","0.4","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C28 H50 B2 N2 P2 Pt V -","- C28 H50 B2 N2 P2 Pt V -","- C112 H200 B8 N8 P8 Pt4 V4 -","4","1","","Holger Braunschweig; Martin Kaupp; Christopher J. Adams; Thomas Kupfer; Krzysztof Radacki; Sandra Schinzel","Synthesis, Reactivity, and Electronic Structure of [n]Vanadoarenophanes: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","11376","11393","10.1021/ja802034p","","","0.71073","MoKα","","0.0311","0.0265","","","0.0593","0.0619","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108232","6.2221","0.0002","38.3377","0.0011","13.3179","0.0004","90","","90.42","0.001","90","","3176.78","0.17","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[1]boravanadoarenophan","[1]boradi-iso-propylaminvanadoarenophan","","- C18 H24 B N V -","- C18 H24 B N V -","- C144 H192 B8 N8 V8 -","8","2","","Holger Braunschweig; Martin Kaupp; Christopher J. Adams; Thomas Kupfer; Krzysztof Radacki; Sandra Schinzel","Synthesis, Reactivity, and Electronic Structure of [n]Vanadoarenophanes: An Experimental and Theoretical Study","Journal of the American Chemical Society","2008","130","","11376","11393","10.1021/ja802034p","","","0.71073","MoKα","","0.0402","0.0357","","","0.0855","0.0886","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108233","15.679","0.0014","9.331","0.0008","41.624","0.004","90","","90","","90","","6089.6","1","183","2","183","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C26 H22 N2 O2 -","- C26 H22 N2 O2 -","- C312 H264 N24 O24 -","12","3","","Manoj Mathews; Nobuyuki Tamaoki","Planar Chiral Azobenzenophanes as Chiroptic Switches for Photon Mode Reversible Reflection Color Control in Induced Chiral Nematic Liquid Crystals","Journal of the American Chemical Society","2008","130","","11409","11416","10.1021/ja802472t","","","0.71073","MoKα","","0.0522","0.0416","","","0.1064","0.1153","","","","","","1.023","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108234","25.279","0.005","7.7559","0.0014","19.608","0.003","90","","129.618","0.01","90","","2961.4","1","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H38 O6 -","- C32 H38 O6 -","- C128 H152 O24 -","4","1","","Rui Xu; W. Bernd Schweizer; Holger Frauenrath","Soluble Poly(diacetylene)s Using the Perfluorophenyl-Phenyl Motif as a Supramolecular Synthon","Journal of the American Chemical Society","2008","130","","11437","11445","10.1021/ja802964a","","","0.71073","MoKα","","0.2279","0.0545","","","0.1238","0.1495","","","","","","0.677","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108235","5.9343","0.0001","7.4644","0.0001","27.3032","0.0005","97.839","0.001","90.534","0.001","93.184","0.001","1196.1","0.03","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H42 F10 O10 -","- C52 H42 F10 O10 -","- C52 H42 F10 O10 -","1","0.5","","Rui Xu; W. Bernd Schweizer; Holger Frauenrath","Soluble Poly(diacetylene)s Using the Perfluorophenyl-Phenyl Motif as a Supramolecular Synthon","Journal of the American Chemical Society","2008","130","","11437","11445","10.1021/ja802964a","","","0.7107","MoKα","","0.0937","0.0732","","","0.2069","0.2269","","","","","","1.029","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108236","27.6013","0.0007","7.6701","0.0002","19.6075","0.0004","90","","102.358","0.0008","90","","4054.82","0.17","223","","","","","","","","","","Frauenrath laboratory","3","P 1 21/c 1","-P 2ybc","14","","","","- C44 H62 O6 -","- C44 H62 O6 -","- C176 H248 O24 -","4","1","","Rui Xu; W. Bernd Schweizer; Holger Frauenrath","Soluble Poly(diacetylene)s Using the Perfluorophenyl-Phenyl Motif as a Supramolecular Synthon","Journal of the American Chemical Society","2008","130","","11437","11445","10.1021/ja802964a","","","0.71073","MoKα","","0.1356","0.0851","","","0.2086","0.2343","","","","","","1.33","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108237","8.5415","0.0002","33.5644","0.0003","8.6075","0.0011","90","","98.629","0.002","90","","2439.8","0.3","203","","","","","","","","","","Frauenrath laboratory","4","P 1 21/c 1","-P 2ybc","14","","6-(4-(hexyloxy)benzoyloxy)hexa-2,4-diynyl 2,3,4,5,6-pentafluorobenzoate","","- C26 H21 F5 O5 -","- C26 H21 F5 O5 -","- C104 H84 F20 O20 -","4","1","","Rui Xu; W. Bernd Schweizer; Holger Frauenrath","Soluble Poly(diacetylene)s Using the Perfluorophenyl-Phenyl Motif as a Supramolecular Synthon","Journal of the American Chemical Society","2008","130","","11437","11445","10.1021/ja802964a","","","0.71073","MoKα","","0.1074","0.0709","","","0.1744","0.1988","","","","","","1.167","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108238","5.9798","0.0001","7.3408","0.0002","32.9975","0.0007","87.5755","0.0009","87.6095","0.0008","85.7851","0.001","1442.18","0.06","153","","","","","","","","","","Frauenrath laboratory","4","P -1","-P 1","2","","","","- C32 H33 F5 O5 -","- C32 H33 F5 O5 -","- C64 H66 F10 O10 -","2","1","","Rui Xu; W. Bernd Schweizer; Holger Frauenrath","Soluble Poly(diacetylene)s Using the Perfluorophenyl-Phenyl Motif as a Supramolecular Synthon","Journal of the American Chemical Society","2008","130","","11437","11445","10.1021/ja802964a","","","0.71073","MoKα","","0.1185","0.0642","","","0.1594","0.1886","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108239","5.928","0.0004","7.487","0.0005","32.386","0.001","87.02","0.0009","87.03","0.0008","86.46","0.001","1431","0.14","223","","223","","","","","","","","Frauenrath group","4","P -1","-P 1","2","","","","- C32 H33 F5 O5 -","- C32 H33 F5 O5 -","- C64 H66 F10 O10 -","2","1","","Rui Xu; W. Bernd Schweizer; Holger Frauenrath","Soluble Poly(diacetylene)s Using the Perfluorophenyl-Phenyl Motif as a Supramolecular Synthon","Journal of the American Chemical Society","2008","130","","11437","11445","10.1021/ja802964a","","x-ray","0.71073","MoKα","","0.3898","0.3575","","","","0.7172","","","","","","5.893","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108240","10.975","0.003","10.975","0.003","4.6804","0.0013","90","","90","","120","","488.2","0.2","298","2","298","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- La10 O3 Si8 -","- La10 O3 Si8 -","- La10 O3 Si8 -","1","0.0416667","","Limin Wang; Zhongjia Tang; Bernd Lorenz; Arnold M. Guloy","Remarkable Rare-Earth Metal Silicide Oxides with Planar Si6 Rings","Journal of the American Chemical Society","2008","130","","11258","11259","10.1021/ja803632x","","","0.71073","MoKα","","0.0144","0.0125","","","0.0263","0.0267","","","","","","0.996","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108241","10.8442","0.0012","10.8442","0.0012","4.5606","0.001","90","","90","","120","","464.46","0.13","298","2","298","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- Ce10 O3 Si8 -","- Ce10 O3 Si8 -","- Ce10 O3 Si8 -","1","0.0416667","","Limin Wang; Zhongjia Tang; Bernd Lorenz; Arnold M. Guloy","Remarkable Rare-Earth Metal Silicide Oxides with Planar Si6 Rings","Journal of the American Chemical Society","2008","130","","11258","11259","10.1021/ja803632x","","","0.71073","MoKα","","0.0143","0.013","","","0.0288","0.0291","","","","","","1.115","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108242","10.5097","0.0012","13.1602","0.0015","25.006","0.003","90","","93.528","0.002","90","","3452","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(BDI)Me2Nb(NCMe3)","","","- C35 H56 N3 Nb -","- C35 H56 N3 Nb -","- C140 H224 N12 Nb4 -","4","1","","Neil C. Tomson; Andrew Yan; John Arnold; Robert G. Bergman","An Unusally Diverse Array of Products Formed upon Carbonylation of a Dialkylniobium Complex","Journal of the American Chemical Society","2008","130","","11262","11263","10.1021/ja803729k","","x-ray","0.7749","synchrotron","","0.0474","0.0336","","","0.0806","0.0849","","","","","","1.215","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108243","16.941","0.003","20.984","0.004","19.668","0.004","90","","103.88","0.002","90","","6788","2","273","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(BDI)(CO)2Nb(NCMe3)","","","- C35 H50 N3 Nb O2 -","- C35 H50 N3 Nb O2 -","- C280 H400 N24 Nb8 O16 -","8","2","","Neil C. Tomson; Andrew Yan; John Arnold; Robert G. Bergman","An Unusally Diverse Array of Products Formed upon Carbonylation of a Dialkylniobium Complex","Journal of the American Chemical Society","2008","130","","11262","11263","10.1021/ja803729k","","","0.71073","MoKα","","0.0784","0.043","","","0.0972","0.113","","","","","","0.975","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108244","9.8916","0.0011","11.5679","0.0013","16.3201","0.0017","81.504","0.002","82.576","0.002","68.648","0.002","1714.4","0.3","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H56 N3 Nb O -","- C36 H56 N3 Nb O -","- C72 H112 N6 Nb2 O2 -","2","1","","Neil C. Tomson; Andrew Yan; John Arnold; Robert G. Bergman","An Unusally Diverse Array of Products Formed upon Carbonylation of a Dialkylniobium Complex","Journal of the American Chemical Society","2008","130","","11262","11263","10.1021/ja803729k","","x-ray","0.71073","MoKα","","0.054","0.0428","","","0.1023","0.1057","","","","","","1.073","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108245","13.398","0.005","14.714","0.005","18.212","0.006","90","","99.021","0.005","90","","3546","2","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H56 N3 Nb O -","- C36 H56 N3 Nb O -","- C144 H224 N12 Nb4 O4 -","4","1","","Neil C. Tomson; Andrew Yan; John Arnold; Robert G. Bergman","An Unusally Diverse Array of Products Formed upon Carbonylation of a Dialkylniobium Complex","Journal of the American Chemical Society","2008","130","","11262","11263","10.1021/ja803729k","","x-ray","0.71073","MoKα","","0.0723","0.0423","","","0.1039","0.1132","","","","","","1.116","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108246","12.253","0.003","13.004","0.003","13.033","0.003","99.359","0.003","93.498","0.003","94.676","0.003","2036.4","0.8","119","2","119","2","","","","","","","","4","P -1","-P 1","2","(BDI)(XylNCMe2)Nb(NCMe3)","","","- C44 H65 N4 Nb -","- C44 H65 N4 Nb -","- C88 H130 N8 Nb2 -","2","1","","Neil C. Tomson; Andrew Yan; John Arnold; Robert G. Bergman","An Unusally Diverse Array of Products Formed upon Carbonylation of a Dialkylniobium Complex","Journal of the American Chemical Society","2008","130","","11262","11263","10.1021/ja803729k","","x-ray","0.71073","MoKα","","0.0806","0.0476","","","0.0996","0.112","","","","","","0.994","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108247","10.8728","0.0009","10.6829","0.0009","10.876","0.0009","90","","116.472","0.001","90","","1130.83","0.16","173","2","173","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C32 H22 -","- C32 H22 -","- C64 H44 -","2","0.5","","Igor V. Alabugin; Kerry Gilmore; Satish Patil; Mariappan Manoharan; Serguei V. Kovalenko; Ronald J. Clark; Ion Ghiviriga","Radical Cascade Transformations of Tris(o-aryleneethynylenes) into Substituted Benzo[a]indeno[2,1-c]fluorenes","Journal of the American Chemical Society","2008","130","","11535","11545","10.1021/ja8038213","","","0.71073","MoKα","","0.0591","0.0567","","","0.1495","0.1518","","","","","","1.141","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108248","11.0954","0.0006","10.5677","0.0006","19.0897","0.0011","90","","90","","90","","2238.3","0.2","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H26 Si2 -","- C24 H26 Si2 -","- C96 H104 Si8 -","4","0.5","","Igor V. Alabugin; Kerry Gilmore; Satish Patil; Mariappan Manoharan; Serguei V. Kovalenko; Ronald J. Clark; Ion Ghiviriga","Radical Cascade Transformations of Tris(o-aryleneethynylenes) into Substituted Benzo[a]indeno[2,1-c]fluorenes","Journal of the American Chemical Society","2008","130","","11535","11545","10.1021/ja8038213","","","0.71073","MoKα","","0.0663","0.0651","","","0.1349","0.1356","","","","","","1.362","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108249","6.3621","0.0002","14.5128","0.0005","25.6079","0.0008","90","","90","","90","","2364.43","0.13","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 Br N O4 -","- C27 H24 Br N O4 -","- C108 H96 Br4 N4 O16 -","4","1","","Michael P. DeMartino; Ke Chen; Phil S. Baran","Intermolecular Enolate Heterocoupling: Scope, Mechanism, and Application","Journal of the American Chemical Society","2008","130","","11546","11560","10.1021/ja804159y","","","1.54178","CuKα","","0.0348","0.0319","","","0.0793","0.0813","","","","","","0.922","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108250","8.8772","0.0005","19.4494","0.001","24.4787","0.0013","90","","95.388","0.003","90","","4207.7","0.4","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 N2 O2 -","- C23 H26 N2 O2 -","- C184 H208 N16 O16 -","8","2","","Vincent César; Noël Lugan; Guy Lavigne","A Stable Anionic N-Heterocyclic Carbene and Its Zwitterionic Complexes","Journal of the American Chemical Society","2008","130","","11286","11287","10.1021/ja804296t","","x-ray","0.71073","MoKα","","0.1009","0.0579","","","0.1185","0.145","","","","","","1.093","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108251","17.493","0.005","21.431","0.005","26.96","0.005","90","0.005","97.401","0.005","90","0.005","10023","4","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C101 H139 Li3 N6 O14 -","- C93 H123 Li3 N6 O12 -","- C372 H492 Li12 N24 O48 -","4","1","","Vincent César; Noël Lugan; Guy Lavigne","A Stable Anionic N-Heterocyclic Carbene and Its Zwitterionic Complexes","Journal of the American Chemical Society","2008","130","","11286","11287","10.1021/ja804296t","","x-ray","0.71073","MoKα","","0.2252","0.1076","","","0.2784","0.3275","","","","","","1.03","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108252","10.1885","0.0005","10.3875","0.0004","13.9142","0.0006","71.898","0.002","80.947","0.003","76.125","0.002","1353.37","0.1","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H37 N2 O2 Rh -","- C31 H37 N2 O2 Rh -","- C62 H74 N4 O4 Rh2 -","2","1","","Vincent César; Noël Lugan; Guy Lavigne","A Stable Anionic N-Heterocyclic Carbene and Its Zwitterionic Complexes","Journal of the American Chemical Society","2008","130","","11286","11287","10.1021/ja804296t","","x-ray","0.71073","MoKα","","0.037","0.0315","","","0.0808","0.0874","","","","","","1.044","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108253","11.3816","0.0016","15.909","0.002","21.281","0.003","90","","90","","90","","3853.3","0.9","180","2","93","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C44 H46 Ag N2 O2 P -","- C44 H46 Ag N2 O2 P -","- C176 H184 Ag4 N8 O8 P4 -","4","0.5","","Vincent César; Noël Lugan; Guy Lavigne","A Stable Anionic N-Heterocyclic Carbene and Its Zwitterionic Complexes","Journal of the American Chemical Society","2008","130","","11286","11287","10.1021/ja804296t","","x-ray","0.71073","MoKα","","0.073","0.0642","","","0.1503","0.1556","","","","","","1.228","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108254","13.079","0.003","15.663","0.003","15.731","0.003","90","","90","","90","","3222.6","1.1","100","2","180","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H38 Cl2 Fe N2 O4 -","- C34 H38 Cl2 Fe N2 O4 -","- C136 H152 Cl8 Fe4 N8 O16 -","4","1","","Vincent César; Noël Lugan; Guy Lavigne","A Stable Anionic N-Heterocyclic Carbene and Its Zwitterionic Complexes","Journal of the American Chemical Society","2008","130","","11286","11287","10.1021/ja804296t","","x-ray","0.71073","MoKα","","0.023","0.0222","","","0.0588","0.0594","","","","","","1.083","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108255","9.9567","0.0003","15.2992","0.0005","16.3935","0.0005","90","","90","","90","","2497.21","0.13","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H38 N2 O2 -","- C30 H38 N2 O2 -","- C120 H152 N8 O8 -","4","1","","Bradley L. Nilsson; Larry E. Overman; Javier Read de Alaniz; Jason M. Rohde","Enantioselective Total Syntheses of Nankakurines A and B: Confirmation of Structure and Establishment of Absolute Configuration","Journal of the American Chemical Society","2008","130","","11297","11299","10.1021/ja804624u","","","0.71073","MoKα","","0.0333","0.032","","","0.0851","0.0868","","","","","","1.054","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108256","7.8258","0.0004","7.8258","0.0004","11.981","0.001","90","","90","","90","","733.75","0.08","","","25","","","","","","","","","5","P 42/m c m","-P 4c 2c","132","crystalline silicotitanate hydrate","","Sitinakite","- Cs1.44 H6.56 O32 Si4 Ti8 -","- Cs1.464 O32 Si4 Ti8 -","- Cs1.464 O32 Si4 Ti8 -","1","0.0625","","Aaron J. Celestian; James D. Kubicki; Jonathon Hanson; Abraham Clearfield; John B. Parise","The Mechanism Responsible for Extraordinary Cs Ion Selectivity in Crystalline Silicotitanate","Journal of the American Chemical Society","2008","130","","11689","11694","10.1021/ja801134a","powder diffraction","x-ray","0.92223","Monochromatic","","","","","","","","","6.5","4.19","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108257","13.427","0.005","13.44","0.005","24.95","0.009","101.217","0.009","95.838","0.01","105.366","0.011","4202","3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H80 Li4 N4 -","- C36 H80 Li4 N4 -","- C144 H320 Li16 N16 -","4","2","","Carsten Strohmann; Viktoria H. Gessner","Crystal Structures of n-BuLi Adducts with (R,R)-TMCDA and the Consequences for the Deprotonation of Benzene","Journal of the American Chemical Society","2008","130","","11719","11725","10.1021/ja8017187","","","0.71073","MoKα","","0.1276","0.0769","","","0.2097","0.2336","","","","","","1.028","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108258","8.765","0.003","25.083","0.008","9.466","0.003","90","","93.771","0.006","90","","2076.6","1.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H80 Li4 N4 -","- C36 H80 Li4 N4 -","- C72 H160 Li8 N8 -","2","1","","Carsten Strohmann; Viktoria H. Gessner","Crystal Structures of n-BuLi Adducts with (R,R)-TMCDA and the Consequences for the Deprotonation of Benzene","Journal of the American Chemical Society","2008","130","","11719","11725","10.1021/ja8017187","","","0.71073","MoKα","","0.0712","0.0592","","","0.1557","0.1635","","","","","","1.031","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108259","17.3647","0.0003","20.5552","0.0004","10.8911","0.0002","90","","90","","90","","3887.41","0.12","100","2","100","2","","","","","","","","3","I b a 2","I 2 -2c","45","","","","- C22 H32 N4 -","- C22 H32 N4 -","- C176 H256 N32 -","8","1","","Stephen F. Nelsen; Gaoquan Li; Kevin P. Schultz; Hieu Q. Tran; Ilia A. Guzei; Dennis H. Evans","Alkylated Trimethylene-Bridged Bis(p-Phenylenediamines)","Journal of the American Chemical Society","2008","130","","11620","11622","10.1021/ja802292g","","","1.54178","Mo-Kα","","0.0314","0.0297","","","0.0778","0.0793","","","","","","0.999","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108260","10.2619","0.0003","11.3556","0.0003","12.6191","0.0003","104.525","0.001","101.089","0.001","91.059","0.001","1393.48","0.06","444","2","444","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H48 N4 -","- C30 H48 N4 -","- C60 H96 N8 -","2","1","","Stephen F. Nelsen; Gaoquan Li; Kevin P. Schultz; Hieu Q. Tran; Ilia A. Guzei; Dennis H. Evans","Alkylated Trimethylene-Bridged Bis(p-Phenylenediamines)","Journal of the American Chemical Society","2008","130","","11620","11622","10.1021/ja802292g","","","1.54178","Cu-Kα","","0.0384","0.0372","","","0.103","0.1044","","","","","","0.983","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108261","7.601","0.0007","11.2909","0.001","11.3686","0.001","113.715","0.001","109.402","0.001","94.584","0.001","816.4","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H38 F12 N6 Sb2 -","- C26 H38 F12 N6 Sb2 -","- C26 H38 F12 N6 Sb2 -","1","0.5","","Stephen F. Nelsen; Gaoquan Li; Kevin P. Schultz; Hieu Q. Tran; Ilia A. Guzei; Dennis H. Evans","Alkylated Trimethylene-Bridged Bis(p-Phenylenediamines)","Journal of the American Chemical Society","2008","130","","11620","11622","10.1021/ja802292g","","","0.71073","Mo-Kα","","0.0278","0.0239","","","0.0582","0.0607","","","","","","1.054","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108262","21.8217","0.0009","7.252","0.0003","8.7815","0.0004","90","","90","","90","","1389.68","0.1","150","2","150","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C2 H7.5 O12.5 S2 Sb4 -","- C2 H6 O12.5 S2 Sb4 -","- C8 H24 O50 S8 Sb16 -","4","0.5","","Claudia H. Swanson; Harris A. Shaikh; David L. Rogow; Allen G. Oliver; Charles F. Campana; Scott R. J. Oliver","Antimony Oxide Hydroxide Ethanedisulfonate: a Cationic Layered Metal Oxide for Lewis Acid Applications","Journal of the American Chemical Society","2008","130","","11737","11741","10.1021/ja802420h","","","0.71073","MoKα","","0.0188","0.0166","","","0.0403","0.0407","","","","","","1.43","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108263","10.2777","0.0003","15.6945","0.0006","22.1373","0.0007","90","","100.634","0.002","90","","3509.5","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H50 Br Fe N3 O -","- C37 H50 Br Fe N3 O -","- C148 H200 Br4 Fe4 N12 O4 -","4","1","","Ryan J. Trovitch; Emil Lobkovsky; Paul J. Chirik","Bis(imino)pyridine Iron Alkyls Containing β-Hydrogens: Synthesis, Evaluation of Kinetic Stability, and Decomposition Pathways Involving Chelate Participation","Journal of the American Chemical Society","2008","130","","11631","11640","10.1021/ja803296f","","","0.71073","MoKα","","0.086","0.0461","","","0.1065","0.1244","","","","","","1.004","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108264","29.663","0.002","29.663","0.002","29.663","0.002","90","","90","","90","","26100","3","258","2","258","2","","","","","","","","6","I m -3 m","-I 4 2 3","229","MOP-14","","","- C360 H512 Br24 Cu24 N48 O180 -","- C192 H72 Br24 Cu24 O120 -","- C384 H144 Br48 Cu48 O240 -","2","0.0208333","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.1251","0.0793","","","0.1658","0.1887","","","","","","1.227","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108265","31.2356","0.0014","31.2356","0.0014","30.617","0.003","90","","90","","90","","29872","3","153","2","153","2","","","","","","","","5","I 4/m","-I 4","87","MOP-15","","","- C358 H578 Cu24 N74 O185 -","- C344 H428 Cu24 N76 O168 -","- C688 H856 Cu48 N152 O336 -","2","0.125","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0863","0.065","","","0.1829","0.1932","","","","","","1.008","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108266","40.654","0.013","39.94","0.013","28.935","0.009","90","","90","","90","","46982","3","258","2","258","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C398 H518 Cu24 N22 O160 -","- C320 H248 Cu24 O166 -","- C1280 H992 Cu96 O664 -","4","","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.219","0.0779","","","0.2221","0.2607","","","","","","0.979","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108267","44.289","0.002","39.49","0.002","37.176","0.002","90","","90","","90","","65020","6","153","2","153","2","","","","","","","","5","C m c e","-C 2ac 2","64","MOP-23","","","- C436 H556 Cu24 N28 O168 -","- C316 H188 Cu24 N6 O120 -","- C1264 H752 Cu96 N24 O480 -","4","0.25","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.1497","0.0843","","","0.2026","0.2282","","","","","","0.864","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4108268","38.3867","0.0009","38.3867","0.0009","141.831","0.003","90","","90","","120","","180994","7","258","2","258","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","MOP-24","","","- C656 H776 Cu24 N64 O188 -","- C336 H144 Cu24 O120 -","- C2016 H864 Cu144 O720 -","6","0.166667","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.2239","0.0682","","","0.1385","0.183","","","","","","0.958","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108269","15.3277","0.0006","15.3277","0.0006","24.322","0.0019","90","","90","","90","","5714.2","0.5","153","2","153","2","","","","","","","","4","P 42 21 2","P 4n 2n","94","MOF-222","","","- C36 H44.38 Cu2 O18.19 -","- C36 H36 Cu2 O18.79 -","- C144 H144 Cu8 O75.16 -","4","0.5","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0793","0.069","","","0.2135","0.2261","","","","","","1.088","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108270","22.241","0.002","12.7034","0.0012","17.6543","0.0016","90","","126.361","0.002","90","","4016.8","0.6","258","2","258","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","MOF-114","","","- C37 H37 N3 O15 S2 Zn2 -","- C37 H37 N3 O15 S2 Zn2 -","- C148 H148 N12 O60 S8 Zn8 -","4","0.5","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0325","0.0284","","","0.077","0.079","","","","","","1.047","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108271","13.22","0.003","15.123","0.003","11.734","0.002","90","","105.673","0.005","90","","2258.7","0.8","258","2","258","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","MOF-115","","","- C41 H45 Cu2 N3 O11 -","- C41 H34 Cu2 N3 O11 -","- C82 H68 Cu4 N6 O22 -","2","0.25","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0794","0.0611","","","0.1651","0.1777","","","","","","1.106","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108272","13.7184","0.0013","20.3881","0.0018","9.3906","0.0009","90","","93.442","0.004","90","","2621.7","0.4","233","2","233","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","MOF-116","","","- C60 H50 Cu2 N4 O11 -","- C54 H34 Cu2 N2 O8 -","- C108 H68 Cu4 N4 O16 -","2","0.25","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.1111","0.0821","","","0.23","0.2606","","","","","","1.002","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108273","10.0679","0.0014","18.449","0.003","14.567","0.002","90","","104.786","0.004","90","","2616.1","0.7","258","2","258","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","MOF-117","","","- C50 H60 Cu2 N4 O14 -","- C50 H60 Cu2 N4 O14 -","- C100 H120 Cu4 N8 O28 -","2","0.5","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.1449","0.0707","","","0.169","0.2115","","","","","","0.971","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108274","24.426","0.0016","17.8487","0.0011","15.1401","0.001","90","","90.036","0.001","90","","6600.7","0.7","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","MOF-118","","","- C55 H74 Cu2 N6 O17 -","- C34 H25 Cu2 N O9 -","- C136 H100 Cu8 N4 O36 -","4","1","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0885","0.0685","","","0.2005","0.2167","","","","","","1.041","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108275","10.0482","0.0009","18.2409","0.0016","26.895","0.002","90","","90","","90","","4929.5","0.7","233","2","233","2","","","","","","","","5","I b a m","-I 2 2c","72","MOF-119","","","- C45 H52 Cu2 N8 O13 -","- C37 H22 Cu2 N6 O18 -","- C148 H88 Cu8 N24 O72 -","4","0.25","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0985","0.0656","","","0.1793","0.2031","","","","","","1.056","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108276","44.0047","0.0015","44.0047","0.0015","12.2617","0.0004","90","","90","","120","","20562.7","1.2","223","2","223","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","MOF-601","","","- C49 H53 Cu2 N9 O15 -","- C35 H14 Cu2 N5 O10 -","- C315 H126 Cu18 N45 O90 -","9","0.25","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.0699","0.0547","","","0.1553","0.1637","","","","","","1.02","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108277","46.3352","0.0014","46.3352","0.0014","10.4693","0.0003","90","","90","","120","","19465.7","1","258","2","258","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","MOF-602","","","- C55 H78 Cu2 N6 O16 -","- C40 H38 Cu2 N2 O10 -","- C360 H342 Cu18 N18 O90 -","9","0.25","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.114","0.0532","","","0.1373","0.1536","","","","","","0.922","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108278","30.1786","0.0007","39.4019","0.0009","26.5077","0.0006","90","","120.931","0.001","90","","27037.6","1.1","223","2","223","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","MOF-603","","","- C42.33 H39.67 Cu2 I4 N3.67 O12.67 -","- C36.3333 H14.3333 Cu2 I4 N1.66667 O8.33333 -","- C436 H172 Cu24 I48 N20 O100 -","12","1.5","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.1224","0.0669","","","0.1774","0.1951","","","","","","0.84","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108279","24.1636","0.0016","17.671","0.0011","10.1065","0.0007","90","","113.969","0.002","90","","3943.3","0.5","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","MOF-604","","","- C38 H36 Cu2 N2 O10 -","- C38 H36 Cu2 N2 O10 -","- C152 H144 Cu8 N8 O40 -","4","0.5","","Hiroyasu Furukawa; Jaheon Kim; Nathan W. Ockwig; Michael O'Keeffe; Omar M. Yaghi","Control of Vertex Geometry, Structure Dimensionality, Functionality, and Pore Metrics in the Reticular Synthesis of Crystalline Metal-Organic Frameworks and Polyhedra","Journal of the American Chemical Society","2008","130","","11650","11661","10.1021/ja803783c","","","0.71073","MoKα","","0.1359","0.0918","","","0.2322","0.26","","","","","","1.067","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108280","37.22","0.007","37.22","0.007","43.77","0.009","90","","90.1","0.03","90","","60636","2","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C433 H375 Cd12 Cl24 N109 O98 -","- C432 H371 Cd12 Cl20 N109 O82 -","- C1728 H1484 Cd48 Cl80 N436 O328 -","4","1","","Nawal K. Al-Rasbi; Ian S. Tidmarsh; Stephen P. Argent; Harry Adams; Lindsay P. Harding; Michael D. Ward","Mixed-Ligand Molecular Paneling: Dodecanuclear Cuboctahedral Coordination Cages Based on a Combination of Edge-Bridging and Face-Capping Ligands","Journal of the American Chemical Society","2008","130","","11641","11649","10.1021/ja803847w","","","0.71073","MoKα","","0.2095","0.134","","","0.3464","0.3812","","","","","","1.075","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108281","17.262","0.0016","17.9425","0.0017","18.4478","0.0017","70.614","0.006","82.359","0.005","63.121","0.005","4806.5","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H79 Cd3 Cl6 N23 O26 -","- C82 H60 Cd3 Cl6 N23 O26 -","- C164 H120 Cd6 Cl12 N46 O52 -","2","1","","Nawal K. Al-Rasbi; Ian S. Tidmarsh; Stephen P. Argent; Harry Adams; Lindsay P. Harding; Michael D. Ward","Mixed-Ligand Molecular Paneling: Dodecanuclear Cuboctahedral Coordination Cages Based on a Combination of Edge-Bridging and Face-Capping Ligands","Journal of the American Chemical Society","2008","130","","11641","11649","10.1021/ja803847w","","","0.71073","MoKα","","0.1695","0.1095","","","0.2894","0.33","","","","","","1.073","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108282","8.135","0.001","12.229","0.002","16.238","0.002","90","","98.11","0.001","90","","1599.2","0.4","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H40 O7 Ru S2 -","- C30 H40 O7 Ru S2 -","- C60 H80 O14 Ru2 S4 -","2","1","","Alexey B. Zaitsev; Stefan Gruber; Pascal A. Plüss; Paul S. Pregosin; Luis F. Veiros; Michael Wörle","Fast and Highly Regioselective Allylation of Indole and Pyrrole Compounds by Allyl Alcohols Using Ru-Sulfonate Catalysts","Journal of the American Chemical Society","2008","130","","11604","11605","10.1021/ja804379k","","","0.71073","MoKα","","0.0812","0.0493","","","0.0971","0.1121","","","","","","1.054","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108283","12.072","0.003","11.15","0.003","13.468","0.004","90","0.002","108.622","0.002","90","0.002","1717.9","0.8","123.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","1","","Jun-ichi Matsuo; Shun Sasaki; Hiroyuki Tanaka; Hiroyuki Ishibashi","Lewis Acid-Catalyzed Intermolecular [4 + 2] Cycloaddition of 3-Alkoxycyclobutanones to Aldehydes and Ketones","Journal of the American Chemical Society","2008","130","","11600","11601","10.1021/ja8045684","","","0.7107","MoKα","","","0.0636","","","","0.0795","","","","","","1.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108284","11.3879","0.0007","11.6326","0.0007","13.4661","0.0005","84.178","0.009","84.793","0.008","78.075","0.009","1731.9","0.17","173.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H50 Cl Ir O S -","- C38 H40 Cl Ir O S -","- C76 H80 Cl2 Ir2 O2 S2 -","2","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0242","","","","0.0523","","","","","","1.148","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108285","11.3944","0.0019","11.658","0.002","13.423","0.003","84.368","0.004","84.664","0.005","78.034","0.005","1731.1","0.6","173.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H50 Cl O Rh S -","- C38 H40 Cl O Rh S -","- C76 H80 Cl2 O2 Rh2 S2 -","2","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0466","","","","0.1459","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108286","8.751","0.005","37.922","0.016","11.966","0.007","90","","92.817","0.01","90","","3966","4","173.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H57 Cl Ir P S -","- C44 H57 Cl Ir P S -","- C176 H228 Cl4 Ir4 P4 S4 -","4","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0472","","","","0.107","","","","","","0.948","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108287","19.474","0.003","18.11","0.003","19.662","0.003","90","","93.912","0.002","90","","6918.1","1.9","173.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C69 H61 B F24 Ir P S -","- C69 H52 B F23.88 Ir P S -","- C276 H208 B4 F95.52 Ir4 P4 S4 -","4","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0412","","","","0.113","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108288","19.672","0.003","18.066","0.003","19.481","0.004","90","","93.826","0.003","90","","6908","2","173.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C69 H61 B F24 P Rh S -","- C69 H52 B F23.88 P Rh S -","- C276 H208 B4 F95.52 P4 Rh4 S4 -","4","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0708","","","","0.1978","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108289","20.109","0.002","20.1593","0.0018","24.523","0.002","90","","90","","90","","9941.2","1.6","173.1","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C45 H39 B F24 Ir P -","- C45 H27 B F23.94 Ir P -","- C360 H216 B8 F191.52 Ir8 P8 -","8","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0594","","","","0.134","","","","","","1.314","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108290","12.4289","0.0016","28.292","0.003","20.207","0.003","90","","100.685","0.0019","90","","6982.4","1.6","173.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C69 H63 B F24 Ir P S -","- C69 H62 B F24 Ir P S -","- C276 H248 B4 F96 Ir4 P4 S4 -","4","1","","Yasuhiro Ohki; Mayumi Sakamoto; Kazuyuki Tatsumi","Reversible Heterolysis of H2 Mediated by an M-S(Thiolate) Bond (M = Ir, Rh): A Mechanistic Implication for [NiFe] Hydrogenase","Journal of the American Chemical Society","2008","130","","11610","11611","10.1021/ja804848w","","","0.7107","MoKα","","","0.0782","","","","0.2038","","","","","","1.071","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108291","10.516","0.005","34.131","0.015","11.577","0.005","90","","112.927","0.007","90","","3827","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H56 Cl2 N3 O2 Os P -","- C38 H56 Cl2 N3 O2 Os P -","- C152 H224 Cl8 N12 O8 Os4 P4 -","4","1","","Miguel A. Esteruelas; Ana B. Masamunt; Montserrat Oliván; Enrique Oñate; Marta Valencia","Aromatic Diosmatricyclic Nitrogen-Containing Compounds","Journal of the American Chemical Society","2008","130","","11612","11613","10.1021/ja8048892","","","0.71073","MoKα","","0.0871","0.049","","","0.0668","0.0739","","","","","","0.976","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108292","12.063","0.003","16.999","0.005","17.374","0.005","86.623","0.005","69.525","0.004","84.738","0.004","3322.2","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H119 N3 Os2 P4 -","- C66 H119 N3 Os2 P4 -","- C132 H238 N6 Os4 P8 -","2","1","","Miguel A. Esteruelas; Ana B. Masamunt; Montserrat Oliván; Enrique Oñate; Marta Valencia","Aromatic Diosmatricyclic Nitrogen-Containing Compounds","Journal of the American Chemical Society","2008","130","","11612","11613","10.1021/ja8048892","","","0.71073","MoKα","","0.072","0.0432","","","0.0766","0.0832","","","","","","0.9","","","","has coordinates,has disorder","178828","2020-10-21","18:00:00",""
"4108293","12.091","0.005","16.911","0.007","17.257","0.007","85.937","0.008","69.937","0.008","84.575","0.007","3297","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C63.5 H116 N2 Os2 P4 -","- C63.5 H116 N2 Os2 P4 -","- C127 H232 N4 Os4 P8 -","2","1","","Miguel A. Esteruelas; Ana B. Masamunt; Montserrat Oliván; Enrique Oñate; Marta Valencia","Aromatic Diosmatricyclic Nitrogen-Containing Compounds","Journal of the American Chemical Society","2008","130","","11612","11613","10.1021/ja8048892","","","0.71073","MoKα","","0.0569","0.0402","","","0.0847","0.0897","","","","","","0.975","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108294","9.5424","0.0007","11.2137","0.0008","21.7553","0.0016","90","","90","","90","","2327.9","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C23 H39 Li N2 O Si -","- C23 H39 Li N2 O Si -","- C92 H156 Li4 N8 O4 Si4 -","4","1","","Holger Ott; Christian Däschlein; Dirk Leusser; Daniel Schildbach; Timo Seibel; Dietmar Stalke; Carsten Strohmann","Structure/Reactivity Studies on an α-Lithiated Benzylsilane: Chemical Interpretation of Experimental Charge Density","Journal of the American Chemical Society","2008","130","","11901","11911","10.1021/ja711104q","","","0.71073","MoKα","","0.029","0.02","","","","0.031","0.024","","","","","2.595","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108295","8.9491","0.0009","14.9054","0.0014","18.5409","0.0018","90","","90","","90","","2473.2","0.4","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C20 H38 I N O Si Sn -","- C20 H38 I N O Si Sn -","- C80 H152 I4 N4 O4 Si4 Sn4 -","4","1","","Holger Ott; Christian Däschlein; Dirk Leusser; Daniel Schildbach; Timo Seibel; Dietmar Stalke; Carsten Strohmann","Structure/Reactivity Studies on an α-Lithiated Benzylsilane: Chemical Interpretation of Experimental Charge Density","Journal of the American Chemical Society","2008","130","","11901","11911","10.1021/ja711104q","","","0.71073","MoKα","","0.0329","0.0311","","","0.0638","0.0645","","","","","","1.138","","","","has coordinates","178828","2020-10-21","18:00:00",""
"4108296","21.38","0.006","7.175","0.002","32.098","0.009","90","","90","","90","","4924","2","193","2","193","2","","","","","","","","10","P c a 21","P 2c -2ac","29","","","","- C25 H50 B2 Cl2 F8 Fe4 N2 O8 P4 S4 -","- C25 H50 B2 Cl2 F8 Fe4 N2 O8 P4 S4 -","- C100 H200 B8 Cl8 F32 Fe16 N8 O32 P16 S16 -","4","1","","Matthew T. Olsen; Maurizio Bruschi; Luca De Gioia; Thomas B. Rauchfuss; Scott R. Wilson","Nitrosyl Derivatives of Diiron(I) Dithiolates Mimic the Structure and Lewis Acidity of the [FeFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2008","130","","12021","12030","10.1021/ja802268p","","","0.71073","MoKα","","0.0889","0.0396","","","0.0673","0.0764","","","","","","0.881","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108297","10.523","0.003","14.085","0.004","15.516","0.005","97.095","0.005","101.417","0.005","90.182","0.005","2236.1","1.2","193","2","193","2","","","","","","","","10","P -1","-P 1","2","","","","- C10 H15 B Cl2 F4 Fe2 N O5 P S2 -","- C10 H15 B Cl2 F4 Fe2 N O5 P S2 -","- C40 H60 B4 Cl8 F16 Fe8 N4 O20 P4 S8 -","4","2","","Matthew T. Olsen; Maurizio Bruschi; Luca De Gioia; Thomas B. Rauchfuss; Scott R. Wilson","Nitrosyl Derivatives of Diiron(I) Dithiolates Mimic the Structure and Lewis Acidity of the [FeFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2008","130","","12021","12030","10.1021/ja802268p","","","0.71073","MoKα","","0.076","0.0408","","","0.0922","0.105","","","","","","1.016","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108298","12.1879","0.0003","12.7453","0.0003","16.8713","0.0003","90","","94.754","0.001","90","","2611.75","0.1","193","2","193","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C14 H33 B F4 Fe2 N O3 P3 S2 -","- C14 H33 B F4 Fe2 N O3 P3 S2 -","- C56 H132 B4 F16 Fe8 N4 O12 P12 S8 -","4","1","","Matthew T. Olsen; Maurizio Bruschi; Luca De Gioia; Thomas B. Rauchfuss; Scott R. Wilson","Nitrosyl Derivatives of Diiron(I) Dithiolates Mimic the Structure and Lewis Acidity of the [FeFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2008","130","","12021","12030","10.1021/ja802268p","","","0.71073","MoKα","","0.0665","0.0479","","","0.118","0.1265","","","","","","1.068","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108299","11.7561","0.0003","16.5341","0.0004","12.1606","0.0003","90","","111.517","0.002","90","","2199","0.1","193","2","193","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C11 H22 B F4 Fe2 N O4 P2 S2 -","- C11 H22 B F4 Fe2 N O4 P2 S2 -","- C44 H88 B4 F16 Fe8 N4 O16 P8 S8 -","4","1","","Matthew T. Olsen; Maurizio Bruschi; Luca De Gioia; Thomas B. Rauchfuss; Scott R. Wilson","Nitrosyl Derivatives of Diiron(I) Dithiolates Mimic the Structure and Lewis Acidity of the [FeFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2008","130","","12021","12030","10.1021/ja802268p","","","0.71073","MoKα","","0.0452","0.0309","","","0.0732","0.0793","","","","","","1.028","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108300","6.6325","0.0003","20.7126","0.0008","9.5998","0.0004","90","","93.054","0.002","90","","1316.91","0.1","193","2","193","2","","","","","","","","10","P 1 21 1","P 2yb","4","","","","- C13 H26 B Cl2 F4 Fe2 N O4 P2 S2 -","- C13 H26 B Cl2 F4 Fe2 N O4 P2 S2 -","- C26 H52 B2 Cl4 F8 Fe4 N2 O8 P4 S4 -","2","1","","Matthew T. Olsen; Maurizio Bruschi; Luca De Gioia; Thomas B. Rauchfuss; Scott R. Wilson","Nitrosyl Derivatives of Diiron(I) Dithiolates Mimic the Structure and Lewis Acidity of the [FeFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2008","130","","12021","12030","10.1021/ja802268p","","","0.71073","MoKα","","0.039","0.0315","","","0.0667","0.07","","","","","","1.016","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108301","7.8326","0.0018","5.2167","0.0012","28.043","0.006","90","","97.071","0.005","90","","1137.1","0.4","162","2","423","2","","","","","","","","7","P 1 2 1","P 2y","3","","","","- C32 H68 Br N4 O15 Pd S2 -","- C32 H68 Br N4 O15 Pd S2 -","- C32 H68 Br N4 O15 Pd S2 -","1","0.5","","Shinya Takaishi; Mitsuhito Takamura; Takashi Kajiwara; Masahiro Yamashita; Muneaki Iwata; Hiroyuki Matsuzaki; Hiroshi Okamoto; Hisaaki Tanaka; Shin-ichi Kuroda; Hiroyuki Nishikawa; Hiroki Oshio; Kenichi Kato; Masaki Takata","Charge-Density-Wave to Mott-Hubbard Phase Transition in Quasi-One-Dimensional Bromo-Bridged Pd Compounds","Journal of the American Chemical Society","2008","130","","12080","12084","10.1021/ja8032026","","","0.71073","MoKα","","0.0471","0.0445","","","0.1161","0.1172","","","","","","1.03","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108302","15.725","0.009","10.569","0.006","28.364","0.016","90","","100.012","0.007","90","","4642","5","259","2","523","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C32 H66 Br N4 O15 Pd S2 -","- C32 H66 Br N4 O15 Pd S2 -","- C128 H264 Br4 N16 O60 Pd4 S8 -","4","1","","Shinya Takaishi; Mitsuhito Takamura; Takashi Kajiwara; Masahiro Yamashita; Muneaki Iwata; Hiroyuki Matsuzaki; Hiroshi Okamoto; Hisaaki Tanaka; Shin-ichi Kuroda; Hiroyuki Nishikawa; Hiroki Oshio; Kenichi Kato; Masaki Takata","Charge-Density-Wave to Mott-Hubbard Phase Transition in Quasi-One-Dimensional Bromo-Bridged Pd Compounds","Journal of the American Chemical Society","2008","130","","12080","12084","10.1021/ja8032026","","","0.71073","MoKα","","0.0845","0.0528","","","0.1342","0.1435","","","","","","0.979","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108303","15.406","0.002","12.3503","0.0013","21.961","0.002","90","","93.196","0.006","90","","4172","0.8","123","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H40 Cl2 N6 O15 Zn2 -","- C39 H40 Cl2 N6 O15 Zn2 -","- C156 H160 Cl8 N24 O60 Zn8 -","4","1","","Akio Ojida; Ippei Takashima; Takahiro Kohira; Hiroshi Nonaka; Itaru Hamachi","Turn-On Fluorescence Sensing of Nucleoside Polyphosphates Using a Xanthene-Based Zn(II) Complex Chemosensor","Journal of the American Chemical Society","2008","130","","12095","12101","10.1021/ja803262w","","","0.71075","MoKα","","","0.0541","","","","0.1306","","","","","","2.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108304","10.583","0.0001","18.6893","0.0002","12.2943","0.0002","90","","97.933","0.001","90","","2408.4","0.05","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H14 B11 Cl11 O3 -","- C4 H14 B11 Cl11 O3 -","- C16 H56 B44 Cl44 O12 -","4","1","","Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed","The Nature of the Hydrated Proton H(aq)+ in Organic Solvents","Journal of the American Chemical Society","2008","130","","12128","12138","10.1021/ja803535s","","","0.71073","MoKα","","0.0598","0.0381","","","0.079","0.0865","","","","","","1.048","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108305","13.1286","0.0004","10.2028","0.0003","15.7311","0.0004","90","","90","","90","","2107.16","0.1","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C H8 B11 Cl11 O3 -","- C H8 B11 Cl11 O3 -","- C4 H32 B44 Cl44 O12 -","4","1","","Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed","The Nature of the Hydrated Proton H(aq)+ in Organic Solvents","Journal of the American Chemical Society","2008","130","","12128","12138","10.1021/ja803535s","","","0.71073","MoKα","","0.019","0.0175","","","0.0434","0.0442","","","","","","1.054","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108306","10.1928","0.0004","17.8149","0.0008","12.4182","0.0005","90","","98.8445","0.0007","90","","2228.13","0.16","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C H10 B11 Cl11 O4 -","- C H10 B11 Cl11 O4 -","- C4 H40 B44 Cl44 O16 -","4","1","","Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed","The Nature of the Hydrated Proton H(aq)+ in Organic Solvents","Journal of the American Chemical Society","2008","130","","12128","12138","10.1021/ja803535s","","","0.71073","MoKα","","0.0238","0.0197","","","0.0543","0.0557","","","","","","1.078","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108307","25.2074","0.0012","15.1047","0.0007","19.778","0.0009","90","","95.174","0.003","90","","7499.8","0.6","90","2","90","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","Sc4O2@C80.NiOEP.2benzene","","","- C128 H56 N4 Ni O2 Sc4 -","- C128.32 H56 N4 Ni O2 Sc4 -","- C513.28 H224 N16 Ni4 O8 Sc16 -","4","0.5","","Steven Stevenson; Mary A. Mackey; Melissa A. Stuart; J. Paige Phillips; Michael L. Easterling; Christopher J. Chancellor; Marilyn M. Olmstead; Alan L. Balch","A Distorted Tetrahedral Metal Oxide Cluster inside an Icosahedral Carbon Cage. Synthesis, Isolation, and Structural Characterization of Sc4(μ3-O)2@Ih-C80","Journal of the American Chemical Society","2008","130","","11844","11845","10.1021/ja803679u","","","0.71073","MoKα","","0.14","0.1203","","","0.3233","0.3435","","","","","","1.037","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108308","15.6507","0.0007","22.6708","0.0007","19.8315","0.001","90","","90","","90","","7036.5","0.5","150","1","150","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C23.33333 H27.33333 Cl2 N2 O1.33333 -","- C23.3333 H27.3333 Cl2 N2 O1.33333 -","- C280 H328 Cl24 N24 O16 -","12","1.5","","Hyunwoo Kim; Yen Nguyen; Cindy Pai-Hui Yen; Leonid Chagal; Alan J. Lough; B. Moon Kim; Jik Chin","Stereospecific Synthesis of C2 Symmetric Diamines from the Mother Diamine by Resonance-Assisted Hydrogen-Bond Directed Diaza-Cope Rearrangement","Journal of the American Chemical Society","2008","130","","12184","12191","10.1021/ja803951u","","","0.71073","MoKα","","0.1101","0.0652","","","0.1608","0.1787","","","","","","0.995","","","","has coordinates","273129","2022-02-23","10:11:33",""
"4108309","16.4941","0.0007","8.9269","0.0005","17.8748","0.0009","90","","106.919","0.003","90","","2518","0.2","150","1","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 N4 O6 -","- C28 H22 N4 O6 -","- C112 H88 N16 O24 -","4","1","","Hyunwoo Kim; Yen Nguyen; Cindy Pai-Hui Yen; Leonid Chagal; Alan J. Lough; B. Moon Kim; Jik Chin","Stereospecific Synthesis of C2 Symmetric Diamines from the Mother Diamine by Resonance-Assisted Hydrogen-Bond Directed Diaza-Cope Rearrangement","Journal of the American Chemical Society","2008","130","","12184","12191","10.1021/ja803951u","","","0.71073","MoKα","","0.1092","0.0558","","","0.139","0.1721","","","","","","1.014","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108310","30.029","0.0011","15.919","0.0007","19.3815","0.0006","90","","127.409","0.0017","90","","7359.3","0.5","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C16 H24.25 Cl2 N2 O1.125 -","- C16 H24.25 Cl2 N2 O1.125 -","- C256 H388 Cl32 N32 O18 -","16","4","","Hyunwoo Kim; Yen Nguyen; Cindy Pai-Hui Yen; Leonid Chagal; Alan J. Lough; B. Moon Kim; Jik Chin","Stereospecific Synthesis of C2 Symmetric Diamines from the Mother Diamine by Resonance-Assisted Hydrogen-Bond Directed Diaza-Cope Rearrangement","Journal of the American Chemical Society","2008","130","","12184","12191","10.1021/ja803951u","","","0.71073","MoKα","","0.1174","0.0785","","","0.202","0.232","","","","","","1.019","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108311","12.194","0.002","17.001","0.003","31.552","0.006","90","","90","","90","","6541","2","100","2","100","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C63 H85 N8 O13 S3 -","- C63 H85 N8 O13 S3 -","- C252 H340 N32 O52 S12 -","4","1","","Silvia Cabrera; Efraim Reyes; José Alemán; Andrea Milelli; Sara Kobbelgaard; Karl Anker Jørgensen","Organocatalytic Asymmetric Synthesis of α,α-Disubstituted α-Amino Acids and Derivatives","Journal of the American Chemical Society","2008","130","","12031","12037","10.1021/ja804567h","","x-ray","0.71073","MoKα","","0.117","0.0682","","","0.1463","0.1631","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108312","11.5493","0.001","12.2399","0.001","22.961","0.002","90.795","0.005","100.549","0.005","113.895","0.005","2903.4","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H88 B2 Na O7 P2 Re -","- C60 H88 B2 Na O7 P2 Re -","- C120 H176 B4 Na2 O14 P4 Re2 -","2","1","","Alexander J. M. Miller; Jay A. Labinger; John E. Bercaw","Reductive Coupling of Carbon Monoxide in a Rhenium Carbonyl Complex with Pendant Lewis Acids","Journal of the American Chemical Society","2008","130","","11874","11875","10.1021/ja805108z","","","0.71073","MoKα","","0.095","0.0756","","","0.1263","0.1273","","","","","","2.715","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108313","11.2518","0.0005","13.3609","0.0006","16.3588","0.0007","88.406","0.003","74.156","0.003","80.3","0.003","2331.6","0.18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C98 H118 B4 Cl4 O8 P4 Re2 -","- C98 H118 B4 Cl4 O8 P4 Re2 -","- C98 H118 B4 Cl4 O8 P4 Re2 -","1","0.5","","Alexander J. M. Miller; Jay A. Labinger; John E. Bercaw","Reductive Coupling of Carbon Monoxide in a Rhenium Carbonyl Complex with Pendant Lewis Acids","Journal of the American Chemical Society","2008","130","","11874","11875","10.1021/ja805108z","","","0.71073","MoKα","","0.0521","0.0351","","","0.0668","0.0681","","","","","","1.248","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108314","11.5211","0.0005","12.3378","0.0005","23.1407","0.0008","81.125","0.002","81.14","0.002","67.21","0.002","2980.1","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C64 H91 B2 Na O8 P2 Re -","- C64 H91.036 B2 Na O8 P2 Re -","- C128 H182.072 B4 Na2 O16 P4 Re2 -","2","1","","Alexander J. M. Miller; Jay A. Labinger; John E. Bercaw","Reductive Coupling of Carbon Monoxide in a Rhenium Carbonyl Complex with Pendant Lewis Acids","Journal of the American Chemical Society","2008","130","","11874","11875","10.1021/ja805108z","","","0.71073","MoKα","","0.0691","0.044","","","0.0574","0.059","","","","","","1.696","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4108315","13.5643","0.001","14.4026","0.001","14.6998","0.0011","71.725","0.004","70.883","0.004","89.203","0.005","2563.9","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C50 H60 B3 Cl4 F4 O4 P2 Re -","- C50 H60 B3 Cl4 F4 O4 P2 Re -","- C100 H120 B6 Cl8 F8 O8 P4 Re2 -","2","1","","Alexander J. M. Miller; Jay A. Labinger; John E. Bercaw","Reductive Coupling of Carbon Monoxide in a Rhenium Carbonyl Complex with Pendant Lewis Acids","Journal of the American Chemical Society","2008","130","","11874","11875","10.1021/ja805108z","","","0.71073","MoKα","","0.1091","0.0515","","","0.0876","0.0895","","","","","","2.971","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108316","7.5319","0.0015","11.179","0.002","12.639","0.003","99.22","0.03","94.76","0.03","93.14","0.03","1044.3","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl N O6 -","- C22 H22 Cl N O6 -","- C44 H44 Cl2 N2 O12 -","2","1","","Ryan C. Clark; Sang Yeul Lee; Dale L. Boger","Total Synthesis of Chlorofusin, Its Seven Chromophore Diastereomers, and Key Partial Structures","Journal of the American Chemical Society","2008","130","","12355","12369","10.1021/ja8012819","","","0.71073","MoKα","","0.0883","0.0629","","","0.1419","0.1554","","","","","","1.071","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108317","7.9229","0.0016","20.997","0.004","25.787","0.005","90","","96.12","0.03","90","","4265.4","1.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Cl N O6 -","- C22 H22 Cl N O6 -","- C176 H176 Cl8 N8 O48 -","8","2","","Ryan C. Clark; Sang Yeul Lee; Dale L. Boger","Total Synthesis of Chlorofusin, Its Seven Chromophore Diastereomers, and Key Partial Structures","Journal of the American Chemical Society","2008","130","","12355","12369","10.1021/ja8012819","","","0.71073","MoKα","","0.0976","0.0675","","","0.1345","0.1486","","","","","","1.098","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108318","19.611","0.003","19.611","0.003","10.628","0.002","90","","90","","120","","3539.8","1","296","2","296","2","","","","","","","","5","P 63","P 6c","173","","","","- C21 H28 Cl N O6 -","- C21 H28 Cl N O6 -","- C126 H168 Cl6 N6 O36 -","6","1","","Ryan C. Clark; Sang Yeul Lee; Dale L. Boger","Total Synthesis of Chlorofusin, Its Seven Chromophore Diastereomers, and Key Partial Structures","Journal of the American Chemical Society","2008","130","","12355","12369","10.1021/ja8012819","","","0.71073","MoKα","","0.1321","0.108","","","0.2463","0.2632","","","","","","1.186","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108319","10.747","0.002","14.12","0.003","16.719","0.003","107.93","0.03","107.91","0.03","90.12","0.03","2283.7","1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H28 Cl N O6 -","- C21 H28 Cl N O6 -","- C84 H112 Cl4 N4 O24 -","4","2","","Ryan C. Clark; Sang Yeul Lee; Dale L. Boger","Total Synthesis of Chlorofusin, Its Seven Chromophore Diastereomers, and Key Partial Structures","Journal of the American Chemical Society","2008","130","","12355","12369","10.1021/ja8012819","","","0.71073","MoKα","","0.1341","0.0932","","","0.2253","0.2497","","","","","","1.104","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108320","15.759","0.009","18.471","0.01","31.051","0.017","90","","90.608","0.012","90","","9038","9","303.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 Ag2 Cr6 O72 Si W12 -","- C36 Ag2 Cr6 O72 Si W12 -","- C144 Ag8 Cr24 O288 Si4 W48 -","4","0.5","","Sayaka Uchida; Ryosuke Kawamoto; Hanae Tagami; Yoshinao Nakagawa; Noritaka Mizuno","Highly Selective Sorption of Small Unsaturated Hydrocarbons by Nonporous Flexible Framework with Silver Ion","Journal of the American Chemical Society","2008","130","","12370","12376","10.1021/ja801453c","","","0.7107","MoKα","","","0.1192","","","","0.167","","","","","","2.11","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108321","15.895","0.007","19.526","0.008","30.385","0.011","90","","90.958","0.007","90","","9429","7","153.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 Ag2 Cr6 O76 Si W12 -","- C36 Ag2 Cr6 O76 Si W12 -","- C144 Ag8 Cr24 O304 Si4 W48 -","4","0.5","","Sayaka Uchida; Ryosuke Kawamoto; Hanae Tagami; Yoshinao Nakagawa; Noritaka Mizuno","Highly Selective Sorption of Small Unsaturated Hydrocarbons by Nonporous Flexible Framework with Silver Ion","Journal of the American Chemical Society","2008","130","","12370","12376","10.1021/ja801453c","","","0.7107","MoKα","","","0.1358","","","","0.1777","","","","","","1.681","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108322","15.965","0.004","19.677","0.008","30.539","0.011","90","","91.154","0.006","90","","9592","6","248","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 Ag2 Cr6 O72 Si W12 -","- C40 Ag2 Cr6 O72 Si W12 -","- C160 Ag8 Cr24 O288 Si4 W48 -","4","0.5","","Sayaka Uchida; Ryosuke Kawamoto; Hanae Tagami; Yoshinao Nakagawa; Noritaka Mizuno","Highly Selective Sorption of Small Unsaturated Hydrocarbons by Nonporous Flexible Framework with Silver Ion","Journal of the American Chemical Society","2008","130","","12370","12376","10.1021/ja801453c","","","0.7107","MoKα","","","0.1862","","","","0.3812","","","","","","1.232","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108323","14.163","0.004","14.134","0.004","16.658","0.004","90","","90","","90","","3334.6","1.6","100","0.1","100","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","jonll04","","","- C18 H23 Cl N Rh -","- C18 H23 Cl N Rh -","- C144 H184 Cl8 N8 Rh8 -","8","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0267","0.0207","","","0.0492","0.0522","","","","","","1.047","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108324","14.216","0.003","14.109","0.003","16.637","0.003","90","","90","","90","","3336.9","1.2","100","0.1","100","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","jonll02","","","- C18 H23 Cl Ir N -","- C18 H23 Cl Ir N -","- C144 H184 Cl8 Ir8 N8 -","8","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0197","0.0152","","","0.033","0.0342","","","","","","1.044","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108325","7.4269","0.0007","14.7526","0.0014","16.9076","0.0016","90","","102.445","0.001","90","","1809","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","jonll14","","","- C21 H23 Cl N Rh -","- C21 H23 Cl N Rh -","- C84 H92 Cl4 N4 Rh4 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0276","0.023","","","0.0531","0.0548","","","","","","1.027","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108326","7.4813","0.001","17.176","0.002","28.082","0.004","90","","92.377","0.002","90","","3605.4","0.8","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","jonll13","","","- C21 H23 Cl Ir N -","- C21 H23 Cl Ir N -","- C168 H184 Cl8 Ir8 N8 -","8","2","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0272","0.0238","","","0.0465","0.0474","","","","","","1.147","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108327","8.1782","0.0007","14.4332","0.0013","15.9593","0.0014","90","","100.211","0.001","90","","1854","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","jonll24","","","- C23 H23 Cl N Rh -","- C23 H23 Cl N Rh -","- C92 H92 Cl4 N4 Rh4 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.039","0.0285","","","0.0602","0.064","","","","","","1.031","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108328","8.1872","0.0007","14.4049","0.0013","16.0988","0.0015","90","","100.911","0.001","90","","1864.3","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","jonll22","","","- C23 H23 Cl Ir N -","- C23 H23 Cl Ir N -","- C92 H92 Cl4 Ir4 N4 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0257","0.0212","","","0.0438","0.0452","","","","","","1.084","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108329","10.083","0.002","15.994","0.003","14.848","0.003","90","","104.125","0.003","90","","2322.1","0.8","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","jonll05","","","- C24 H29 Cl N O4 Rh -","- C24 H29 Cl N O4 Rh -","- C96 H116 Cl4 N4 O16 Rh4 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0226","0.0198","","","0.0498","0.0513","","","","","","1.043","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108330","10.0687","0.0014","16.002","0.002","14.879","0.002","90","","104.076","0.002","90","","2325.3","0.5","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","jonll03","","","- C24 H29 Cl Ir N O4 -","- C24 H29 Cl Ir N O4 -","- C96 H116 Cl4 Ir4 N4 O16 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0224","0.0179","","","0.042","0.0433","","","","","","1.033","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108331","10.2924","0.001","10.3114","0.001","14.0019","0.0013","105.008","0.001","92.503","0.001","94.958","0.001","1426.6","0.2","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","jonll23","","","- C28 H31 Cl3 N O4 Rh -","- C28 H31 Cl3 N O4 Rh -","- C56 H62 Cl6 N2 O8 Rh2 -","2","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0439","0.0326","","","0.0685","0.0735","","","","","","1.019","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108332","10.305","0.002","10.319","0.002","13.966","0.003","92.449","0.002","105.184","0.002","95.122","0.002","1424.2","0.5","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","jonll49","","","- C28 H31 Cl3 Ir N O4 -","- C28 H31 Cl3 Ir N O4 -","- C56 H62 Cl6 Ir2 N2 O8 -","2","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0237","0.021","","","0.0453","0.0463","","","","","","0.983","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108333","13.7783","0.0012","19.5301","0.0017","9.3512","0.0008","90","","90","","90","","2516.3","0.4","100","0.1","100","0.1","","","","","","","","6","P n a 21","P 2c -2n","33","jonll27","","","- C29 H29 Cl N O4 Rh -","- C29 H29 Cl N O4 Rh -","- C116 H116 Cl4 N4 O16 Rh4 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0354","0.0275","","","0.0573","0.0604","","","","","","1.026","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108334","9.7806","0.0019","10.864","0.002","27.439","0.005","90","","90.469","0.003","90","","2915.5","0.9","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","jonll50","","","- C30 H31 Cl3 Ir N O4 -","- C30 H31 Cl3 Ir N O4 -","- C120 H124 Cl12 Ir4 N4 O16 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0709","0.0396","","","0.0715","0.0835","","","","","","1.009","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108335","10.9364","0.001","7.0474","0.0007","20.1124","0.0019","90","","96.847","0.001","90","","1539.1","0.3","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","jonll15","","","- C14 H14 B F4 N O4 -","- C14 H14 B F4 N O4 -","- C56 H56 B4 F16 N4 O16 -","4","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0569","0.0424","","","0.1053","0.1158","","","","","","1.024","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108336","7.2288","0.0005","10.8213","0.0008","12.2774","0.0009","68.019","0.001","89.457","0.001","74.203","0.001","852.34","0.11","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","jonll26","","","- C19 H14 B F4 N O4 -","- C19 H14 B F4 N O4 -","- C38 H28 B2 F8 N2 O8 -","2","1","","Ling Li; William W. Brennessel; William D. Jones","An Efficient Low-Temperature Route to Polycyclic Isoquinoline Salt Synthesis via C-H Activation with [Cp*MCl2]2 (M = Rh, Ir)","Journal of the American Chemical Society","2008","130","","12414","12419","10.1021/ja802415h","","","0.71073","MoKα","","0.0666","0.0439","","","0.1103","0.1226","","","","","","1.058","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108337","13.409","0.005","12.052","0.005","20.006","0.005","90","","101.237","0.005","90","","3171.1","1.9","293","","293","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H33 Co3.25 F9 N3 O9 -","- C24 H33 Co3.5 F9 N3 O9 -","- C96 H132 Co14 F36 N12 O36 -","4","1","","Liviu F. Chibotaru; Liviu Ungur; Christophe Aronica; Hani Elmoll; Guillaume Pilet; Dominique Luneau","Structure, Magnetism, and Theoretical Study of a Mixed-Valence CoII3CoIII4 Heptanuclear Wheel: Lack of SMM Behavior despite Negative Magnetic Anisotropy","Journal of the American Chemical Society","2008","130","","12445","12455","10.1021/ja8029416","","","0.71069","MoKα","","0.1107","0.0506","","0.0692","0.0507","0.0507","","","","","","1.2173","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108338","5.099","0.001","11.694","0.002","23.476","0.005","90","","90","","90","","1399.8","0.5","90","","90","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(R)-N-((2-chloroethoxy)(phenyl)methyl)benzamide","","","- C16 H16 Cl N O2 -","- C16 H16 Cl N O2 -","- C64 H64 Cl4 N4 O8 -","4","1","","Guilong Li; Frank R. Fronczek; Jon C. Antilla","Catalytic Asymmetric Addition of Alcohols to Imines: Enantioselective Preparation of Chiral N,O-Aminals","Journal of the American Chemical Society","2008","130","","12216","12217","10.1021/ja8033334","","","0.71073","MoKα","","0.086","0.051","","","0.078","0.089","","","","","","1.069","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108339","5.8653","0.0005","7.5844","0.0007","26.955","0.002","90","","90","","90","","1199.09","0.17","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-(2-exo-norbornyl)-p-bromoaniline","","","- C13 H16 Br N -","- C13 H16 Br N -","- C52 H64 Br4 N4 -","4","1","","Jianrong (Steve) Zhou; John F. Hartwig","Intermolecular, Catalytic Asymmetric Hydroamination of Bicyclic Alkenes and Dienes in High Yield and Enantioselectivity","Journal of the American Chemical Society","2008","130","","12220","12221","10.1021/ja803523z","","","0.71073","MoKα","","0.0678","0.0284","","","0.0515","0.058","","","","","","0.86","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108340","15.699","0.001","11.016","0.001","12.468","0.001","90","","111.412","0.001","90","","2007.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H12 N2 O -","- C11 H12 N2 O -","- C88 H96 N16 O8 -","8","1","","Edward C. Lis; Rebecca J. Salomon; Michal Sabat; William H. Myers; W. Dean Harman","Synthesis of 1-Oxadecalins from Anisole Promoted by Tungsten","Journal of the American Chemical Society","2008","130","","12472","12476","10.1021/ja803605m","","","0.71074","MoKα","","0.0598","0.0499","","","0.1378","0.1466","","","","","","1.069","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108341","9.675","0.0019","9.456","0.0019","34.564","0.007","90","","90","","90","","3162.1","1.1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H20 N2 O2 S -","- C18 H20 N2 O2 S -","- C144 H160 N16 O16 S8 -","8","1","","Edward C. Lis; Rebecca J. Salomon; Michal Sabat; William H. Myers; W. Dean Harman","Synthesis of 1-Oxadecalins from Anisole Promoted by Tungsten","Journal of the American Chemical Society","2008","130","","12472","12476","10.1021/ja803605m","","","0.71073","MoKα","","0.126","0.0925","","","0.2683","0.3006","","","","","","1.035","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108342","12.3422","0.0013","20.007","0.002","14.4645","0.0015","90","","107.163","0.002","90","","3412.7","0.6","273","2","273","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C28 H37 B Cl2 N7 O3 P S W -","- C28 H37 B Cl2 N7 O3 P S W -","- C112 H148 B4 Cl8 N28 O12 P4 S4 W4 -","4","1","","Edward C. Lis; Rebecca J. Salomon; Michal Sabat; William H. Myers; W. Dean Harman","Synthesis of 1-Oxadecalins from Anisole Promoted by Tungsten","Journal of the American Chemical Society","2008","130","","12472","12476","10.1021/ja803605m","","","0.71073","MoKα","","0.1225","0.0497","","","0.0897","0.1062","","","","","","0.824","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108343","3.7079","0.001","15.074","0.005","18.491","0.006","90","","90","","90","","1033.5","0.6","298","2","298","2","","","","","","","","4","P m c 21","P 2c -2","26","","","","- K P Se6 Zr -","- K P Se6 Zr -","- K4 P4 Se24 Zr4 -","4","1","","Santanu Banerjee; Christos D. Malliakas; Joon I. Jang; John B. Ketterson; Mercouri G. Kanatzidis","1/\ιnfty[ZrPSe6-]: A Soluble Photoluminescent Inorganic Polymer and Strong Second Harmonic Generation Response of Its Alkali Salts","Journal of the American Chemical Society","2008","130","","12270","12272","10.1021/ja804166m","","","0.40663","synchrotron","","0.1885","0.0644","","","0.122","0.1646","","","","1.52","1.52","1.35","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108344","14.871","0.002","26.682","0.003","16.569","0.002","90","","110.17","0.02","90","","6171.2","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C65 H101 N4 O3 U -","- C65 H101 N4 O3 U -","- C260 H404 N16 O12 U4 -","4","1","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.1155","0.0643","","","0.1227","0.1369","","","","","","1.173","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108345","16.902","0.003","24.544","0.003","18.305","0.002","90","","107.196","0.011","90","","7254.2","1.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C82 H114 N3 O4 U -","- C82 H114 N3 O4 U -","- C328 H456 N12 O16 U4 -","4","1","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.1231","0.0547","","","0.087","0.1037","","","","","","0.993","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108346","14.841","0.002","14.841","0.002","15.8111","0.0008","90","","90","","120","","3015.9","0.6","100","2","100","2","","","","","","","","5","P 63","P 6c","173","","","","- C66 H114 N3 O4 U -","- C66 H78 N3 O4 U -","- C132 H156 N6 O8 U2 -","2","0.333333","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.0766","0.0359","","","0.0864","0.0996","","","","","","1.125","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108347","15.319","0.004","28.718","0.004","16.433","0.003","90","","108.962","0.014","90","","6837","2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C70.5 H99.75 N6.25 O5 U -","- C70.5 H99.75 N6.25 O5 U -","- C282 H399 N25 O20 U4 -","4","1","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.0719","0.0433","","","0.0867","0.0944","","","","","","1.107","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108348","14.754","0.001","26.672","0.006","16.825","0.003","90","","110.097","0.008","90","","6217.8","1.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H100 N4 O4 U -","- C64 H100 N4 O4 U -","- C256 H400 N16 O16 U4 -","4","1","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.1211","0.0562","","","0.0953","0.1113","","","","","","1.06","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108349","14.97","0.003","24.531","0.004","20.93","0.002","90","","96.82","0.01","90","","7632","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C84.25 H118.38 N5.38 O5.63 U -","- C84.248 H118.368 N5.376 O5.624 U -","- C336.992 H473.472 N21.504 O22.496 U4 -","4","1","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.0911","0.0499","","","0.0903","0.1004","","","","","","1.049","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108350","15.342","0.002","17.744","0.001","26.201","0.003","90","","94.49","0.02","90","","7110.8","1.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C69 H110 N4 O7 U -","- C69 H110 N4 O7 U -","- C276 H440 N16 O28 U4 -","4","1","","Suzanne C. Bart; Christian Anthon; Frank W. Heinemann; Eckhard Bill; Norman M. Edelstein; Karsten Meyer","Carbon Dioxide Activation with Sterically Pressured Mid- and High-Valent Uranium Complexes","Journal of the American Chemical Society","2008","130","","12536","12546","10.1021/ja804263w","","","0.71073","MoKα","","0.0579","0.0323","","","0.0718","0.0817","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108351","9.2966","0.0018","9.4895","0.0018","9.5352","0.0018","104.005","0.003","116.032","0.003","99.246","0.003","698.2","0.2","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C32 H38 N2 O6 -","2","1","","Joshua N. Payette; Hisashi Yamamoto","Nitrosobenzene-Mediated C-C Bond Cleavage Reactions and Spectral Observation of an Oxazetidin-4-one Ring System","Journal of the American Chemical Society","2008","130","","12276","12278","10.1021/ja804325f","","","0.71073","MoKα","","0.0697","0.0474","","","0.0978","0.1049","","","","","","0.946","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108352","10.219","0.003","6.4631","0.0017","14.713","0.004","90","","102.359","0.004","90","","949.2","0.5","100","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C19 H27 N O3 Si -","- C19 H27 N O3 Si -","- C38 H54 N2 O6 Si2 -","2","1","","Joshua N. Payette; Hisashi Yamamoto","Nitrosobenzene-Mediated C-C Bond Cleavage Reactions and Spectral Observation of an Oxazetidin-4-one Ring System","Journal of the American Chemical Society","2008","130","","12276","12278","10.1021/ja804325f","","","0.71073","MoKα","","0.0386","0.0356","","","0.0767","0.0781","","","","","","0.94","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108353","8.9975","0.0015","12.9799","0.0019","9.8043","0.0016","90","","90","","90","","1145","0.3","143","1","143","1","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C8 H16 Cu I N2 -","- C8 H16 Cu I N2 -","- C32 H64 Cu4 I4 N8 -","4","0.5","","J. Brian Hewgley; Shannon S. Stahl; Marisa C. Kozlowski","Mechanistic Study of Asymmetric Oxidative Biaryl Coupling: Evidence for Self-Processing of the Copper Catalyst to Achieve Control of Oxidase vs Oxygenase Activity","Journal of the American Chemical Society","2008","130","","12232","12233","10.1021/ja804570b","","","0.71073","MoKα","","0.0331","0.0296","","","0.0765","0.0786","","","","","","1.098","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108354","7.1311","0.0004","12.5109","0.0007","13.6583","0.0008","84.172","0.003","83.812","0.003","79.439","0.003","1186.75","0.12","143","1","143","1","","","","","","","","4","P -1","-P 1","2","","","","- C25 H18 Cl2 O10 -","- C25 H18 Cl2 O10 -","- C50 H36 Cl4 O20 -","2","1","","J. Brian Hewgley; Shannon S. Stahl; Marisa C. Kozlowski","Mechanistic Study of Asymmetric Oxidative Biaryl Coupling: Evidence for Self-Processing of the Copper Catalyst to Achieve Control of Oxidase vs Oxygenase Activity","Journal of the American Chemical Society","2008","130","","12232","12233","10.1021/ja804570b","","","0.71069","MoKα","","0.0618","0.0564","","","0.1585","0.1645","","","","","","1.061","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108355","7.7037","0.0004","12.2546","0.0008","21.0831","0.0012","90","","95.364","0.003","90","","1981.7","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Cu(OH2)(cage)]","","","- C21 H19 Cu N5 O5 -","- C21 H19 Cu N5 O5 -","- C84 H76 Cu4 N20 O20 -","4","1","","Katie L. Ciesienski; Kathryn L. Haas; Marina G. Dickens; Yohannes T. Tesema; Katherine J. Franz","A Photolabile Ligand for Light-Activated Release of Caged Copper","Journal of the American Chemical Society","2008","130","","12246","12247","10.1021/ja8047442","","","0.71073","MoKα","","0.0664","0.041","","","0.0983","0.1093","","","","","","1.152","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108356","10.6958","0.0006","5.6655","0.0003","16.4765","0.001","90","","102.599","0.001","90","","974.39","0.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 N2 O3 S -","- C8 H10 N2 O3 S -","- C32 H40 N8 O12 S4 -","4","1","","Le Li; Eric G. Klauber; Daniel Seidel","Catalytic Enantioselective Aldol Additions of α-Isothiocyanato Imides to Aldehydes","Journal of the American Chemical Society","2008","130","","12248","12249","10.1021/ja804838y","","","0.71073","MoKα","","0.0449","0.0373","","","0.098","0.1042","","","","","","0.923","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108357","10.9697","0.0005","5.1144","0.0003","11.8901","0.0006","90","","100.446","0.001","90","","656.02","0.06","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H15 N O4 S -","- C13 H15 N O4 S -","- C26 H30 N2 O8 S2 -","2","1","","Le Li; Eric G. Klauber; Daniel Seidel","Catalytic Enantioselective Aldol Additions of α-Isothiocyanato Imides to Aldehydes","Journal of the American Chemical Society","2008","130","","12248","12249","10.1021/ja804838y","","","0.71073","MoKα","","0.0285","0.0279","","","0.0707","0.0711","","","","","","1.003","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108358","22.9183","0.0011","7.1479","0.0003","22.6542","0.0011","90","","94.972","0.001","90","","3697.2","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H20 N2 O5 S2 -","- C17 H20 N2 O5 S2 -","- C136 H160 N16 O40 S16 -","8","1","","Le Li; Eric G. Klauber; Daniel Seidel","Catalytic Enantioselective Aldol Additions of α-Isothiocyanato Imides to Aldehydes","Journal of the American Chemical Society","2008","130","","12248","12249","10.1021/ja804838y","","","0.71073","MoKα","","0.0387","0.0343","","","0.0837","0.0865","","","","","","1.003","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108359","10.433","0.004","11.79","0.005","14.866","0.007","81.444","0.016","82.486","0.018","76.746","0.014","1751.2","1.3","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H37 B N4 O -","- C48 H37 B N4 O -","- C96 H74 B2 N8 O2 -","2","1","","Yasuhide Inokuma; Shanmugam Easwaramoorthi; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-(4-(N,N-Dialkylamino)phenyl)-Substituted Subporphyrins: Remarkably Perturbed Absorption Spectra and Enhanced Fluorescence by Intramolecular Charge Transfer Interactions","Journal of the American Chemical Society","2008","130","","12234","12235","10.1021/ja804846v","","","0.71075","MoKα","","0.0879","0.0534","","","0.1175","0.1338","","","","","","1.022","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108360","15.615","0.003","29.921","0.004","29.357","0.004","90","","90","","90","","13716","4","123","2","123","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C79.35 H69.7 B Cl4.7 N6 O -","- C79.35 H69.7 B Cl4.7 N6 O -","- C634.8 H557.6 B8 Cl37.6 N48 O8 -","8","1","","Yasuhide Inokuma; Shanmugam Easwaramoorthi; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-(4-(N,N-Dialkylamino)phenyl)-Substituted Subporphyrins: Remarkably Perturbed Absorption Spectra and Enhanced Fluorescence by Intramolecular Charge Transfer Interactions","Journal of the American Chemical Society","2008","130","","12234","12235","10.1021/ja804846v","","","0.71075","MoKα","","0.1076","0.0722","","","0.2107","0.2411","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108361","12.0051","0.0006","13.3719","0.0007","13.6933","0.0007","110.572","0.0007","102.316","0.0007","103.599","0.0007","1891.6","0.17","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C88 H110 N2 Sn2 -","- C88 H110 N2 Sn2 -","- C88 H110 N2 Sn2 -","1","0.5","","Yang Peng; Bobby D. Ellis; Xinping Wang; Philip P. Power","Diarylstannylene Activation of Hydrogen or Ammonia with Arene Elimination","Journal of the American Chemical Society","2008","130","","12268","12269","10.1021/ja805358u","","","0.71073","MoKα","","0.0268","0.022","","","0.0552","0.0578","","","","","","1.044","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108362","9.7446","0.0005","11.3016","0.0006","16.3463","0.0009","84.978","0.003","82.942","0.003","73.809","0.003","1713.03","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H57 Cl2 N2 P Ru -","- C35 H57 Cl2 N2 P Ru -","- C70 H114 Cl4 N4 P2 Ru2 -","2","1","","Andrew J. Boydston; Yan Xia; Julia A. Kornfield; Irina A. Gorodetskaya; Robert H. Grubbs","Cyclic Ruthenium-Alkylidene Catalysts for Ring-Expansion Metathesis Polymerization","Journal of the American Chemical Society","2008","130","","12775","12782","10.1021/ja8037849","","","0.71073","MoKα","","0.0885","0.0521","","","0.0694","0.072","","","","","","2.028","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108363","17.2664","0.0015","11.8916","0.0011","19.2386","0.0017","90","","107.393","0.002","90","","3769.6","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H60 Cl2 N2 P Ru -","- C39 H60 Cl2 N2 P Ru -","- C156 H240 Cl8 N8 P4 Ru4 -","4","1","","Andrew J. Boydston; Yan Xia; Julia A. Kornfield; Irina A. Gorodetskaya; Robert H. Grubbs","Cyclic Ruthenium-Alkylidene Catalysts for Ring-Expansion Metathesis Polymerization","Journal of the American Chemical Society","2008","130","","12775","12782","10.1021/ja8037849","","","0.71073","MoKα","","0.0489","0.0341","","","0.0717","0.0754","","","","","","1.676","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108364","10.0249","0.0005","12.835","0.0006","16.6189","0.0008","102.525","0.003","90.596","0.003","106.768","0.003","1992.6","0.17","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H71 Cl2 N2 P Ru -","- C41 H71 Cl2 N2 P Ru -","- C82 H142 Cl4 N4 P2 Ru2 -","2","1","","Andrew J. Boydston; Yan Xia; Julia A. Kornfield; Irina A. Gorodetskaya; Robert H. Grubbs","Cyclic Ruthenium-Alkylidene Catalysts for Ring-Expansion Metathesis Polymerization","Journal of the American Chemical Society","2008","130","","12775","12782","10.1021/ja8037849","","","0.71073","MoKα","","0.0749","0.046","","","0.0734","0.076","","","","","","1.356","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4108365","16.0931","0.0018","40.136","0.005","13.9991","0.0016","90","","111.896","0.002","90","","8389.9","1.7","193","2","193","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C22 H42 Cl2 N2 O3 S2 W -","- C22 H42 Cl2 N2 O3 S2 W -","- C264 H504 Cl24 N24 O36 S24 W12 -","12","3","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0382","0.0345","","","0.0716","0.074","","","","","","1.012","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108366","13.2607","0.0009","14.9006","0.001","14.3014","0.001","90","","93.356","0.001","90","","2821","0.3","193","2","193","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C22 H42 Cl2 Mo N2 O3 S2 -","- C22 H42 Cl2 Mo N2 O3 S2 -","- C88 H168 Cl8 Mo4 N8 O12 S8 -","4","1","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0275","0.0265","","","0.0657","0.0667","","","","","","1.055","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108367","10.476","0.0002","10.476","0.0002","27.2433","0.0011","90","","90","","90","","2989.86","0.15","193","2","193","2","","","","","","","","6","P 43","P 4cw","78","","","","- C26 H52 N2 O3 S2 W -","- C26 H52 N2 O3 S2 W -","- C104 H208 N8 O12 S8 W4 -","4","1","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0211","0.0193","","","0.0437","0.0444","","","","","","0.967","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108368","11.0172","0.0007","14.7202","0.0009","19.881","0.0012","90","","90","","90","","3224.2","0.3","188","2","188","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H51 N3 O2 S4 W -","- C25 H51 N3 O2 S4 W -","- C100 H204 N12 O8 S16 W4 -","4","1","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0254","0.023","","","0.05","0.051","","","","","","1.061","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108369","13.9726","0.0009","14.3223","0.0009","29.797","0.002","90","","90","","90","","5963","0.7","193","2","193","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C22 H42 Cl2 N2 O S4 W -","- C22 H22 Cl2 N2 O S4 W -","- C176 H176 Cl16 N16 O8 S32 W8 -","8","1","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0919","0.0813","","","0.2129","0.2275","","","","","","1.083","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108370","21.347","0.004","9.5082","0.0017","16.045","0.003","90","","109.008","0.003","90","","3079.1","1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H50 N2 O1.5 S3.5 W -","- C26 H52 N2 O1.5 S3.5 W -","- C104 H208 N8 O6 S14 W4 -","4","1","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0505","0.0368","","","0.0826","0.0897","","","","","","1.017","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108371","10.1752","0.0008","16.6951","0.0012","21.7024","0.0015","110.262","0.001","100.372","0.002","91.711","0.001","3385","0.4","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H43 N O S4 Si W -","- C30 H43 N O S4 Si W -","- C120 H172 N4 O4 S16 Si4 W4 -","4","2","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.0592","0.0409","","","0.0938","0.1055","","","","","","0.987","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108372","9.2753","0.0009","9.9505","0.001","20.736","0.002","79.19","0.002","88.356","0.002","64.132","0.001","1688.4","0.3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H39 N O S4 Si W -","- C32 H39 N O S4 Si W -","- C64 H78 N2 O2 S8 Si2 W2 -","2","1","","Stanislav Groysman; Jun-Jieh Wang; Ranitendranath Tagore; Sonny C. Lee; Richard H. Holm","A Biomimetic Approach to Oxidized Sites in the Xanthine Oxidoreductase Family: Synthesis and Stereochemistry of Tungsten(VI) Analogue Complexes","Journal of the American Chemical Society","2008","130","","12794","12807","10.1021/ja804000k","","","0.71073","MoKα","","0.048","0.0408","","","0.0987","0.1056","","","","","","0.951","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108373","15.733","0.002","14.3721","0.0019","13.6617","0.0018","90","","102.852","0.002","90","","3011.7","0.7","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 Cl2 Cu2 N6 O6 -","- C26 H38 Cl2 Cu2 N6 O6 -","- C104 H152 Cl8 Cu8 N24 O24 -","4","1","","Lijun Tang; Jinhee Park; Hae-Jo Kim; Youngmee Kim; Sung Jin Kim; Jik Chin; Kwan Mook Kim","Tight Binding and Fluorescent Sensing of Oxalate in Water","Journal of the American Chemical Society","2008","130","","12606","12607","10.1021/ja804753n","","","0.71073","MoKα","","0.0478","0.0357","","","0.0961","0.1009","","","","","","1.055","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108374","10.6171","0.0003","12.0557","0.0004","15.7265","0.0007","90","","108.334","0.001","90","","1910.76","0.12","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 Br N2 O2 S2 -","- C19 H19 Br N2 O2 S2 -","- C76 H76 Br4 N8 O8 S8 -","4","1","","Venukrishnan Komanduri; Christopher D. Grant; Michael J. Krische","Branch-Selective Reductive Coupling of 2-Vinyl Pyridines and Imines via Rhodium Catalyzed C-C Bond Forming Hydrogenation","Journal of the American Chemical Society","2008","130","","12592","12593","10.1021/ja805056g","","","0.71073","MoKα","","0.0404","0.0291","","","0.0653","0.07","","","","","","0.997","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108375","18.0042","0.0003","19.4639","0.0003","17.5579","0.0002","90","","113.538","0.0006","90","","5640.88","0.15","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C79.5 H41 N O10 S3 -","- C79.5 H41 N O10 S3 -","- C318 H164 N4 O40 S12 -","4","1","","Gaihong Zhang; Shaohua Huang; Zuo Xiao; Quan Chen; Liangbing Gan; Zheming Wang","Preparation of Azafullerene Derivatives from Fullerene-Mixed Peroxides and Single Crystal X-ray Structures of Azafulleroid and Azafullerene","Journal of the American Chemical Society","2008","130","","12614","12615","10.1021/ja805072h","","","0.71073","MoKα","","0.16","0.0834","","","0.207","0.2391","","","","","","1.012","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4108376","21.7515","0.0003","22.0969","0.0005","10.217","0.0002","90","","90","","90","","4910.71","0.16","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C75 H36 Br N O8 -","- C75 H36 Br N O8 -","- C300 H144 Br4 N4 O32 -","4","0.5","","Gaihong Zhang; Shaohua Huang; Zuo Xiao; Quan Chen; Liangbing Gan; Zheming Wang","Preparation of Azafullerene Derivatives from Fullerene-Mixed Peroxides and Single Crystal X-ray Structures of Azafulleroid and Azafullerene","Journal of the American Chemical Society","2008","130","","12614","12615","10.1021/ja805072h","","","0.71073","MoKα","","0.1147","0.0503","","","0.1201","0.1408","","","","","","0.989","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108377","17.2715","0.0004","17.2715","0.0004","17.2715","0.0004","90","","90","","90","","5152.2","0.2","153","2","153","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","ZIF-90","","","- C48 H36 N24 O12 Zn6 -","- C48 H36 N24 O12 Zn6 -","- C96 H72 N48 O24 Zn12 -","2","0.0416667","","William Morris; Christian J. Doonan; Hiroyasu Furukawa; Rahul Banerjee; Omar M. Yaghi","Crystals as Molecules: Postsynthesis Covalent Functionalization of Zeolitic Imidazolate Frameworks","Journal of the American Chemical Society","2008","130","","12626","12627","10.1021/ja805222x","","","1.54178","CuKα","","0.1455","0.1447","","","0.3474","0.3497","","","","","","1.838","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108378","9.699","0.002","9.703","0.002","10.404","0.002","67.072","0.002","80.77","0.003","67.852","0.002","835.1","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H10 B F10 P -","- C16 H10 B F10 P -","- C32 H20 B2 F20 P2 -","2","1","","Stephen J. Geier; Thomas M. Gilbert; Douglas W. Stephan","Activation of H2 by Phosphinoboranes R2PB(C6F5)2","Journal of the American Chemical Society","2008","130","","12632","12633","10.1021/ja805493y","","","0.71073","MoKα","","0.0544","0.039","","","0.0942","0.1029","","","","","","1.035","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108379","12.194","0.009","18.331","0.013","19.774","0.014","90","","90","","90","","4420","6","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H18 B F10 P -","- C20 H18 B F10 P -","- C160 H144 B8 F80 P8 -","8","1","","Stephen J. Geier; Thomas M. Gilbert; Douglas W. Stephan","Activation of H2 by Phosphinoboranes R2PB(C6F5)2","Journal of the American Chemical Society","2008","130","","12632","12633","10.1021/ja805493y","","","0.71073","MoKα","","0.0821","0.0553","","","0.1494","0.1889","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108380","9.542","0.0017","12.872","0.002","19.447","0.003","96.656","0.002","95.583","0.002","109.144","0.002","2217.8","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 B F10 P -","- C20 H19 B F10 P -","- C80 H76 B4 F40 P4 -","4","2","","Stephen J. Geier; Thomas M. Gilbert; Douglas W. Stephan","Activation of H2 by Phosphinoboranes R2PB(C6F5)2","Journal of the American Chemical Society","2008","130","","12632","12633","10.1021/ja805493y","","","0.71073","MoKα","","0.2563","0.0949","","","0.2123","0.2839","","","","","","0.952","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108381","11.0086","0.0011","26.657","0.003","12.6812","0.0012","90","","111.034","0.002","90","","3473.4","0.6","373","2","373","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H63 N Ni P2 -","- C33 H63 N Ni P2 -","- C132 H252 N4 Ni4 P8 -","4","0.5","","Rory Waterman; Gregory L. Hillhouse","η2-Organoazide Complexes of Nickel and Their Conversion to Terminal Imido Complexes via Dinitrogen Extrusion","Journal of the American Chemical Society","2008","130","","12628","12629","10.1021/ja805530z","","","0.71073","MoKα","","0.0786","0.0687","","","0.2088","0.2167","","","","","","1.114","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108382","8.6921","0.0008","21.3953","0.0019","16.4939","0.0015","90","","102.456","0.002","90","","2995.2","0.5","373","2","373","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H51 N3 Ni P2 -","- C27 H51 N3 Ni P2 -","- C108 H204 N12 Ni4 P8 -","4","1","","Rory Waterman; Gregory L. Hillhouse","η2-Organoazide Complexes of Nickel and Their Conversion to Terminal Imido Complexes via Dinitrogen Extrusion","Journal of the American Chemical Society","2008","130","","12628","12629","10.1021/ja805530z","","","0.71073","MoKα","","0.0703","0.0517","","","0.1087","0.1158","","","","","","1.035","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108383","19.401","0.003","16.398","0.002","20.871","0.003","90","","101.635","0.003","90","","6503.4","1.6","373","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30.5 H58 N Ni P2 -","- C30.5 H58 N Ni P2 -","- C244 H464 N8 Ni8 P16 -","8","1","","Rory Waterman; Gregory L. Hillhouse","η2-Organoazide Complexes of Nickel and Their Conversion to Terminal Imido Complexes via Dinitrogen Extrusion","Journal of the American Chemical Society","2008","130","","12628","12629","10.1021/ja805530z","","","0.71073","MoKα","","0.0688","0.0515","","","0.1195","0.1264","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108384","11.7111","0.0014","15.1445","0.0019","17.514","0.002","90","","98.285","0.002","90","","3073.8","0.6","378","2","378","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H55 N3 Ni O0 P2 -","- C28 H55 N3 Ni P2 -","- C112 H220 N12 Ni4 P8 -","4","1","","Rory Waterman; Gregory L. Hillhouse","η2-Organoazide Complexes of Nickel and Their Conversion to Terminal Imido Complexes via Dinitrogen Extrusion","Journal of the American Chemical Society","2008","130","","12628","12629","10.1021/ja805530z","","","0.71073","MoKα","","0.0574","0.0447","","","0.0958","0.1007","","","","","","1.026","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108385","11.3584","0.0013","22.03","0.003","20.938","0.002","90","","101.35","0.001","90","","5136.8","1","90","","90","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Gd@C82Ad","Gd@C82Ad","","- C96.5 H15.5 Cl1.5 Gd S3 -","- C96.5 H15.5 Cl1.5 Gd S3 -","- C386 H62 Cl6 Gd4 S12 -","4","1","","Takeshi Akasaka; Takayoshi Kono; Yuji Takematsu; Hidefumi Nikawa; Tsukasa Nakahodo; Takatsugu Wakahara; Midori O. Ishitsuka; Takahiro Tsuchiya; Yutaka Maeda; Michael T. H. Liu; Kenji Yoza; Tatsuhisa Kato; Kazunori Yamamoto; Naomi Mizorogi; Zdenek Slanina; Shigeru Nagase","Does Gd@C82 Have an Anomalous Endohedral Structure? Synthesis and Single Crystal X-ray Structure of the Carbene Adduct","Journal of the American Chemical Society","2008","130","","12840","12841","10.1021/ja802156n","","x-ray","0.71073","MoKα","","0.0763","0.0661","","","0.157","0.1644","","","","","","1.049","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108386","11.3888","0.0012","22.081","0.002","21.014","0.002","90","","101.249","0.001","90","","5183","0.9","213","","213","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Gd@C82Ad","Gd@C82Ad","","- C96.5 H15.5 Cl1.5 Gd S3 -","- C96.5 H15.5 Cl1.5 Gd S3 -","- C386 H62 Cl6 Gd4 S12 -","4","1","","Takeshi Akasaka; Takayoshi Kono; Yuji Takematsu; Hidefumi Nikawa; Tsukasa Nakahodo; Takatsugu Wakahara; Midori O. Ishitsuka; Takahiro Tsuchiya; Yutaka Maeda; Michael T. H. Liu; Kenji Yoza; Tatsuhisa Kato; Kazunori Yamamoto; Naomi Mizorogi; Zdenek Slanina; Shigeru Nagase","Does Gd@C82 Have an Anomalous Endohedral Structure? Synthesis and Single Crystal X-ray Structure of the Carbene Adduct","Journal of the American Chemical Society","2008","130","","12840","12841","10.1021/ja802156n","","x-ray","0.71073","MoKα","","0.0876","0.0735","","","0.1824","0.1933","","","","","","1.044","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108387","11.41","0.004","22.139","0.008","21.097","0.008","90","","101.145","0.004","90","","5229","3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Gd@C82Ad","Gd@C82Ad","","- C96.5 H15.5 Cl1.5 Gd S3 -","- C96.423 H15.5 Cl1.5 Gd S3 -","- C385.692 H62 Cl6 Gd4 S12 -","4","1","","Takeshi Akasaka; Takayoshi Kono; Yuji Takematsu; Hidefumi Nikawa; Tsukasa Nakahodo; Takatsugu Wakahara; Midori O. Ishitsuka; Takahiro Tsuchiya; Yutaka Maeda; Michael T. H. Liu; Kenji Yoza; Tatsuhisa Kato; Kazunori Yamamoto; Naomi Mizorogi; Zdenek Slanina; Shigeru Nagase","Does Gd@C82 Have an Anomalous Endohedral Structure? Synthesis and Single Crystal X-ray Structure of the Carbene Adduct","Journal of the American Chemical Society","2008","130","","12840","12841","10.1021/ja802156n","","x-ray","0.71073","MoKα","","0.0979","0.0805","","","0.2124","0.2273","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108388","25.1848","0.0007","15.116","0.0005","19.7406","0.0007","90","","95.063","0.001","90","","7485.8","0.4","90","2","90","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Tb2@C79N.NiOEP.2benzene","","","- C128 H56 N4 Ni Tb2 -","- C129.5 H56 N4 Ni Tb2.0004 -","- C518 H224 N16 Ni4 Tb8.0016 -","4","0.5","","Tianming Zuo; Liaosa Xu; Christine M. Beavers; Marilyn M. Olmstead; Wujun Fu; T. Daniel Crawford; Alan L. Balch; Harry C. Dorn","M2@C79N (M = Y, Tb): Isolation and Characterization of Stable Endohedral Metallofullerenes Exhibiting M-M Bonding Interactions inside Aza[80]fullerene Cages","Journal of the American Chemical Society","2008","130","","12992","12997","10.1021/ja802417d","","","0.7749","synchrotron","","0.0909","0.0844","","","0.2357","0.2435","","","","","","1.033","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108389","23.422","0.003","12.7232","0.0014","33.774","0.004","90","","108.588","0.002","90","","9540","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C39 H90 Mo O3 P Si3 -","- C39 H90 Mo O3 P Si3 -","- C312 H720 Mo8 O24 P8 Si24 -","8","1","","David S. Kuiper; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Low Coordinate, Monomeric Molybdenum and Tungsten(III) Complexes: Structure, Reactivity and Calculational Studies of (silox)3Mo and (silox)3ML (M = Mo, W; L = PMe3, CO; silox =tBu3SiO)","Journal of the American Chemical Society","2008","130","","12931","12943","10.1021/ja802706u","","","0.71073","MoKα","","0.0609","0.0381","","","0.0901","0.0971","","","","","","1.034","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108390","12.9564","0.0011","20.469","0.0017","21.6634","0.0017","63.76","0.004","80.022","0.004","76.894","0.004","5001.4","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H180 O6 P2 Si6 W2 -","- C78 H180 O6 P2 Si6 W2 -","- C156 H360 O12 P4 Si12 W4 -","2","1","","David S. Kuiper; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Low Coordinate, Monomeric Molybdenum and Tungsten(III) Complexes: Structure, Reactivity and Calculational Studies of (silox)3Mo and (silox)3ML (M = Mo, W; L = PMe3, CO; silox =tBu3SiO)","Journal of the American Chemical Society","2008","130","","12931","12943","10.1021/ja802706u","","","0.71073","MoKα","","0.0528","0.0322","","","0.0725","0.0764","","","","","","0.967","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108391","8.684","0.002","21.091","0.004","24.354","0.005","90","","94.12","0.03","90","","4449","1.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H81 O4 Si3 W -","- C37 H81 O4 Si3 W -","- C148 H324 O16 Si12 W4 -","4","1","","David S. Kuiper; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Low Coordinate, Monomeric Molybdenum and Tungsten(III) Complexes: Structure, Reactivity and Calculational Studies of (silox)3Mo and (silox)3ML (M = Mo, W; L = PMe3, CO; silox =tBu3SiO)","Journal of the American Chemical Society","2008","130","","12931","12943","10.1021/ja802706u","","","0.71073","MoKα","","0.0477","0.0368","","0.0912","0.0865","","","","1.107","1.143","1.143","","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108392","11.4799","0.0013","17.225","0.002","17.214","0.002","90","","103.884","0.002","90","","3304.5","0.7","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 O2 -","- C20 H24 O2 -","- C160 H192 O16 -","8","2","","Song Lin; Chun-Xiao Song; Gui-Xin Cai; Wen-Hua Wang; Zhang-Jie Shi","Intra/Intermolecular Direct Allylic Alkylation via Pd(II)-Catalyzed Allylic C-H Activation","Journal of the American Chemical Society","2008","130","","12901","12903","10.1021/ja803452p","","","0.71073","MoKα","","0.1663","0.0544","","","0.1158","0.176","","","","","","1.037","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108393","8.3412","0.0017","8.8546","0.0018","12.46","0.003","69.39","0.03","75.89","0.03","80.67","0.03","832.4","0.4","211","2","211","2","","","","","","","","3","P -1","-P 1","2","PIIV09","dimethyl 6-acetyl-7-methyl-4-methylideneoctahydroazulene-2,2(1H)- dicarboxylate","","- C18 H24 O5 -","- C18 H24 O5 -","- C36 H48 O10 -","2","1","","P. Andrew Evans; Phillip A. Inglesby","Intermolecular Rhodium-Catalyzed [3+2+2] Carbocyclization of Alkenylidenecyclopropanes with Activated Alkynes: Regio- and Diastereoselective Construction of cis-Fused Bicycloheptadienes","Journal of the American Chemical Society","2008","130","","12838","12839","10.1021/ja803691p","","","0.71073","MoKα","","0.0479","0.0398","","","0.1016","0.1054","","","","","","1.032","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108394","13.651","0.003","11.617","0.002","11.148","0.002","90","","103.73","0.03","90","","1717.4","0.6","211","2","211","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","PIIV15","dimethyl 6-acetyl-3a-methyl-8-methylideneoctahydroazulene- 2,2(1H)-dicarboxylate","","- C18 H24 O5 -","- C18 H24 O5 -","- C72 H96 O20 -","4","1","","P. Andrew Evans; Phillip A. Inglesby","Intermolecular Rhodium-Catalyzed [3+2+2] Carbocyclization of Alkenylidenecyclopropanes with Activated Alkynes: Regio- and Diastereoselective Construction of cis-Fused Bicycloheptadienes","Journal of the American Chemical Society","2008","130","","12838","12839","10.1021/ja803691p","","","0.71073","MoKα","","0.0819","0.0435","","","0.0805","0.0891","","","","","","0.832","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108395","19.797","0.005","10.686","0.003","17.708","0.005","90","","95.527","0.005","90","","3728.7","1.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","PI-111-74","","","- C20 H25 N O4 S -","- C20 H25 N O4 S -","- C160 H200 N8 O32 S8 -","8","1","","P. Andrew Evans; Phillip A. Inglesby","Intermolecular Rhodium-Catalyzed [3+2+2] Carbocyclization of Alkenylidenecyclopropanes with Activated Alkynes: Regio- and Diastereoselective Construction of cis-Fused Bicycloheptadienes","Journal of the American Chemical Society","2008","130","","12838","12839","10.1021/ja803691p","","","0.71073","MoKα","","0.0514","0.0383","","","0.095","0.1","","","","","","1.038","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108396","28.827","0.002","28.827","0.002","7.7483","0.0013","90","","90","","120","","5576.2","1.1","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C11 H14 N6 O -","- C11.1443 H14.336 N6.048 O1.048 -","- C200.598 H258.048 N108.864 O18.864 -","18","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","G^C Quartet - A DNA-Inspired Janus-GC Heterocycle: Synthesis, Structural Analysis, and Self-Organization","Journal of the American Chemical Society","2008","130","","12860","12861","10.1021/ja8047128","","","0.71073","MoKα","","0.0517","0.0422","","","0.1088","0.1152","","","","","","1.05","","","","has coordinates,has disorder","178829","2020-10-21","18:00:00",""
"4108397","28.263","0.005","8.5974","0.0011","19.975","0.003","90","","93.396","0.005","90","","4845.2","1.3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 N7 O2 -","- C12.6667 H19.3333 N4.66667 O6.67667 -","- C152 H232 N56 O80.12 -","12","1.5","","Ali Asadi; Brian O. Patrick; David M. Perrin","G^C Quartet - A DNA-Inspired Janus-GC Heterocycle: Synthesis, Structural Analysis, and Self-Organization","Journal of the American Chemical Society","2008","130","","12860","12861","10.1021/ja8047128","","","0.71073","MoKα","","0.0608","0.0395","","","0.1028","0.124","","","","","","1.003","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108398","20.67","0.0005","27.198","0.0007","28.726","0.0009","90","","90","","90","","16149.3","0.8","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C96 H82 Cl Cs F N5 O14 -","- C84 Cl3 Cs F N4 O11 -","- C672 Cl24 Cs8 F8 N32 O88 -","8","1","","Jonathan L. Sessler; Sung Kuk Kim; Dustin E. Gross; Chang-Hee Lee; Jong Seung Kim; Vincent M. Lynch","Crown-6-calix[4]arene-Capped Calix[4]pyrrole: An Ion-Pair Receptor for Solvent-Separated CsF Ions","Journal of the American Chemical Society","2008","130","","13162","13166","10.1021/ja804976f","","","0.7107","MoKα","","0.2815","0.1683","","","0.3399","0.4349","","","","","","1.047","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108399","13.4993","0.0002","26.0185","0.0007","19.6409","0.0005","90","0.005","100.663","0.002","90","0.005","6779.4","0.3","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C77 H86 Cs F N4 O8 -","- C77 H86 Cs F N4 O8 -","- C308 H344 Cs4 F4 N16 O32 -","4","1","","Jonathan L. Sessler; Sung Kuk Kim; Dustin E. Gross; Chang-Hee Lee; Jong Seung Kim; Vincent M. Lynch","Crown-6-calix[4]arene-Capped Calix[4]pyrrole: An Ion-Pair Receptor for Solvent-Separated CsF Ions","Journal of the American Chemical Society","2008","130","","13162","13166","10.1021/ja804976f","","","0.71073","MoKα","","0.0803","0.0418","","","0.0839","0.0973","","","","","","1.019","","","","has coordinates","178829","2020-10-21","18:00:00",""
"4108400","9.872","0.002","9.8736","0.0019","12.086","0.002","70.579","0.003","69.775","0.003","60.317","0.003","941.4","0.3","300","2","300","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H22 N2 -","- C24 H22 N2 -","- C48 H44 N4 -","2","1","","Yoshiaki Nakao; Shiro Ebata; Akira Yada; Tamejiro Hiyama; Masashi Ikawa; Sensuke Ogoshi","Intramolecular Arylcyanation of Alkenes Catalyzed by Nickel/AlMe2Cl","Journal of the American Chemical Society","2008","130","","12874","12875","10.1021/ja805088r","","","0.71073","MoKα","","0.0521","0.0463","","","0.1314","0.1366","","","","","","1.075","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108401","10.7665","0.0009","20.8961","0.0016","20.9391","0.0016","81.9439","0.0018","79.336","0.002","81.22","0.002","4544.8","0.6","273.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C38 H73 Al Cl N Ni P2 -","- C38 H73 Al Cl N Ni P2 -","- C152 H292 Al4 Cl4 N4 Ni4 P8 -","4","2","","Yoshiaki Nakao; Shiro Ebata; Akira Yada; Tamejiro Hiyama; Masashi Ikawa; Sensuke Ogoshi","Intramolecular Arylcyanation of Alkenes Catalyzed by Nickel/AlMe2Cl","Journal of the American Chemical Society","2008","130","","12874","12875","10.1021/ja805088r","","","0.71075","MoKα","","","0.1113","","","","0.1163","","","","","","4.226","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108402","9.6659","0.0011","14.4842","0.0015","15.7784","0.0018","81.377","0.003","81.904","0.003","86.67","0.003","2160.7","0.4","123.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C38 H73 Al Cl N Ni P2 -","- C38 H73 Al Cl N Ni P2 -","- C76 H146 Al2 Cl2 N2 Ni2 P4 -","2","1","","Yoshiaki Nakao; Shiro Ebata; Akira Yada; Tamejiro Hiyama; Masashi Ikawa; Sensuke Ogoshi","Intramolecular Arylcyanation of Alkenes Catalyzed by Nickel/AlMe2Cl","Journal of the American Chemical Society","2008","130","","12874","12875","10.1021/ja805088r","","","0.71075","MoKα","","","0.0866","","","","0.3001","","","","","","1.183","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108403","27.2736","0.001","6.5729","0.0002","11.141","0.0005","90","","94.704","0.002","90","","1990.48","0.13","200","2","200","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C15 H20 Cl2 N O6 V -","- C15 H20 Cl2 N O6 V -","- C60 H80 Cl8 N4 O24 V4 -","4","1","","Chien-Tien Chen; Ya-Hui Lin; Ting-Shen Kuo","Directed Assembly of Chiral Oxidovanadium(V) Methoxides into C4-Symmetric Metal(I) Vanadate-Centered Quadruplexes: Synergistic K± and Ag±specific Transport","Journal of the American Chemical Society","2008","130","","12842","12843","10.1021/ja8051552","","","0.71073","MoKα","","0.061","0.0435","","","0.0942","0.1061","","","","","","1.061","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108404","15.2879","0.0004","12.7171","0.0004","20.9195","0.0007","90","","103.167","0.001","90","","3960.2","0.2","200","2","200","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C56 H70 Cl8 K N4 O26 V5 -","- C56 H52 Cl8 K N4 O26 V5 -","- C112 H104 Cl16 K2 N8 O52 V10 -","2","1","","Chien-Tien Chen; Ya-Hui Lin; Ting-Shen Kuo","Directed Assembly of Chiral Oxidovanadium(V) Methoxides into C4-Symmetric Metal(I) Vanadate-Centered Quadruplexes: Synergistic K± and Ag±specific Transport","Journal of the American Chemical Society","2008","130","","12842","12843","10.1021/ja8051552","","","0.71073","MoKα","","0.1114","0.0768","","","0.1905","0.2152","","","","","","1.071","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108405","15.2137","0.0004","12.7086","0.0003","21.7372","0.0006","90","","107.063","0.001","90","","4017.78","0.18","296","2","296","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C52 H52 Cl8 Cs N4 O21 V5 -","- C52 H52 Cl8 Cs N4 O21 V5 -","- C104 H104 Cl16 Cs2 N8 O42 V10 -","2","1","","Chien-Tien Chen; Ya-Hui Lin; Ting-Shen Kuo","Directed Assembly of Chiral Oxidovanadium(V) Methoxides into C4-Symmetric Metal(I) Vanadate-Centered Quadruplexes: Synergistic K± and Ag±specific Transport","Journal of the American Chemical Society","2008","130","","12842","12843","10.1021/ja8051552","","","0.71073","MoKα","","0.057","0.0419","","","0.1009","0.1066","","","","","","0.973","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108406","25.21","0.0002","15.502","0.0002","38.329","0.0004","90","","103.58","","90","","14560.4","0.3","200","2","200","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C214 H243 Ag3 B0 Cl24 N41 O63 V15 -","- C214 H243 Ag3 Cl24 N41 O63 V15 -","- C428 H486 Ag6 Cl48 N82 O126 V30 -","2","0.5","","Chien-Tien Chen; Ya-Hui Lin; Ting-Shen Kuo","Directed Assembly of Chiral Oxidovanadium(V) Methoxides into C4-Symmetric Metal(I) Vanadate-Centered Quadruplexes: Synergistic K± and Ag±specific Transport","Journal of the American Chemical Society","2008","130","","12842","12843","10.1021/ja8051552","","","0.71073","MoKα","","0.0518","0.0439","","","0.1296","0.1394","","","","","","1.01","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108407","10.4406","0.0011","12.2497","0.0013","18.53","0.002","83.963","0.003","86.405","0.002","65.306","0.002","2140.8","0.4","110","","110","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C45 H77 B Cl P2 Ru -","- C45 H77 B Cl P2 Ru -","- C90 H154 B2 Cl2 P4 Ru2 -","2","1","","Gilles Alcaraz; Ulrike Helmstedt; Eric Clot; Laure Vendier; Sylviane Sabo-Etienne","A Terminal Borylene Ruthenium Complex: From B-H Activation to Reversible Hydrogen Release","Journal of the American Chemical Society","2008","130","","12878","12879","10.1021/ja805164n","","","","MoKα","","0.0643","0.05","","","0.1056","0.1129","","","","","","1.062","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108408","11.3972","0.0007","12.7454","0.0008","15.7096","0.001","90","","92.677","0.001","90","","2279.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H30 B N -","- C29 H30 B N -","- C116 H120 B4 N4 -","4","1","","Ying-Li Rao; Hazem Amarne; Shu-Bin Zhao; Theresa M. McCormick; Sanela Martić; Yi Sun; Rui-Yao Wang; Suning Wang","Reversible Intramolecular C-C Bond Formation/Breaking and Color Switching Mediated by a N,C-Chelate in (2-ph-py)BMes2 and (5-BMes2-2-ph-py)BMes2","Journal of the American Chemical Society","2008","130","","12898","12900","10.1021/ja8052046","","","0.71073","MoKα","","0.0669","0.0475","","","0.1303","0.1437","","","","","","1.074","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4108409","12.021","0.008","12.104","0.008","13.193","0.009","107.38","0.008","101.907","0.008","102.516","0.008","1711","2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H42 B Cl2 N -","- C39 H42 B Cl2 N -","- C78 H84 B2 Cl4 N2 -","2","1","","Ying-Li Rao; Hazem Amarne; Shu-Bin Zhao; Theresa M. McCormick; Sanela Martić; Yi Sun; Rui-Yao Wang; Suning Wang","Reversible Intramolecular C-C Bond Formation/Breaking and Color Switching Mediated by a N,C-Chelate in (2-ph-py)BMes2 and (5-BMes2-2-ph-py)BMes2","Journal of the American Chemical Society","2008","130","","12898","12900","10.1021/ja8052046","","","0.71073","MoKα","","0.2642","0.0878","","","0.2033","0.2942","","","","","","0.911","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108410","15.292","0.004","24.012","0.006","21.457","0.005","90","","90","","90","","7879","3","180","2","180","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C47 H51 B2 N -","- C47 H51 B2 N -","- C376 H408 B16 N8 -","8","2","","Ying-Li Rao; Hazem Amarne; Shu-Bin Zhao; Theresa M. McCormick; Sanela Martić; Yi Sun; Rui-Yao Wang; Suning Wang","Reversible Intramolecular C-C Bond Formation/Breaking and Color Switching Mediated by a N,C-Chelate in (2-ph-py)BMes2 and (5-BMes2-2-ph-py)BMes2","Journal of the American Chemical Society","2008","130","","12898","12900","10.1021/ja8052046","","","0.71073","MoKα","","0.1178","0.0541","","","0.1089","0.1397","","","","","","1.053","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4108411","13.565","0.005","13.565","0.005","15.503","0.013","90","","90","","90","","2853","3","293","2","293","2","","","","","","","","6","P 41 2 2","P 4w 2c","91","","","","- C14 H6 In N O8 S2 -","- C14 H4 In N O8 S2 -","- C56 H16 In4 N4 O32 S8 -","4","0.5","","Jian Zhang; Shumei Chen; Tao Wu; Pingyun Feng; Xianhui Bu","Homochiral Crystallization of Microporous Framework Materials from Achiral Precursors by Chiral Catalysis","Journal of the American Chemical Society","2008","130","","12882","12883","10.1021/ja805272j","","","0.71073","MoKα","","0.0767","0.0488","","","0.1145","0.1259","","","","","","1.024","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108412","13.559","","13.559","","15.6782","0.0002","90","","90","","90","","2882.38","0.04","293","2","293","2","","","","","","","","6","P 43 2 2","P 4cw 2c","95","","","","- C14 H4 In N O8 S2 -","- C14 H4 In N O8 S2 -","- C56 H16 In4 N4 O32 S8 -","4","0.5","","Jian Zhang; Shumei Chen; Tao Wu; Pingyun Feng; Xianhui Bu","Homochiral Crystallization of Microporous Framework Materials from Achiral Precursors by Chiral Catalysis","Journal of the American Chemical Society","2008","130","","12882","12883","10.1021/ja805272j","","","0.71073","MoKα","","0.0452","0.0392","","","0.1457","0.1543","","","","","","1.179","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108413","13.577","0.0004","13.577","0.0004","15.5394","0.0009","90","","90","","90","","2864.5","0.2","293","2","293","2","","","","","","","","6","P 41 2 2","P 4w 2c","91","","","","- C14 H6 In N O8 S2 -","- C14 H4 In N O8 S2 -","- C56 H16 In4 N4 O32 S8 -","4","0.5","","Jian Zhang; Shumei Chen; Tao Wu; Pingyun Feng; Xianhui Bu","Homochiral Crystallization of Microporous Framework Materials from Achiral Precursors by Chiral Catalysis","Journal of the American Chemical Society","2008","130","","12882","12883","10.1021/ja805272j","","","0.71073","MoKα","","0.0507","0.0378","","","0.0992","0.106","","","","","","1.117","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108414","13.51","0.0001","13.51","0.0001","16.0684","0.0003","90","","90","","90","","2932.81","0.06","293","2","293","2","","","","","","","","6","P 41 2 2","P 4w 2c","91","","","","- C16 H16 In N O8 S2 -","- C16 H8 In N O8 S2 -","- C64 H32 In4 N4 O32 S8 -","4","0.5","","Jian Zhang; Shumei Chen; Tao Wu; Pingyun Feng; Xianhui Bu","Homochiral Crystallization of Microporous Framework Materials from Achiral Precursors by Chiral Catalysis","Journal of the American Chemical Society","2008","130","","12882","12883","10.1021/ja805272j","","","0.71073","MoKα","","0.062","0.0526","","","0.1788","0.1842","","","","","","1.234","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108415","13.5065","0.0002","13.5065","0.0002","15.9076","0.0004","90","","90","","90","","2901.95","0.09","293","2","293","2","","","","","","","","6","P 43 2 2","P 4cw 2c","95","","","","- C16 H16 In N O8 S2 -","- C16 H4 In N O8 S2 -","- C64 H16 In4 N4 O32 S8 -","4","0.5","","Jian Zhang; Shumei Chen; Tao Wu; Pingyun Feng; Xianhui Bu","Homochiral Crystallization of Microporous Framework Materials from Achiral Precursors by Chiral Catalysis","Journal of the American Chemical Society","2008","130","","12882","12883","10.1021/ja805272j","","","0.71073","MoKα","","0.0824","0.0602","","","0.1916","0.2001","","","","","","1.099","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108416","8.4","0.004","9.951","0.005","11.472","0.007","84.65","0.03","71.48","0.03","70.1","0.03","854.9","0.8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H18 Cl2 O2 -","- C20 H18 Cl2 O2 -","- C40 H36 Cl4 O4 -","2","1","","Michael A. Ischay; Mary E. Anzovino; Juana Du; Tehshik P. Yoon","Efficient Visible Light Photocatalysis of [2+2] Enone Cycloadditions","Journal of the American Chemical Society","2008","130","","12886","12887","10.1021/ja805387f","","","1.54178","Cu-Kα","","0.0297","0.029","","","0.0775","0.0782","","","","","","0.998","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108417","12.634","0.003","13.905","0.003","14.845","0.004","90.303","0.005","112.075","0.004","95.868","0.004","2401.4","1","100","2","100","2","","","","","","","","8","P 1","P 1","1","","","","- C107 H93 B F20 N2 O2 Pd Si2 -","- C107 H93 B F20 N2 O2 Pd Si2 -","- C107 H93 B F20 N2 O2 Pd Si2 -","1","1","","Changle Chen; Shuji Luo; Richard F. Jordan","Multiple Insertion of a Silyl Vinyl Ether by (α-Diimine)PdMe+ Species","Journal of the American Chemical Society","2008","130","","12892","12893","10.1021/ja8056858","","","0.71073","MoKα","","0.0506","0.0457","","","0.0847","0.0869","","","","","","0.894","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108418","12.68","0.008","13.926","0.009","14.868","0.009","90.3","0.011","111.83","0.01","95.895","0.011","2422","3","100","2","100","2","","","","","","","","8","P 1","P 1","1","","","","- C107 H93 B F20 N2 O2 Pd Si2 -","- C107 H93 B F20 N2 O2 Pd Si2 -","- C107 H93 B F20 N2 O2 Pd Si2 -","1","1","","Changle Chen; Shuji Luo; Richard F. Jordan","Multiple Insertion of a Silyl Vinyl Ether by (α-Diimine)PdMe+ Species","Journal of the American Chemical Society","2008","130","","12892","12893","10.1021/ja8056858","","","0.71073","MoKα","","0.0562","0.0525","","","0.1179","0.1226","","","","","","1.049","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108419","8.5863","0.0013","10.8754","0.0017","9.9485","0.0016","90","","111.535","0.002","90","","864.1","0.2","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H28 O4 -","- C19 H28 O4 -","- C38 H56 O8 -","2","1","","M. Kevin Brown; Amir H. Hoveyda","Enantioselective Total Synthesis of Clavirolide C. Applications of Cu-Catalyzed Asymmetric Conjugate Additions and Ru-Catalyzed Ring-Closing Metathesis","Journal of the American Chemical Society","2008","130","","12904","12906","10.1021/ja8058414","","","0.71073","MoKα","","0.1046","0.0593","","","0.0896","0.1029","","","","","","1.014","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108420","9.328","0.002","10.513","0.003","9.388","0.002","90","","98.241","0.004","90","","911.1","0.4","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H32 O4 -","- C20 H32 O4 -","- C40 H64 O8 -","2","1","","M. Kevin Brown; Amir H. Hoveyda","Enantioselective Total Synthesis of Clavirolide C. Applications of Cu-Catalyzed Asymmetric Conjugate Additions and Ru-Catalyzed Ring-Closing Metathesis","Journal of the American Chemical Society","2008","130","","12904","12906","10.1021/ja8058414","","","0.71073","MoKα","","0.0998","0.0581","","","0.0846","0.0967","","","","","","1.013","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108421","22.3407","0.0007","10.1916","0.0003","14.7991","0.0009","90","","100.743","0.003","90","","3310.5","0.2","200","1","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C36 H20 Br4 N6 O8 -","- C36 H20 Br4 N6 O8 -","- C144 H80 Br16 N24 O32 -","4","1","","Sachio Horiuchi; Reiji Kumai; Yusuke Tokunaga; Yoshinori Tokura","Proton Dynamics and Room-Temperature Ferroelectricity in Anilate Salts with a Proton Sponge","Journal of the American Chemical Society","2008","130","","13382","13391","10.1021/ja8032235","","","0.9979","synchrotron","","","0.024","","","","0.0305","","","","","","1.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108422","22.309","0.004","10.188","0.002","14.696","0.003","90","","100.228","0.006","90","","3287.1","1.1","297","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H20 Cl4 N6 O8 -","- C36 H20 Cl4 N6 O8 -","- C144 H80 Cl16 N24 O32 -","4","0.5","","Sachio Horiuchi; Reiji Kumai; Yusuke Tokunaga; Yoshinori Tokura","Proton Dynamics and Room-Temperature Ferroelectricity in Anilate Salts with a Proton Sponge","Journal of the American Chemical Society","2008","130","","13382","13391","10.1021/ja8032235","","","0.6877","synchrotron","","","0.0316","","","","0.0395","","","","","","1.004","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108423","22.198","0.0011","10.1502","0.0004","14.5046","0.0008","90","","101.341","0.003","90","","3204.3","0.3","100","1","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C36 H20 Cl4 N6 O8 -","- C36 H20 Cl4 N6 O8 -","- C144 H80 Cl16 N24 O32 -","4","1","","Sachio Horiuchi; Reiji Kumai; Yusuke Tokunaga; Yoshinori Tokura","Proton Dynamics and Room-Temperature Ferroelectricity in Anilate Salts with a Proton Sponge","Journal of the American Chemical Society","2008","130","","13382","13391","10.1021/ja8032235","","","0.6877","synchrotron","","","0.0215","","","","0.0243","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108424","22.4282","0.0013","10.2454","0.0006","14.9797","0.0015","90","","99.797","0.007","90","","3391.9","0.4","370","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H20 Br4 N6 O8 -","- C36 H20 Br4 N6 O8 -","- C144 H80 Br16 N24 O32 -","4","0.5","","Sachio Horiuchi; Reiji Kumai; Yusuke Tokunaga; Yoshinori Tokura","Proton Dynamics and Room-Temperature Ferroelectricity in Anilate Salts with a Proton Sponge","Journal of the American Chemical Society","2008","130","","13382","13391","10.1021/ja8032235","","","0.9979","synchrotron","","","0.0272","","","","0.0402","","","","","","0.993","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108425","13.3087","0.0004","17.4037","0.0005","24.3214","0.0007","90","","90","","90","","5633.3","0.3","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,3,5,6,2',3',5'6'-ocatabromo-4,4'-dihexylbiphenyl","","- C24 H26 Br8 -","- C24 H26 Br8 -","- C192 H208 Br64 -","8","1","","Cameron L. Hilton; Jeremy M. Crowfoot; Pawel Rempala; Benjamin T. King","18,18'-Dihexyl[9,9']biphenanthro[9,10-b]triphenylene: Construction and Consequences of a Profoundly Hindered Aryl-Aryl Single Bond","Journal of the American Chemical Society","2008","130","","13392","13399","10.1021/ja803396n","","","0.71073","MoKα","","0.0666","0.0362","","","0.0677","0.0727","","","","","","1","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108426","8.9878","0.0001","15.3483","0.0002","21.4148","0.0003","86.272","0.001","89.261","0.001","78.793","0.001","2891.65","0.06","99","2","99","2","","","","","","","","2","P -1","-P 1","2","","18,18'-Di-n-hexyl[9,9']Bi[phenanthro[9,10-b]triphenylenyl]","","- C84 H70 -","- C84 H70 -","- C168 H140 -","2","1","","Cameron L. Hilton; Jeremy M. Crowfoot; Pawel Rempala; Benjamin T. King","18,18'-Dihexyl[9,9']biphenanthro[9,10-b]triphenylene: Construction and Consequences of a Profoundly Hindered Aryl-Aryl Single Bond","Journal of the American Chemical Society","2008","130","","13392","13399","10.1021/ja803396n","","","0.71073","MoKα","","0.0657","0.0417","","","0.0969","0.1071","","","","","","1.092","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108427","8.9148","0.0015","13.982","0.002","21.42","0.004","104.888","0.003","96.43","0.003","94.489","0.003","2548.1","0.7","100","2","100","2","","","","","","","","2","P -1","-P 1","2","","18,18'-Di-n-hexyl[9,9']Bi[phenanthro[9,10-b]triphenylenyl]","","- C75 H61 -","- C75 H61 -","- C150 H122 -","2","1","","Cameron L. Hilton; Jeremy M. Crowfoot; Pawel Rempala; Benjamin T. King","18,18'-Dihexyl[9,9']biphenanthro[9,10-b]triphenylene: Construction and Consequences of a Profoundly Hindered Aryl-Aryl Single Bond","Journal of the American Chemical Society","2008","130","","13392","13399","10.1021/ja803396n","","","0.71073","MoKα","","0.1135","0.0545","","","0.1176","0.1384","","","","","","0.916","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108428","14.1687","0.0016","6.9866","0.0009","31.257","0.003","90","","96.257","0.006","90","","3075.7","0.6","173","1","173","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 F3 N2 O3 -","- C16 H11 F3 N2 O3 -","- C128 H88 F24 N16 O24 -","8","2","","Jin-Yong Lu; John A. Keith; Wei-Zheng Shen; Markus Schürmann; Hans Preut; Timo Jacob; Hans-Dieter Arndt","Regioselective De Novo Synthesis of Cyanohydroxypyridines with a Concerted Cycloaddition Mechanism","Journal of the American Chemical Society","2008","130","","13219","13221","10.1021/ja804078v","","","0.71073","MoKα","","0.1941","0.0406","","","0.0658","0.0831","","","","","","0.915","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108429","23.8603","0.0007","11.1601","0.0004","22.9338","0.0007","90","","105.447","0.002","90","","5886.3","0.3","100","1","100","1","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C88 F30 -","- C88 F30 -","- C352 F120 -","4","0.5","","Ivan E. Kareev; Alexey A. Popov; Igor V. Kuvychko; Natalia B. Shustova; Sergey F. Lebedkin; Vyachevslav P. Bubnov; Oren P. Anderson; Konrad Seppelt; Steven H. Strauss; Olga V. Boltalina","Synthesis and X-ray or NMR/DFT Structure Elucidation of Twenty-One New Trifluoromethyl Derivatives of Soluble Cage Isomers of C76, C78, C84, and C90","Journal of the American Chemical Society","2008","130","","13471","13489","10.1021/ja8041614","","","0.71073","MoKα","","0.0491","0.0441","","","0.1195","0.123","","","","","","1.051","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108430","11.444","0.002","18.791","0.004","14.883","0.003","90","","110.048","0.01","90","","3006.6","1","100","1","100","1","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C95 H8 F30 -","- C95 H8 F30 -","- C190 H16 F60 -","2","0.5","","Ivan E. Kareev; Alexey A. Popov; Igor V. Kuvychko; Natalia B. Shustova; Sergey F. Lebedkin; Vyachevslav P. Bubnov; Oren P. Anderson; Konrad Seppelt; Steven H. Strauss; Olga V. Boltalina","Synthesis and X-ray or NMR/DFT Structure Elucidation of Twenty-One New Trifluoromethyl Derivatives of Soluble Cage Isomers of C76, C78, C84, and C90","Journal of the American Chemical Society","2008","130","","13471","13489","10.1021/ja8041614","","","0.71073","MoKα","","0.0752","0.0557","","","0.155","0.1695","","","","","","1.071","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108431","18.526","0.005","14.922","0.005","26.019","0.008","90","","96.03","0.008","90","","7153","4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C96 H5 Br F36 -","- C96 H5 Br F36 -","- C384 H20 Br4 F144 -","4","1","","Ivan E. Kareev; Alexey A. Popov; Igor V. Kuvychko; Natalia B. Shustova; Sergey F. Lebedkin; Vyachevslav P. Bubnov; Oren P. Anderson; Konrad Seppelt; Steven H. Strauss; Olga V. Boltalina","Synthesis and X-ray or NMR/DFT Structure Elucidation of Twenty-One New Trifluoromethyl Derivatives of Soluble Cage Isomers of C76, C78, C84, and C90","Journal of the American Chemical Society","2008","130","","13471","13489","10.1021/ja8041614","","","0.71073","MoKα","","0.1012","0.0673","","","0.1663","0.1819","","","","","","1.072","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108432","11.439","0.002","11.76","0.002","10.777","0.002","90","","97.55","0.03","90","","1437.2","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 N2 O5 -","- C14 H18 N2 O5 -","- C56 H72 N8 O20 -","4","1","","Xuechen Li; Yu Yuan; William F. Berkowitz; Louis J. Todaro; Samuel J. Danishefsky","On the Two-Component Microwave-Mediated Reaction of Isonitriles with Carboxylic Acids: Regarding Alleged Formimidate Carboxylate Mixed Anhydrides","Journal of the American Chemical Society","2008","130","","13222","13224","10.1021/ja8047078","","","0.71073","MoKα","","0.0743","0.0487","","","0.1048","0.1171","","","","","","1.039","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108433","13.0871","0.001","15.2737","0.0011","17.7536","0.0013","90","","104.463","0.001","90","","3436.3","0.4","208","2","208","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","VM-565-90-1","","","- C34 H50 Cl2 Ir N2 O2 P -","- C34 H50 Cl2 Ir N2 O2 P -","- C136 H200 Cl8 Ir4 N8 O8 P4 -","4","1","","Valentín Miranda-Soto; Douglas B. Grotjahn; Antonio G. DiPasquale; Arnold L. Rheingold","Imidazol-2-yl Complexes of Cp*Ir as Bifunctional Ambident Reactants","Journal of the American Chemical Society","2008","130","","13200","13201","10.1021/ja804713u","","","0.71073","MoKα","","0.0245","0.021","","","0.0498","0.0516","","","","","","1.047","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4108434","18.4917","0.0011","8.3646","0.0005","18.3085","0.0011","90","","95.023","0.001","90","","2821","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H39 Cl Ir N2 P -","- C31 H39 Cl Ir N2 P -","- C124 H156 Cl4 Ir4 N8 P4 -","4","1","","Valentín Miranda-Soto; Douglas B. Grotjahn; Antonio G. DiPasquale; Arnold L. Rheingold","Imidazol-2-yl Complexes of Cp*Ir as Bifunctional Ambident Reactants","Journal of the American Chemical Society","2008","130","","13200","13201","10.1021/ja804713u","","","0.71073","MoKα","","0.0243","0.021","","","0.0477","0.0492","","","","","","1.048","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108435","10.529","0.001","22.192","0.002","12.113","0.002","90","","92.739","0.01","90","","2827.1","0.6","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H29 Br N4 O7 -","- C29 H29 Br N4 O7 -","- C116 H116 Br4 N16 O28 -","4","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.54178","CuKα","","0.0645","0.0467","","","0.1067","0.1134","","","","","","0.899","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108436","13.226","0.004","15.25","0.004","21.736","0.007","89.91","0.02","80.84","0.02","78.995","0.016","4247","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C85 H89 Br2 N12 O18 -","- C85.944 H87.71 Br2 N12 O18 -","- C171.888 H175.42 Br4 N24 O36 -","2","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.54178","CuKα","","0.1507","0.0801","","","0.2412","0.2773","","","","","","1.075","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108437","37.784","0.002","15.211","0.001","19.567","0.001","90","","90.719","0.003","90","","11244.9","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C63 H56 Br1.13 N8 O11.13 -","- C63 H56 Br1.073 N8 O11.063 -","- C504 H448 Br8.584 N64 O88.504 -","8","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.54178","CuKα","","0.1127","0.0835","","","0.3091","0.3166","","","","","","1.13","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108438","10.418","0.003","16.302","0.004","18.637","0.005","90.438","0.017","99.948","0.018","102.15","0.018","3044.6","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H60 Br2 Cl2 N8 O12 -","- C58 H60 Br2 Cl2 N8 O12 -","- C116 H120 Br4 Cl4 N16 O24 -","2","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.5418","CuKα","","0.1999","0.1238","","","0.3237","0.3626","","","","","","1.084","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108439","15.592","0.003","29.122","0.006","26.198","0.005","90","","102.87","0.03","90","","11597","4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C118 H114.5 Br1.25 Cl7 N16 O19 -","- C118 H121 Br1.199 Cl6.977 N16 O19 -","- C472 H484 Br4.796 Cl27.908 N64 O76 -","4","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.54178","CuKα","","0.1231","0.1024","","","0.2731","0.2948","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108440","18.488","0.002","15.1736","0.0018","43.257","0.006","90","","92.765","0.006","90","","12121","3","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C119.25 H113 Br2 Cl6 N16 O20.5 -","- C117.89 H113 Br1.9 Cl6 N16 O20.83 -","- C471.56 H452 Br7.6 Cl24 N64 O83.32 -","4","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.5418","CuKα","","0.1941","0.1612","","","0.4149","0.441","","","","","","1.641","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108441","8.498","","11.409","","17.093","","89.37","","78.23","","78.19","","1587.22","","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H31 Br Cl2 N4 O5 -","- C31 H31 Br Cl2 N4 O5 -","- C62 H62 Br2 Cl4 N8 O10 -","2","1","","Kolupula Srinivas; Brice Kauffmann; Christel Dolain; Jean-Michel Léger; Léon Ghosez; Ivan Huc","Remote Substituent Effects and Regioselective Enhancement of Electrophilic Substitutions in Helical Aromatic Oligoamides","Journal of the American Chemical Society","2008","130","","13210","13211","10.1021/ja805178j","","","1.54178","CuKα","","0.0641","0.0575","","","0.1952","0.2139","","","","","","1.011","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108442","10.626","","15.631","","15.214","","90","","98.05","","90","","2502.07","","100","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H14 Cl2 F10 N2 O2 Ti -","- C22 H14 Cl2 F10 N2 O2 Ti -","- C88 H56 Cl8 F40 N8 O8 Ti4 -","4","1","","Sze-Man Yu; Stefan Mecking","Extremely Narrow-Dispersed High Molecular Weight Polyethylene from Living Polymerization at Elevated Temperatures with o-F Substituted Ti Enolatoimines","Journal of the American Chemical Society","2008","130","","13204","13205","10.1021/ja805304p","","","0.71073","MoKα","","0.0623","0.0393","","","0.078","0.0839","","","","","","1.005","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108443","6.0539","0.0018","18.545","0.006","23.851","0.006","90","","90","","90","","2677.7","1.4","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H36 Br N O3 -","- C28 H36 Br N O3 -","- C112 H144 Br4 N4 O12 -","4","1","","David A. Kummer; William J. Chain; Marvin R. Morales; Olga Quiroga; Andrew G. Myers","Stereocontrolled Alkylative Construction of Quaternary Carbon Centers","Journal of the American Chemical Society","2008","130","","13231","13233","10.1021/ja806021y","","","0.71073","MoKα","","0.0934","0.0536","","","0.1087","0.1239","","","","","","0.99","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108444","13.07","0.002","20.164","0.004","20.938","0.004","90","","106.521","0.007","90","","5290.3","1.7","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C66 H26 F18 N6 -","- C66 H26 F18 N6 -","- C264 H104 F72 N24 -","4","1","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71075","MoKα","","0.0887","0.0541","","","0.1266","0.1432","","","","","","1.063","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108445","29.855","0.009","13.058","0.005","21.941","0.006","90","","110.284","0.008","90","","8023","5","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C86 H72 Cl12 N6 O5 -","- C86 H72 Cl12 N6 O5 -","- C344 H288 Cl48 N24 O20 -","4","0.5","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71075","MoKα","","0.1228","0.0718","","","0.1672","0.1951","","","","","","1.046","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108446","13.7892","0.0019","12.9847","0.0017","18.106","0.003","90","","99.097","0.002","90","","3201.1","0.8","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H28 F30 N6 O2 S2 -","- C70 H28 F30 N6 O2 S2 -","- C140 H56 F60 N12 O4 S4 -","2","0.5","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71073","MoKα","","0.0871","0.0501","","","0.1212","0.1356","","","","","","1.029","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108447","16.316","0.012","14.472","0.01","12.961","0.01","90","","106.751","0.012","90","","2931","4","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C68 H36 Cl6 F12 N6 -","- C68 H36 Cl6 F12 N6 -","- C136 H72 Cl12 F24 N12 -","2","0.5","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71073","MoKα","","0.1532","0.0739","","","0.173","0.1985","","","","","","0.908","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108448","13.877","0.0014","14.6082","0.0014","16.7087","0.0017","102.042","0.002","113.657","0.002","105.822","0.002","2783.8","0.5","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C69.34 H43.38 Cl0.65 F12 N6 O1.35 -","- C69.345 H43.38 Cl0.655 F12 N6 O1.345 -","- C138.69 H86.76 Cl1.31 F24 N12 O2.69 -","2","1","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71073","MoKα","","0.0969","0.0677","","","0.1723","0.1943","","","","","","1.036","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108449","12.876","0.003","22.92","0.005","19.902","0.004","90","","96.996","0.004","90","","5830","2","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C67 H29 Cl3 F18 N6 -","- C67 H29 Cl3 F18 N6 -","- C268 H116 Cl12 F72 N24 -","4","1","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71073","MoKα","","0.1958","0.079","","","0.1887","0.235","","","","","","1.001","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108450","16.445","0.003","15.46","0.003","14.672","0.003","90","","98.883","0.003","90","","3685.5","1.2","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C70 H42 Cl20 N6 -","- C70 H42 Cl20 N6 -","- C140 H84 Cl40 N12 -","2","0.5","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71073","MoKα","","0.1221","0.0818","","","0.2257","0.2503","","","","","","1.053","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108451","13.431","0.006","14.864","0.007","18.625","0.009","93.198","0.008","99.842","0.009","99.058","0.008","3605","3","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H45 Cl6 F15 N6 O2.5 -","- C76 H45 Cl6 F15 N6 O2.5 -","- C152 H90 Cl12 F30 N12 O5 -","2","1","","Jeyaraman Sankar; Shigeki Mori; Shohei Saito; Harapriya Rath; Masaaki Suzuki; Yasuhide Inokuma; Hiroshi Shinokubo; Kil Suk Kim; Zin Seok Yoon; Jae-Yoon Shin; Jong Min Lim; Yoichi Matsuzaki; Osamu Matsushita; Atsuya Muranaka; Nagao Kobayashi; Dongho Kim; Atsuhiro Osuka","Unambiguous Identification of Möbius Aromaticity for meso-Aryl-Substituted [28]Hexaphyrins(1.1.1.1.1.1)","Journal of the American Chemical Society","2008","130","","13568","13579","10.1021/ja801983d","","","0.71073","MoKα","","0.1787","0.0932","","","0.264","0.306","","","","","","0.986","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108452","21.1012","0.0007","21.1012","0.0007","6.6095","0.0004","90","","90","","90","","2943","0.2","220","","220","","","","","","","","","4","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- C12 H6 Al O8 -","- C12 H6 Al O8 -","- C96 H48 Al8 O64 -","8","0.5","","Angiolina Comotti; Silvia Bracco; Piero Sozzani; Satoshi Horike; Ryotaro Matsuda; Jinxi Chen; Masaki Takata; Yoshiki Kubota; Susumu Kitagawa","Nanochannels of Two Distinct Cross-Sections in a Porous Al-Based Coordination Polymer","Journal of the American Chemical Society","2008","130","","13664","13672","10.1021/ja802589u","powder diffraction","","0.8007","synchrotron","","","","","","","","","","2.23","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108453","24.824","0.003","9.6318","0.0009","26.586","0.002","90","","104.671","0.003","90","","6149.5","1.1","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","(1S,2S,3R,4S)-3-methoxy-2-methyl-1,4-diphenylcyclobutanol","(1S,2S,3R,4S)-3-methoxy-2-methyl-1,4-diphenylcyclobutanol","","- C18 H20 O2 -","- C18 H20 O2 -","- C288 H320 O32 -","16","2","","Jarugu Narasimha Moorthy; Subhas Samanta; Apurba L. Koner; Satyajit Saha; Werner M. Nau","Intramolecular O-H...O Hydrogen-Bond-Mediated Reversal in the Partitioning of Conformationally Restricted Triplet 1,4-Biradicals and Amplification of Diastereodifferentiation in Their Lifetimes","Journal of the American Chemical Society","2008","130","","13608","13617","10.1021/ja8032179","","","0.71073","MoKα","","0.0975","0.0666","","","0.1732","0.203","","","","","","1.02","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108454","9.3238","0.0006","9.8521","0.0006","17.4034","0.0012","90","","90","","90","","1598.66","0.18","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(2R,3R)-3-methyl-4-oxo-1,4-diphenylbutan-2-yl acetate","(2R,3R)-3-methyl-4-oxo-1,4-diphenylbutan-2-yl acetate","","- C19 H20 O3 -","- C19 H20 O3 -","- C76 H80 O12 -","4","1","","Jarugu Narasimha Moorthy; Subhas Samanta; Apurba L. Koner; Satyajit Saha; Werner M. Nau","Intramolecular O-H...O Hydrogen-Bond-Mediated Reversal in the Partitioning of Conformationally Restricted Triplet 1,4-Biradicals and Amplification of Diastereodifferentiation in Their Lifetimes","Journal of the American Chemical Society","2008","130","","13608","13617","10.1021/ja8032179","","","0.71073","MoKα","","0.0717","0.0527","","","0.1202","0.1437","","","","","","1.097","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108455","10.4473","0.0007","13.6445","0.0009","11.1454","0.0008","90","","91.342","0.001","90","","1588.32","0.19","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","(1R,2S,3S,4S)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl acetate","(1R,2S,3S,4S)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl acetate","","- C19 H20 O3 -","- C19 H20 O3 -","- C76 H80 O12 -","4","1","","Jarugu Narasimha Moorthy; Subhas Samanta; Apurba L. Koner; Satyajit Saha; Werner M. Nau","Intramolecular O-H...O Hydrogen-Bond-Mediated Reversal in the Partitioning of Conformationally Restricted Triplet 1,4-Biradicals and Amplification of Diastereodifferentiation in Their Lifetimes","Journal of the American Chemical Society","2008","130","","13608","13617","10.1021/ja8032179","","","0.71073","MoKα","","0.096","0.0634","","","0.1492","0.1903","","","","","","1.091","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108456","10.3587","0.0013","5.9712","0.0007","13.2278","0.0016","90","","103.415","0.002","90","","795.87","0.17","293","2","293","2","","","","","","","","3","P 1 n 1","P -2yac","7","(1R,2S,3S,4R)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl acetate","(1R,2S,3S,4R)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl acetate","","- C19 H20 O3 -","- C19 H20 O3 -","- C38 H40 O6 -","2","1","","Jarugu Narasimha Moorthy; Subhas Samanta; Apurba L. Koner; Satyajit Saha; Werner M. Nau","Intramolecular O-H...O Hydrogen-Bond-Mediated Reversal in the Partitioning of Conformationally Restricted Triplet 1,4-Biradicals and Amplification of Diastereodifferentiation in Their Lifetimes","Journal of the American Chemical Society","2008","130","","13608","13617","10.1021/ja8032179","","","0.71073","MoKα","","0.0442","0.0384","","","0.0905","0.095","","","","","","1.054","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108457","10.1291","0.001","13.2035","0.0012","15.8027","0.0015","90","","97.059","0.002","90","","2097.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(1S,2S,3S,4R)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl 3,5-dinitrobenzoate","(1S,2S,3S,4R)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl 3,5-dinitrobenzoate","","- C24 H20 N2 O7 -","- C24 H20 N2 O7 -","- C96 H80 N8 O28 -","4","1","","Jarugu Narasimha Moorthy; Subhas Samanta; Apurba L. Koner; Satyajit Saha; Werner M. Nau","Intramolecular O-H...O Hydrogen-Bond-Mediated Reversal in the Partitioning of Conformationally Restricted Triplet 1,4-Biradicals and Amplification of Diastereodifferentiation in Their Lifetimes","Journal of the American Chemical Society","2008","130","","13608","13617","10.1021/ja8032179","","","0.71073","MoKα","","0.0641","0.0504","","","0.1242","0.137","","","","","","1.036","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108458","14.9428","0.0013","8.5306","0.0007","24.732","0.002","90","","90","","90","","3152.6","0.5","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","(1S,2S,3S,4S)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl acetate","(1S,2S,3S,4S)-3-hydroxy-2-methyl-3,4-diphenylcyclobutyl acetate","","- C19 H20 O3 -","- C19 H20 O3 -","- C152 H160 O24 -","8","2","","Jarugu Narasimha Moorthy; Subhas Samanta; Apurba L. Koner; Satyajit Saha; Werner M. Nau","Intramolecular O-H...O Hydrogen-Bond-Mediated Reversal in the Partitioning of Conformationally Restricted Triplet 1,4-Biradicals and Amplification of Diastereodifferentiation in Their Lifetimes","Journal of the American Chemical Society","2008","130","","13608","13617","10.1021/ja8032179","","","0.71073","MoKα","","0.0922","0.0812","","","0.1929","0.2078","","","","","","1.034","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108459","13.3411","0.0004","16.6406","0.0005","9.3406","0.0003","90","","102.552","0.002","90","","2024.09","0.11","193","2","193","2","","","","","","","chemical synthesis","3","C 1 2/c 1","-C 2yc","15","","2-(2,4,6-trichlorophenyl)-3-[(2,4,6-trichlorophenyl)methyl]indene","","- C22 H12 Cl6 -","- C22 H12 Cl6 -","- C88 H48 Cl24 -","4","0.5","","Chandrasekhar Vavilala; Neal Byrne; Christina M. Kraml; Douglas M. Ho; Robert A. Pascal","Thermal C1-C5 Diradical Cyclization of Enediynes","Journal of the American Chemical Society","2008","130","","13549","13551","10.1021/ja803413f","","","0.71073","MoKα","","0.0555","0.0456","","0.1094","","0.1027","","","1.068","","","1.125","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108460","9.0104","0.0003","13.5724","0.0004","17.8294","0.0006","90","","90.698","0.0005","90","","2180.24","0.12","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0539","0.0467","","","0.1301","0.1373","","","","","","1.054","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108461","9.0133","0.0003","13.5748","0.0004","17.8444","0.0005","90","","90.6996","0.0005","90","","2183.17","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0544","0.0469","","","0.129","0.1364","","","","","","1.038","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108462","9.017","0.0003","13.5775","0.0004","17.8629","0.0006","90","","90.7025","0.0005","90","","2186.76","0.12","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0554","0.0482","","","0.132","0.1391","","","","","","1.032","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108463","9.0186","0.0003","13.5771","0.0004","17.8801","0.0006","90","","90.7212","0.0005","90","","2189.18","0.12","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.056","0.0485","","","0.1317","0.1394","","","","","","1.023","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108464","9.0218","0.0003","13.5771","0.0004","17.9099","0.0006","90","","90.7694","0.0005","90","","2193.58","0.12","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0559","0.0484","","","0.1319","0.1394","","","","","","1.034","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108465","9.0221","0.0003","13.5591","0.0004","17.9972","0.0006","90","","91.1112","0.0005","90","","2201.21","0.12","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0612","0.0518","","","0.1395","0.1488","","","","","","1.035","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108466","9.0262","0.0003","13.558","0.0005","18.0187","0.0006","90","","91.1133","0.0006","90","","2204.66","0.13","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0612","0.0518","","","0.1397","0.1491","","","","","","1.038","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108467","9.0293","0.0003","13.5581","0.0004","18.0357","0.0006","90","","91.1401","0.0005","90","","2207.5","0.12","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0622","0.0524","","","0.1427","0.1521","","","","","","1.051","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108468","9.0332","0.0003","13.5582","0.0004","18.0514","0.0006","90","","91.1033","0.0005","90","","2210.42","0.12","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0621","0.052","","","0.1413","0.1512","","","","","","1.045","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108469","9.0964","0.0003","13.5839","0.0004","18.2278","0.0005","90","","90.6903","0.0004","90","","2252.15","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0695","0.0487","","","0.131","0.1462","","","","","","1.044","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108470","9.0184","0.0003","13.5743","0.0004","17.9303","0.0005","90","","90.8539","0.0004","90","","2194.76","0.12","135","2","135","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 B N2 O2 -","- C30 H24 B N2 O2 -","- C120 H96 B4 N8 O8 -","4","1","","Robert C. Haddon; Arindam Sarkar; Sushanta K. Pal; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham","Localization of Spin and Charge in Phenalenyl-Based Neutral Radical Conductors","Journal of the American Chemical Society","2008","130","","13683","13690","10.1021/ja8037307","","","0.71073","MoKα","","0.0537","0.0487","","","0.1343","0.1398","","","","","","1.026","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108471","14.029","0.003","19.121","0.002","17.573","0.002","90","","107.046","0.01","90","","4506.8","1.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H50 N2 Ni2 O3 P2 S2 -","- C44 H42 N2 Ni2 O2 P2 S2 -","- C176 H168 N8 Ni8 O8 P8 S8 -","4","1","","William G. Dougherty; Krishnan Rangan; Molly J. O'Hagan; Glenn P. A. Yap; Charles G. Riordan","Binuclear Complexes Containing a Methylnickel Moiety: Relevance to Organonickel Intermediates in Acetyl Coenzyme A Synthase Catalysis","Journal of the American Chemical Society","2008","130","","13510","13511","10.1021/ja803795k","","","0.71073","MoKα","","0.0458","0.0368","","","0.0918","0.0958","","","","","","1.012","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108472","8.937","0.006","10.736","0.008","26.003","0.017","90","","90","","90","","2495","3","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H34 N3 Ni O2 S2 -","- C25 H34 N3 Ni O2 S2 -","- C100 H136 N12 Ni4 O8 S8 -","4","1","","William G. Dougherty; Krishnan Rangan; Molly J. O'Hagan; Glenn P. A. Yap; Charles G. Riordan","Binuclear Complexes Containing a Methylnickel Moiety: Relevance to Organonickel Intermediates in Acetyl Coenzyme A Synthase Catalysis","Journal of the American Chemical Society","2008","130","","13510","13511","10.1021/ja803795k","","","0.71073","MoKα","","0.0643","0.0528","","","0.1262","0.1353","","","","","","1.064","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108473","11.696","0.004","28.15","0.009","13.377","0.004","90","","94.506","0.005","90","","4391","2","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45 H57 N3 Ni2 O3 P2 S2 -","- C45 H57 N3 Ni2 O3 P2 S2 -","- C180 H228 N12 Ni8 O12 P8 S8 -","4","1","","William G. Dougherty; Krishnan Rangan; Molly J. O'Hagan; Glenn P. A. Yap; Charles G. Riordan","Binuclear Complexes Containing a Methylnickel Moiety: Relevance to Organonickel Intermediates in Acetyl Coenzyme A Synthase Catalysis","Journal of the American Chemical Society","2008","130","","13510","13511","10.1021/ja803795k","","","0.71073","MoKα","","0.0492","0.0405","","","0.094","0.0993","","","","","","1.088","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108474","18.1917","0.0012","8.8565","0.0006","24.6411","0.0017","90","","107.826","0.003","90","","3779.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 N O2 -","- C22 H29 N O2 -","- C176 H232 N8 O16 -","8","2","","Shyam Krishnan; Jeffrey T. Bagdanoff; David C. Ebner; Yeeman K. Ramtohul; Uttam K. Tambar; Brian M. Stoltz","Pd-Catalyzed Enantioselective Aerobic Oxidation of Secondary Alcohols: Applications to the Total Synthesis of Alkaloids","Journal of the American Chemical Society","2008","130","","13745","13754","10.1021/ja804738b","","","0.71073","MoKα","","0.171","0.0814","","","0.1171","0.1283","","","","","","1.429","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108475","9.2969","0.0009","12.2219","0.0011","15.8158","0.0016","90","","90","","90","","1797.1","0.3","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N O4 -","- C21 H25 N O4 -","- C84 H100 N4 O16 -","4","1","","Douglas C. Beshore; Amos B. Smith","The Lyconadins: Enantioselective Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B","Journal of the American Chemical Society","2008","130","","13778","13789","10.1021/ja804939r","","","0.71069","MoKα","","0.0409","0.0386","","","0.0895","0.0912","","","","","","1.078","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108476","9.505","0.0006","6.3017","0.0004","22.2972","0.0017","90","","96.294","0.002","90","","1327.5","0.16","143","1","143","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 O5 -","- C15 H18 O5 -","- C60 H72 O20 -","4","1","","Douglas C. Beshore; Amos B. Smith","The Lyconadins: Enantioselective Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B","Journal of the American Chemical Society","2008","130","","13778","13789","10.1021/ja804939r","","","0.71069","MoKα","","0.0461","0.0341","","","0.0815","0.0872","","","","","","0.966","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108477","11.5465","0.0008","16.9259","0.0007","27.4768","0.0015","90","","91.208","0.002","90","","5368.7","0.5","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H20 I N O -","- C13 H20 I N O -","- C208 H320 I16 N16 O16 -","16","8","","Douglas C. Beshore; Amos B. Smith","The Lyconadins: Enantioselective Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B","Journal of the American Chemical Society","2008","130","","13778","13789","10.1021/ja804939r","","","0.71069","MoKα","","0.056","0.0504","","","0.1286","0.1369","","","","","","1.039","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108478","11.4784","0.0007","11.8832","0.0007","18.3144","0.0011","100.107","0.001","102.739","0.001","107.582","0.001","2242.7","0.2","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H58 Br O2 P Pd -","- C41 H58 Br O2 P Pd -","- C82 H116 Br2 O4 P2 Pd2 -","2","1","","Brett P. Fors; Donald A. Watson; Mark R. Biscoe; Stephen L. Buchwald","A Highly Active Catalyst for Pd-Catalyzed Amination Reactions: Cross-Coupling Reactions Using Aryl Mesylates and the Highly Selective Monoarylation of Primary Amines Using Aryl Chlorides","Journal of the American Chemical Society","2008","130","","13552","13554","10.1021/ja8055358","","","0.71073","MoKα","","0.0735","0.0543","","","0.1795","0.1952","","","","","","1.097","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108479","10.2858","0.0007","10.2858","0.0007","19.3715","0.0014","90","","90","","120","","1774.9","0.2","90","2","90","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C9 H15 F6 O Sb -","- C9 H15 F6 O Sb -","- C54 H90 F36 O6 Sb6 -","6","0.333333","","Mark Mascal; Nema Hafezi; Nabin K. Meher; James C. Fettinger","Oxatriquinane and Oxatriquinacene: Extraordinary Oxonium Ions","Journal of the American Chemical Society","2008","130","","13532","13533","10.1021/ja805686u","","","0.71073","MoKα","","0.0229","0.0209","","","0.054","0.0552","","","","","","1.115","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108480","10.1372","0.0007","15.7721","0.0012","10.5998","0.0006","90","","102.445","0.0015","90","","1654.93","0.19","296","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H23 N O2 -","- C17 H23 N O2 -","- C68 H92 N4 O8 -","4","1","","Sun-Liang Cui; Jing Wang; Yan-Guang Wang","Synthesis of Indoles via Domino Reaction of N-Aryl Amides and Ethyl Diazoacetate","Journal of the American Chemical Society","2008","130","","13526","13527","10.1021/ja805706r","","","0.71075","MoKα","","","0.0601","","","","0.1395","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108481","11.1392","0.0012","12.4523","0.0014","15.7097","0.0016","93.256","0.013","110.476","0.012","96.599","0.013","2016.8","0.4","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.5 H31 Cl I4 N6 Pd2 -","- C32.5 H31 Cl I4 N6 Pd2 -","- C65 H62 Cl2 I8 N12 Pd4 -","2","1","","Paulson Mathew; Antonia Neels; Martin Albrecht","1,2,3-Triazolylidenes as Versatile Abnormal Carbene Ligands for Late Transition Metals","Journal of the American Chemical Society","2008","130","","13534","13535","10.1021/ja805781s","","","0.71073","MoKα","","0.1152","0.0778","","","0.1989","0.2153","","","","","","0.89","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108482","9.7329","0.0008","17.7673","0.0019","11.0845","0.001","90","","103.598","0.01","90","","1863.1","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 Cl N3 Rh -","- C19 H25 Cl N3 Rh -","- C76 H100 Cl4 N12 Rh4 -","4","1","","Paulson Mathew; Antonia Neels; Martin Albrecht","1,2,3-Triazolylidenes as Versatile Abnormal Carbene Ligands for Late Transition Metals","Journal of the American Chemical Society","2008","130","","13534","13535","10.1021/ja805781s","","","0.71073","MoKα","","0.0691","0.0507","","","0.1259","0.1329","","","","","","1.079","","","","has coordinates,has disorder","178830","2020-10-21","18:00:00",""
"4108483","8.1315","0.0006","9.9636","0.0008","10.5002","0.0008","94.53","0.006","107.141","0.006","109.506","0.006","751.27","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H13 Cl Ir N3 O2 -","- C13 H13 Cl Ir N3 O2 -","- C26 H26 Cl2 Ir2 N6 O4 -","2","1","","Paulson Mathew; Antonia Neels; Martin Albrecht","1,2,3-Triazolylidenes as Versatile Abnormal Carbene Ligands for Late Transition Metals","Journal of the American Chemical Society","2008","130","","13534","13535","10.1021/ja805781s","","","0.71073","MoKα","","0.0447","0.0436","","","0.1101","0.111","","","","","","1.102","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108484","8.1801","0.0001","13.292","0.0002","8.1852","0.0001","90","","102.405","0.002","90","","869.2","0.02","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C15 H17 N6 O3 Re -","- C15 H17 N6 O3 Re -","- C30 H34 N12 O6 Re2 -","2","0.5","","Miguel A. Huertos; Julio Pérez; Lucía Riera; Amador Menéndez-Velázquez","From N-Alkylimidazole Ligands at a Rhenium Center: Ring Opening or Formation of NHC Complexes","Journal of the American Chemical Society","2008","130","","13530","13531","10.1021/ja805888f","","","1.54184","CuKα","","0.0234","0.0208","","","0.0555","0.0645","","","","","","1.274","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108485","7.2555","0.0002","12.3527","0.00029","12.7001","0.0004","90.4425","0.0019","96.5903","0.0014","91.4894","0.0017","1130.28","0.05","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H18 F3 N6 O6 Re S -","- C16 H18 F3 N6 O6 Re S -","- C32 H36 F6 N12 O12 Re2 S2 -","2","1","","Miguel A. Huertos; Julio Pérez; Lucía Riera; Amador Menéndez-Velázquez","From N-Alkylimidazole Ligands at a Rhenium Center: Ring Opening or Formation of NHC Complexes","Journal of the American Chemical Society","2008","130","","13530","13531","10.1021/ja805888f","","","0.71073","MoKα","","0.0293","0.0268","","","0.0772","0.0859","","","","","","1.227","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108486","12.0694","0.0003","12.4173","0.0004","19.2661","0.0006","78.624","0.002","74.171","0.002","85.731","0.002","2722.68","0.14","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H42 F3 N6 O6 Re S -","- C40 H42 F3 N6 O6 Re0.99 S -","- C80 H84 F6 N12 O12 Re1.98 S2 -","2","1","","Miguel A. Huertos; Julio Pérez; Lucía Riera; Amador Menéndez-Velázquez","From N-Alkylimidazole Ligands at a Rhenium Center: Ring Opening or Formation of NHC Complexes","Journal of the American Chemical Society","2008","130","","13530","13531","10.1021/ja805888f","","","1.54184","CuKα","","0.0869","0.0757","","","0.2266","0.2472","","","","","","1.094","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108487","11.9986","0.0002","14.6415","0.0002","21.3109","0.00029","72.274","0.0009","89.6955","0.0009","66.9111","0.0009","3252.52","0.09","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C57 H42 B Cl4 F24 N6 O3 Re -","- C57 H42 B Cl4 F24 N6 O3 Re -","- C114 H84 B2 Cl8 F48 N12 O6 Re2 -","2","1","","Miguel A. Huertos; Julio Pérez; Lucía Riera; Amador Menéndez-Velázquez","From N-Alkylimidazole Ligands at a Rhenium Center: Ring Opening or Formation of NHC Complexes","Journal of the American Chemical Society","2008","130","","13530","13531","10.1021/ja805888f","","","0.71073","MoKα","","0.0367","0.0311","","","0.0886","0.1133","","","","","","1.144","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4108488","13.4701","0.0002","11.7958","0.0002","17.5998","0.0005","90","","120.652","0.001","90","","2405.72","0.09","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 N6 O3 Re -","- C23 H25 N6 O3 Re -","- C92 H100 N24 O12 Re4 -","4","1","","Miguel A. Huertos; Julio Pérez; Lucía Riera; Amador Menéndez-Velázquez","From N-Alkylimidazole Ligands at a Rhenium Center: Ring Opening or Formation of NHC Complexes","Journal of the American Chemical Society","2008","130","","13530","13531","10.1021/ja805888f","","","0.71073","MoKα","","0.0334","0.0233","","","0.0636","0.0975","","","","","","1.143","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108489","9.0502","0.001","14.6787","0.0017","21.206","0.002","90","","92.885","0.009","90","","2813.5","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H41 N2 Ni S2 -","- C29 H41 N2 Ni S2 -","- C116 H164 N8 Ni4 S8 -","4","1","","Shenglai Yao; Carsten Milsmann; Eckhard Bill; Karl Wieghardt; Matthias Driess","From a Paramagnetic, Mononuclear Supersulfidonickel(II) Complex to a Diamagnetic Dimer with a Four-Sulfur Two-Electron Bond","Journal of the American Chemical Society","2008","130","","13536","13537","10.1021/ja806101h","","","0.71073","","","0.125","0.0492","","","0.0682","0.0827","","","","","","0.863","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108490","11.1549","0.0004","20.5247","0.0007","24.3787","0.0009","90","","90","","90","","5581.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H82 N4 Ni2 S2 -","- C58 H82 N4 Ni2 S2 -","- C232 H328 N16 Ni8 S8 -","4","1","","Shenglai Yao; Carsten Milsmann; Eckhard Bill; Karl Wieghardt; Matthias Driess","From a Paramagnetic, Mononuclear Supersulfidonickel(II) Complex to a Diamagnetic Dimer with a Four-Sulfur Two-Electron Bond","Journal of the American Chemical Society","2008","130","","13536","13537","10.1021/ja806101h","","","0.71073","MoKα","","0.0981","0.0613","","","0.0931","0.1017","","","","","","1.125","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108491","7.691","0.0017","14.82","0.003","7.7801","0.0018","90","","90","","90","","886.8","0.3","298","2","298","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Gd5 Ge4 -","- Gd5 Ge4 -","- Gd20 Ge16 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0439","0.0385","","","0.0831","0.0853","","","","","","1.161","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108492","7.676","0.002","14.787","0.004","7.763","0.002","90","","90","","90","","881.1","0.4","273","2","273","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd4 Ge4 Y -","- Gd4.021 Ge4 Y0.979 -","- Gd16.084 Ge16 Y3.916 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0642","0.0461","","","0.0864","0.0917","","","","","","1.104","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108493","7.663","0.003","14.772","0.006","7.748","0.003","90","","90","","90","","877.1","0.6","273","2","273","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd3 Ge4 Y2 -","- Gd2.963 Ge4 Y2.037 -","- Gd11.852 Ge16 Y8.148 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0688","0.0485","","","0.0881","0.0937","","","","","","1.154","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108494","7.653","0.004","14.758","0.008","7.741","0.004","90","","90","","90","","874.3","0.8","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd2 Ge4 Y3 -","- Gd1.91 Ge4 Y3.09 -","- Gd7.64 Ge16 Y12.36 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0759","0.0503","","","0.0799","0.0855","","","","","","1.105","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108495","7.6466","0.0012","14.741","0.002","7.7258","0.0012","90","","90","","90","","870.8","0.2","298","2","273","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd1.8 Ge4 Y3.2 -","- Gd1.747 Ge4 Y3.253 -","- Gd6.988 Ge16 Y13.012 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0744","0.0493","","","0.0895","0.0977","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108496","7.645","0.002","14.72","0.004","7.72","0.002","90","","90","","90","","868.8","0.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd1.6 Ge4 Y3.4 -","- Gd1.551 Ge4 Y3.449 -","- Gd6.204 Ge16 Y13.796 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0988","0.0628","","","0.1179","0.1306","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108497","7.638","0.002","14.723","0.004","7.714","0.002","90","","90","","90","","867.5","0.4","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd1.4 Ge4 Y3.6 -","- Gd1.262 Ge4 Y3.738 -","- Gd5.048 Ge16 Y14.952 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0767","0.0524","","","0.0914","0.0974","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108498","7.996","0.002","7.757","0.002","7.602","0.002","90","","112.879","0.005","90","","434.42","0.19","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Gd1.2 Ge4 Y3.8 -","- Gd1.105 Ge4 Y3.895 -","- Gd2.21 Ge8 Y7.79 -","2","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0615","0.0434","","","0.0826","0.0876","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108499","8.001","0.003","7.754","0.003","7.601","0.003","90","","112.945","0.006","90","","434.3","0.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Gd Ge4 Y4 -","- Gd0.988 Ge4 Y4.012 -","- Gd1.976 Ge8 Y8.024 -","2","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.058","0.0426","","","0.0769","0.0811","","","","","","1.058","","","","has coordinates","178830","2020-10-21","18:00:00",""
"4108500","7.9976","0.0012","7.7515","0.0012","7.6","0.0012","90","","112.952","0.002","90","","433.85","0.12","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Gd0.8 Ge4 Y4.2 -","- Gd0.772 Ge4 Y4.228 -","- Gd1.544 Ge8 Y8.456 -","2","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0426","0.0332","","","0.0574","0.0597","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108501","7.645","0.003","14.728","0.006","7.711","0.003","90","","90","","90","","868.2","0.6","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd0.6 Ge4 Y4.4 -","- Gd0.618 Ge4 Y4.382 -","- Gd2.472 Ge16 Y17.528 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.1105","0.0611","","","0.1109","0.1305","","","","","","0.979","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108502","7.6365","0.0015","14.713","0.003","7.7051","0.0014","90","","90","","90","","865.7","0.3","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd0.4 Ge4 Y4.6 -","- Gd0.291 Ge4 Y4.709 -","- Gd1.164 Ge16 Y18.836 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.073","0.0437","","","0.0758","0.0837","","","","","","0.989","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108503","7.6361","0.001","14.7135","0.0018","7.7077","0.001","90","","90","","90","","865.99","0.19","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd0.2 Ge4 Y4.8 -","- Gd0.171 Ge4 Y4.829 -","- Gd0.684 Ge16 Y19.316 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0565","0.0423","","","0.0838","0.0908","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108504","7.637","0.002","14.695","0.004","7.711","0.002","90","","90","","90","","865.4","0.4","298","2","298","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Ge4 Y5 -","- Ge4 Y5 -","- Ge16 Y20 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0713","0.0482","","","0.0798","0.0854","","","","","","1.072","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108505","7.4823","0.0018","14.738","0.004","7.746","0.0018","90","","90","","90","","854.2","0.4","298","2","298","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Gd5 Si4 -","- Gd5 Si4 -","- Gd20 Si16 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0433","0.0326","","","0.0591","0.0616","","","","","","1.102","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108506","7.464","0.002","14.708","0.005","7.742","0.002","90","","90","","90","","849.9","0.4","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd4 Si4 Y -","- Gd3.912 Si4 Y1.088 -","- Gd15.648 Si16 Y4.352 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.052","0.0356","","","0.0702","0.0756","","","","","","1.088","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108507","7.435","0.002","14.69","0.004","7.739","0.002","90","","90","","90","","845.3","0.4","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd3 Si4 Y2 -","- Gd2.87 Si4 Y2.13 -","- Gd11.48 Si16 Y8.52 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0651","0.0484","","","0.0912","0.0962","","","","","","1.108","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108508","7.429","0.005","14.696","0.009","7.738","0.005","90","","90","","90","","844.8","0.9","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd2 Si4 Y3 -","- Gd1.967 Si4 Y3.033 -","- Gd7.868 Si16 Y12.132 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0439","0.0351","","","0.0655","0.0678","","","","","","1.094","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108509","7.415","0.004","14.607","0.007","7.713","0.004","90","","90","","90","","835.4","0.7","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd Si4 Y4 -","- Gd0.976 Si4 Y4.024 -","- Gd3.904 Si16 Y16.096 -","4","0.5","","Sumohan Misra; Gordon J. Miller","Gd5-xYxTt4 (Tt = Si or Ge): Effect of Metal Substitution on Structure, Bonding, and Magnetism","Journal of the American Chemical Society","2008","130","","13900","13911","10.1021/ja802848r","","","0.71073","MoKα","","0.0454","0.035","","","0.061","0.0636","","","","","","1.084","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108510","24.5377","0.0002","24.5377","0.0002","72.0873","0.0016","90","","90","","90","","43403.7","1.1","293","2","293","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C26 H12 Cu O6 -","- C26 H12 Cu O6 -","- C416 H192 Cu16 O96 -","16","1","","Liqing Ma; Wenbin Lin","Chirality-Controlled and Solvent-Templated Catenation Isomerism in Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","13834","13835","10.1021/ja804944r","","","1.54178","CuKα","","0.0766","0.0598","","","0.132","0.1389","","","","","","0.998","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108511","24.5467","0.0012","24.5467","0.0012","72.387","0.006","90","","90","","90","","43616","5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C52 H31 Cu2 O12 -","- C52 H30.75 Cu2 O12 -","- C832 H492 Cu32 O192 -","16","1","","Liqing Ma; Wenbin Lin","Chirality-Controlled and Solvent-Templated Catenation Isomerism in Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","13834","13835","10.1021/ja804944r","","","0.71073","MoKα","","0.1447","0.0849","","","0.2125","0.2248","","","","","","0.997","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108512","24.5021","0.0005","24.5021","0.0005","71.8088","0.0019","90","","90","","90","","43110.6","1.7","243","2","243","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- C26 H12 Cu O6 -","- C26 H12 Cu O6 -","- C416 H192 Cu16 O96 -","16","1","","Liqing Ma; Wenbin Lin","Chirality-Controlled and Solvent-Templated Catenation Isomerism in Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","13834","13835","10.1021/ja804944r","","","1.54178","CuKα","","0.1193","0.0844","","","0.215","0.2318","","","","","","0.891","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108513","11.5849","0.001","12.337","0.0011","16.4652","0.0015","90","","90","","90","","2353.3","0.4","198","2","198","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H33 F3 O6 S -","- C22 H33 F3 O6 S -","- C88 H132 F12 O24 S4 -","4","1","","Serge Phoenix; Maddi Sridhar Reddy; Pierre Deslongchamps","Total Synthesis of (+)-Cassaine via Transannular Diels-Alder Reaction","Journal of the American Chemical Society","2008","130","","13989","13995","10.1021/ja805097s","","","0.71073","MoKα","","0.0375","0.0321","","","0.083","0.0868","","","","","","1.044","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108514","9.18","0.001","12.581","0.0014","16.5854","0.0018","90","","90","","90","","1915.5","0.4","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 F9 N2 O Sb -","- C16 H14 F9 N2 O Sb -","- C64 H56 F36 N8 O4 Sb4 -","4","1","","Ximin Li; Peng Liu; K. N. Houk; Vladimir B. Birman","Origin of Enantioselectivity in CF3-PIP-Catalyzed Kinetic Resolution of Secondary Benzylic Alcohols","Journal of the American Chemical Society","2008","130","","13836","13837","10.1021/ja805275s","","","0.71073","MoKα","","0.0506","0.0446","","","0.107","0.1112","","","","","","1.053","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108515","11.2158","0.0006","14.6014","0.0008","34.1994","0.0018","90","","90","","90","","5600.7","0.5","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C48 H58 Cu4 I4 N2 O8 S2 -","- C48 H58 Cu4 I4 N2 O8 S2 -","- C192 H232 Cu16 I16 N8 O32 S8 -","4","0.5","","Jai Young Lee; Hyun Jee Kim; Jong Hwa Jung; Wonbo Sim; Shim Sung Lee","Networking of Calixcrowns: From Heteronuclear Endo/Exocyclic Coordination Polymers to A Photoluminescence Switch","Journal of the American Chemical Society","2008","130","","13838","13839","10.1021/ja805337n","","","0.71073","MoKα","","0.0588","0.0375","","","0.0858","0.1005","","","","","","1.075","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108516","10.8292","0.0004","19.6626","0.0008","15.1761","0.0006","90","","103.504","0.001","90","","3142.1","0.2","173","2","173","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C48 H59 Cl4 Cu4 I6 K2 N O8 S2 -","- C48 H59 Cl4 Cu4 I6 K2 N O8 S2 -","- C96 H118 Cl8 Cu8 I12 K4 N2 O16 S4 -","2","1","","Jai Young Lee; Hyun Jee Kim; Jong Hwa Jung; Wonbo Sim; Shim Sung Lee","Networking of Calixcrowns: From Heteronuclear Endo/Exocyclic Coordination Polymers to A Photoluminescence Switch","Journal of the American Chemical Society","2008","130","","13838","13839","10.1021/ja805337n","","","0.71073","MoKα","","0.0837","0.0491","","","0.0973","0.1201","","","","","","1.05","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108517","12.7493","0.0013","13.6346","0.0014","21.526","0.002","90","","106.44","0.002","90","","3588.9","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H54 N3 Ni Si2 -","- C33 H54 N3 Ni Si2 -","- C132 H216 N12 Ni4 Si8 -","4","1","","Carl A. Laskowski; Gregory L. Hillhouse","Two-Coordinate d9 Complexes. Synthesis and Oxidation of NHC Nickel(I) Amides","Journal of the American Chemical Society","2008","130","","13846","13847","10.1021/ja805804s","","","0.71073","MoKα","","0.0593","0.0501","","","0.1361","0.1408","","","","","","1.042","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108518","41.431","0.005","11.9142","0.0015","32.218","0.004","90","","101.082","0.003","90","","15607","3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C83 H120 N6 Ni2 -","- C83 H120 N6 Ni2 -","- C664 H960 N48 Ni16 -","8","1","","Carl A. Laskowski; Gregory L. Hillhouse","Two-Coordinate d9 Complexes. Synthesis and Oxidation of NHC Nickel(I) Amides","Journal of the American Chemical Society","2008","130","","13846","13847","10.1021/ja805804s","","","0.71073","MoKα","","0.0764","0.0454","","","0.083","0.089","","","","","","0.855","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108519","12.789","0.002","32.507","0.005","20.86","0.003","90","","96.741","0.003","90","","8612","2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C87 H74 B F24 N3 Ni O4 -","- C87 H74 B F24 N3 Ni O4 -","- C348 H296 B4 F96 N12 Ni4 O16 -","4","1","","Carl A. Laskowski; Gregory L. Hillhouse","Two-Coordinate d9 Complexes. Synthesis and Oxidation of NHC Nickel(I) Amides","Journal of the American Chemical Society","2008","130","","13846","13847","10.1021/ja805804s","","","0.71073","MoKα","","0.0992","0.083","","","0.2286","0.2431","","","","","","1.078","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108520","16.127","0.003","16.608","0.004","16.626","0.003","102.917","0.004","101.969","0.004","114.548","0.004","3714.8","1.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C146 H140 B2 Cl8 F48 N6 Ni2 O0 -","- C146 H140 B2 Cl8 F48 N6 Ni2 -","- C146 H140 B2 Cl8 F48 N6 Ni2 -","1","0.5","","Carl A. Laskowski; Gregory L. Hillhouse","Two-Coordinate d9 Complexes. Synthesis and Oxidation of NHC Nickel(I) Amides","Journal of the American Chemical Society","2008","130","","13846","13847","10.1021/ja805804s","","","0.71073","MoKα","","0.1504","0.1048","","","0.2813","0.3071","","","","","","1.027","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108521","12.609","0.004","15.987","0.005","19.734","0.007","104.523","0.005","96.711","0.007","91.746","0.007","3817","2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C69 H76 B F24 N3 Ni O Si2 -","- C69 H76 B F24 N3 Ni O Si2 -","- C138 H152 B2 F48 N6 Ni2 O2 Si4 -","2","1","","Carl A. Laskowski; Gregory L. Hillhouse","Two-Coordinate d9 Complexes. Synthesis and Oxidation of NHC Nickel(I) Amides","Journal of the American Chemical Society","2008","130","","13846","13847","10.1021/ja805804s","","","0.71073","MoKα","","0.1056","0.0781","","","0.2074","0.2227","","","","","","0.983","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108522","14.4419","0.0002","24.1793","0.0003","51.1378","0.0007","90","","90","","90","","17857.1","0.4","173","2","173","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","","","- C84 H150 O4 Si4 U2 -","- C84 H150 O4 Si4 U2 -","- C672 H1200 O32 Si32 U16 -","8","1","","Alistair S. Frey; F. Geoffrey N. Cloke; Peter B. Hitchcock; Iain J. Day; Jennifer C. Green; Georgina Aitken","Mechanistic Studies on the Reductive Cyclooligomerisation of CO by U(III) Mixed Sandwich Complexes; the Molecular Structure of [(U(η-C8H6{SiiPr3-1,4}2)(η-Cp*)]2(μ-η1:η1-C2O2)","Journal of the American Chemical Society","2008","130","","13816","13817","10.1021/ja8059792","","x-ray","0.71073","MoKα","","0.0777","0.0645","","","0.1262","0.1302","","","","","","1.306","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108523","13.3216","0.0002","17.9584","0.0003","18.3048","0.0003","100.239","0.001","97.9372","0.0007","98.9409","0.0006","4194.73","0.12","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H134 Br2 Si16 -","- C60 H134 Br2 Si16 -","- C120 H268 Br4 Si32 -","2","1","","Takahiro Sasamori; Koji Hironaka; Yusuke Sugiyama; Nozomi Takagi; Shigeru Nagase; Yoshinobu Hosoi; Yukio Furukawa; Norihiro Tokitoh","Synthesis and Reactions of a Stable 1,2-Diaryl-1,2-dibromodisilene: A Precursor for Substituted Disilenes and a 1,2-Diaryldisilyne","Journal of the American Chemical Society","2008","130","","13856","13857","10.1021/ja8061002","","","0.71069","MoKα","","0.0415","0.0288","","","0.0671","0.0706","","","","","","1.03","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108524","18.5893","0.0003","12.7057","0.0002","38.2073","0.0007","90","","101.562","0.0008","90","","8841.1","0.3","103","2","103","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C63 H141 Br2 Si16 -","- C63 H141 Br2 Si16 -","- C252 H564 Br8 Si64 -","4","1","","Takahiro Sasamori; Koji Hironaka; Yusuke Sugiyama; Nozomi Takagi; Shigeru Nagase; Yoshinobu Hosoi; Yukio Furukawa; Norihiro Tokitoh","Synthesis and Reactions of a Stable 1,2-Diaryl-1,2-dibromodisilene: A Precursor for Substituted Disilenes and a 1,2-Diaryldisilyne","Journal of the American Chemical Society","2008","130","","13856","13857","10.1021/ja8061002","","","0.71069","MoKα","","0.0633","0.0399","","","0.0963","0.1081","","","","","","1.036","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108525","13.2621","0.0003","18.6172","0.0003","19.7599","0.0003","114.414","0.0008","99.4484","0.0008","96.362","0.002","4294.7","0.14","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H143 Br Si16 -","- C64 H143 Br Si16 -","- C128 H286 Br2 Si32 -","2","1","","Takahiro Sasamori; Koji Hironaka; Yusuke Sugiyama; Nozomi Takagi; Shigeru Nagase; Yoshinobu Hosoi; Yukio Furukawa; Norihiro Tokitoh","Synthesis and Reactions of a Stable 1,2-Diaryl-1,2-dibromodisilene: A Precursor for Substituted Disilenes and a 1,2-Diaryldisilyne","Journal of the American Chemical Society","2008","130","","13856","13857","10.1021/ja8061002","","","0.71069","MoKα","","0.0809","0.0445","","","0.0932","0.1022","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108526","16.6701","0.0004","16.6701","0.0004","33.7498","0.0011","90","","90","","90","","9378.8","0.4","103","2","103","2","","","","","","","","3","P 42 21 2","P 4n 2n","94","","","","- C74 H150 Si16 -","- C74 H150 Si16 -","- C296 H600 Si64 -","4","0.5","","Takahiro Sasamori; Koji Hironaka; Yusuke Sugiyama; Nozomi Takagi; Shigeru Nagase; Yoshinobu Hosoi; Yukio Furukawa; Norihiro Tokitoh","Synthesis and Reactions of a Stable 1,2-Diaryl-1,2-dibromodisilene: A Precursor for Substituted Disilenes and a 1,2-Diaryldisilyne","Journal of the American Chemical Society","2008","130","","13856","13857","10.1021/ja8061002","","","0.71069","MoKα","","0.1762","0.0723","","","0.1497","0.2028","","","","","","1.026","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108527","7.8633","0.0003","12.3026","0.0004","13.8229","0.0005","90","","90","","90","","1337.21","0.08","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 N O2 -","- C16 H19 N O2 -","- C64 H76 N4 O8 -","4","1","","Guillaume Barbe; André B. Charette","Total Synthesis of (+)-Lepadin B: Stereoselective Synthesis of Nonracemic Polysubstituted Hydroquinolines Using an RC-ROM Process","Journal of the American Chemical Society","2008","130","","13873","13875","10.1021/ja8068215","","","1.54178","CuKα","","0.0319","0.0306","","","0.0822","0.0832","","","","","","1.16","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108528","22.501","0.002","6.562","0.0007","23.365","0.002","90","","100.494","0.006","90","","3392.2","0.6","150","2","150","2","","","","","","","Synthesized by the authors. See text","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H21 N O4 -","- C19 H21 N O4 -","- C152 H168 N8 O32 -","8","1","","Guillaume Barbe; André B. Charette","Total Synthesis of (+)-Lepadin B: Stereoselective Synthesis of Nonracemic Polysubstituted Hydroquinolines Using an RC-ROM Process","Journal of the American Chemical Society","2008","130","","13873","13875","10.1021/ja8068215","","","1.54178","CuKα","","0.0811","0.058","","","0.1508","0.1668","","","","","","1.04","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108529","9.7667","0.0003","10.593","0.0003","10.9641","0.0003","80.7093","0.0015","71.5065","0.0013","73.983","0.0018","1030.59","0.05","150","2","150","2","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C26 H29 N O2 -","- C26 H29 N O2 -","- C52 H58 N2 O4 -","2","1","","Guillaume Barbe; André B. Charette","Total Synthesis of (+)-Lepadin B: Stereoselective Synthesis of Nonracemic Polysubstituted Hydroquinolines Using an RC-ROM Process","Journal of the American Chemical Society","2008","130","","13873","13875","10.1021/ja8068215","","","1.54178","CuKα","","0.0627","0.0518","","","0.1965","0.2051","","","","","","1.058","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108530","10.988","0.003","11.469","0.002","11.757","0.004","81.7","0.02","73.58","0.02","71.71","0.02","1346.9","0.7","293","2","253","2","","","","","","","","4","P -1","-P 1","2","","","","- C58 H82 Li2 O2 -","- C58 H82 Li2 O2 -","- C58 H82 Li2 O2 -","1","0.5","","Rudolf Knorr; Thomas Menke; Kathrin Ferchland; Johann Mehlstäubl; David S. Stephenson","Microsolvation and 13C-Li NMR Coupling","Journal of the American Chemical Society","2008","130","","14179","14188","10.1021/ja8026828","","","0.71069","MoKα","","0.1452","0.1072","","0.3078","0.2724","","","","1.171","1.373","1.373","","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108531","19.465","0.004","9.769","0.003","25.461","0.006","90","","104.01","0.01","90","","4697","2","173","","173","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C55 H66 Li2 O2 -","- C55 H66 Li2 O2 -","- C220 H264 Li8 O8 -","4","0.5","","Rudolf Knorr; Thomas Menke; Kathrin Ferchland; Johann Mehlstäubl; David S. Stephenson","Microsolvation and 13C-Li NMR Coupling","Journal of the American Chemical Society","2008","130","","14179","14188","10.1021/ja8026828","","","0.71073","MoKα","","0.1207","0.0548","","0.1529","0.1187","","","","1.016","1.09","1.09","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108532","11.8651","0.0015","11.168","0.003","20.524","0.004","90","0.02","95.995","0.012","90","0.02","2704.8","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H78 Li2 O2 Si2 -","- C54 H78 Li2 O2 Si2 -","- C108 H156 Li4 O4 Si4 -","2","0.5","","Rudolf Knorr; Thomas Menke; Kathrin Ferchland; Johann Mehlstäubl; David S. Stephenson","Microsolvation and 13C-Li NMR Coupling","Journal of the American Chemical Society","2008","130","","14179","14188","10.1021/ja8026828","","","0.71069","MoKα","","0.1028","0.0641","","0.1764","0.1524","","","","1.078","1.165","1.165","","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108533","6.63098","0.00022","15.9473","0.0007","13.9205","0.0006","90","","90","","90","","1472.04","0.1","","","","","","","","","","","","4","I m m a","-I 2b 2","74","MIL-53 ortho-xylene","","","- C8 H5 Al O5 -","- C18.88 Al O -","- C75.52 Al4 O4 -","4","0.25","","Luc Alaerts; Michael Maes; Lars Giebeler; Pierre A. Jacobs; Johan A. Martens; Joeri F. M. Denayer; Christine E. A. Kirschhock; Dirk E. De Vos","Selective Adsorption and Separation of ortho-Substituted Alkylaromatics with the Microporous Aluminum Terephthalate MIL-53","Journal of the American Chemical Society","2008","130","","14170","14178","10.1021/ja802761z","powder diffraction","","","","","","","","","","","","","4.55","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108534","6.63456","0.00028","16.0005","0.0008","13.8726","0.0007","90","","90","","90","","1472.66","0.12","","","","","","","","","","","","4","I m m a","-I 2b 2","74","MIL-53 meta-xylene","","","- C8 H5 Al O5 -","- C19.36 Al O -","- C77.44 Al4 O4 -","4","0.25","","Luc Alaerts; Michael Maes; Lars Giebeler; Pierre A. Jacobs; Johan A. Martens; Joeri F. M. Denayer; Christine E. A. Kirschhock; Dirk E. De Vos","Selective Adsorption and Separation of ortho-Substituted Alkylaromatics with the Microporous Aluminum Terephthalate MIL-53","Journal of the American Chemical Society","2008","130","","14170","14178","10.1021/ja802761z","powder diffraction","","","","","","","","","","","","","5.65","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108535","16.243","0.004","6.6352","0.001","13.4943","0.0028","90","","90","","90","","1454.4","0.5","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","MIL-53","","","- C8 H5 Al O5 -","- C12 Al O -","- C48 Al4 O4 -","4","0.5","","Luc Alaerts; Michael Maes; Lars Giebeler; Pierre A. Jacobs; Johan A. Martens; Joeri F. M. Denayer; Christine E. A. Kirschhock; Dirk E. De Vos","Selective Adsorption and Separation of ortho-Substituted Alkylaromatics with the Microporous Aluminum Terephthalate MIL-53","Journal of the American Chemical Society","2008","130","","14170","14178","10.1021/ja802761z","powder diffraction","","","","","","","","","","","","","8.49","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108536","6.6218","0.0017","16.2148","0.0022","13.5886","0.0023","90","","90","","90","","1459","0.5","","","","","","","","","","","","4","I m m a","-I 2b 2","74","MIL-53","","","- C8 H5 Al O5 -","- C27.2 Al O -","- C108.8 Al4 O4 -","4","0.25","","Luc Alaerts; Michael Maes; Lars Giebeler; Pierre A. Jacobs; Johan A. Martens; Joeri F. M. Denayer; Christine E. A. Kirschhock; Dirk E. De Vos","Selective Adsorption and Separation of ortho-Substituted Alkylaromatics with the Microporous Aluminum Terephthalate MIL-53","Journal of the American Chemical Society","2008","130","","14170","14178","10.1021/ja802761z","powder diffraction","","","","","","","","","","","","","8.49","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108537","6.63378","0.00022","16.2884","0.0006","13.4909","0.0005","90","","90","","90","","1457.74","0.09","","","","","","","","","","","","4","I m m a","-I 2b 2","74","MIL-53 ortho-cymene","","","- C8 H5 Al O5 -","- C20.516 Al O -","- C82.064 Al4 O4 -","4","0.25","","Luc Alaerts; Michael Maes; Lars Giebeler; Pierre A. Jacobs; Johan A. Martens; Joeri F. M. Denayer; Christine E. A. Kirschhock; Dirk E. De Vos","Selective Adsorption and Separation of ortho-Substituted Alkylaromatics with the Microporous Aluminum Terephthalate MIL-53","Journal of the American Chemical Society","2008","130","","14170","14178","10.1021/ja802761z","powder diffraction","","","","","","","","","","","","","4.87","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108538","16.101","0.0004","13.7952","0.0004","9.9077","0.0003","90","","90","","90","","2200.66","0.11","110","","110","","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C17 H30 B Cl F4 Fe N4 S -","- C17 H30 B Cl F4 Fe N4 S -","- C68 H120 B4 Cl4 F16 Fe4 N16 S4 -","4","1","","Frances Namuswe; Gary D. Kasper; Amy A. Narducci Sarjeant; Takahiro Hayashi; Courtney M. Krest; Michael T. Green; Pierre Moënne-Loccoz; David P. Goldberg","Rational Tuning of the Thiolate Donor in Model Complexes of Superoxide Reductase: Direct Evidence for a trans Influence in FeIII-OOR Complexes","Journal of the American Chemical Society","2008","130","","14189","14200","10.1021/ja8031828","","","0.71073","MoKα","","0.103","0.0719","","","0.1961","0.2412","","","","","","1.071","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108539","15.7595","0.0004","14.3395","0.0003","10.0194","0.0003","90","","90","","90","","2264.22","0.1","","","110","","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C18 H33 B F4 Fe N4 O S -","- C18 H33 B F4 Fe N4 O S -","- C72 H132 B4 F16 Fe4 N16 O4 S4 -","4","1","","Frances Namuswe; Gary D. Kasper; Amy A. Narducci Sarjeant; Takahiro Hayashi; Courtney M. Krest; Michael T. Green; Pierre Moënne-Loccoz; David P. Goldberg","Rational Tuning of the Thiolate Donor in Model Complexes of Superoxide Reductase: Direct Evidence for a trans Influence in FeIII-OOR Complexes","Journal of the American Chemical Society","2008","130","","14189","14200","10.1021/ja8031828","","","0.71073","MoKα","","0.1129","0.0947","","","0.229","0.2428","","","","","","1.076","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108540","8.8233","0.0002","22.7707","0.0006","15.2423","0.0004","90","","103.444","0.003","90","","2978.46","0.13","","","110","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C23 H26 B F13 Fe N4 S2 -","- C23 H26 B F13 Fe N4 S2 -","- C92 H104 B4 F52 Fe4 N16 S8 -","4","1","","Frances Namuswe; Gary D. Kasper; Amy A. Narducci Sarjeant; Takahiro Hayashi; Courtney M. Krest; Michael T. Green; Pierre Moënne-Loccoz; David P. Goldberg","Rational Tuning of the Thiolate Donor in Model Complexes of Superoxide Reductase: Direct Evidence for a trans Influence in FeIII-OOR Complexes","Journal of the American Chemical Society","2008","130","","14189","14200","10.1021/ja8031828","","","0.71073","MoKα","","0.0583","0.0401","","","0.0892","0.1005","","","","","","1.047","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108541","16.0267","0.0003","13.6455","0.0003","10.1189","0.0002","90","","90","","90","","2212.93","0.08","","","110","","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C17 H30 B F4 Fe N5 O2 S -","- C17 H30 B F4 Fe N5 O2 S -","- C68 H120 B4 F16 Fe4 N20 O8 S4 -","4","1","","Frances Namuswe; Gary D. Kasper; Amy A. Narducci Sarjeant; Takahiro Hayashi; Courtney M. Krest; Michael T. Green; Pierre Moënne-Loccoz; David P. Goldberg","Rational Tuning of the Thiolate Donor in Model Complexes of Superoxide Reductase: Direct Evidence for a trans Influence in FeIII-OOR Complexes","Journal of the American Chemical Society","2008","130","","14189","14200","10.1021/ja8031828","","","0.71073","MoKα","","0.1115","0.0831","","","0.2256","0.2648","","","","","","1.08","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108542","8.9104","0.0009","22.243","0.002","9.5035","0.0008","90","","90.486","0.003","90","","1883.5","0.3","110","2","110","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H9 N3 -","- C27 H9 N3 -","- C108 H36 N12 -","4","1","","Kazukuni Tahara; Takumi Fujita; Motohiro Sonoda; Motoo Shiro; Yoshito Tobe","Donors and Acceptors Based on Triangular Dehydrobenzo[12]annulenes: Formation of a Triple-Layered Rosette Structure by a Charge-Transfer Complex","Journal of the American Chemical Society","2008","130","","14339","14345","10.1021/ja804604y","","x-ray","0.71073","MoKα","","0.1761","0.0695","","","0.0886","0.1096","","","","","","0.914","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108543","5.1021","0.0011","16.743","0.003","21.306","0.004","90","","95.741","0.007","90","","1810.9","0.6","110","2","110","2","","","","","","","synthesis as described","2","P 1 21/c 1","-P 2ybc","14","","","","- C24 F12 -","- C24 F12 -","- C96 F48 -","4","1","","Kazukuni Tahara; Takumi Fujita; Motohiro Sonoda; Motoo Shiro; Yoshito Tobe","Donors and Acceptors Based on Triangular Dehydrobenzo[12]annulenes: Formation of a Triple-Layered Rosette Structure by a Charge-Transfer Complex","Journal of the American Chemical Society","2008","130","","14339","14345","10.1021/ja804604y","","x-ray","0.71073","MoKα","","0.1884","0.0834","","","0.1737","0.2297","","","","","","0.983","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108544","9.293","0.002","26.564","0.007","16.569","0.003","90","","98.146","0.007","90","","4048.9","1.6","140","2","110","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H63 N3 -","- C48 H63 N3 -","- C192 H252 N12 -","4","1","","Kazukuni Tahara; Takumi Fujita; Motohiro Sonoda; Motoo Shiro; Yoshito Tobe","Donors and Acceptors Based on Triangular Dehydrobenzo[12]annulenes: Formation of a Triple-Layered Rosette Structure by a Charge-Transfer Complex","Journal of the American Chemical Society","2008","130","","14339","14345","10.1021/ja804604y","","x-ray","0.71073","MoKα","","0.0686","0.0557","","","0.1548","0.1626","","","","","","1.093","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108545","19.6903","0.0004","19.7776","0.0005","19.8704","0.0005","90","","119.714","0.0011","90","","6720.6","0.3","110.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C164 H83 Cl6 F36 N9 -","- C164 H83 Cl6 F36 N9 -","- C328 H166 Cl12 F72 N18 -","2","1","","Kazukuni Tahara; Takumi Fujita; Motohiro Sonoda; Motoo Shiro; Yoshito Tobe","Donors and Acceptors Based on Triangular Dehydrobenzo[12]annulenes: Formation of a Triple-Layered Rosette Structure by a Charge-Transfer Complex","Journal of the American Chemical Society","2008","130","","14339","14345","10.1021/ja804604y","","","1.54187","CuKα","","0.0845","0.0566","","","0.143","0.1622","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108546","16.8732","0.0008","18.0144","0.0007","17.8583","0.0008","90","","90","","90","","5428.2","0.4","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C52 H60 I2 N2 Na2 Zr2 -","- C52 H60 I2 N2 Na2 Zr2 -","- C208 H240 I8 N8 Na8 Zr8 -","4","0.5","","Doris Pun; Christopher A. Bradley; Emil Lobkovsky; Ivan Keresztes; Paul J. Chirik","N2 Hydrogenation from Activated End-On Bis(indenyl) Zirconium Dinitrogen Complexes","Journal of the American Chemical Society","2008","130","","14046","14047","10.1021/ja8048332","","","0.71073","MoKα","","0.0648","0.0419","","","0.0951","0.1037","","","","","","0.978","","","","has coordinates","183806","2020-10-21","18:00:00",""
"4108547","15.2867","0.0004","15.2867","0.0004","23.8065","0.0013","90","","90","","90","","5563.2","0.4","173","2","173","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C52 H60 Cl2 N2 Na2 Zr2 -","- C52 H60 Cl2 N2 Na2 Zr2 -","- C208 H240 Cl8 N8 Na8 Zr8 -","4","0.5","","Doris Pun; Christopher A. Bradley; Emil Lobkovsky; Ivan Keresztes; Paul J. Chirik","N2 Hydrogenation from Activated End-On Bis(indenyl) Zirconium Dinitrogen Complexes","Journal of the American Chemical Society","2008","130","","14046","14047","10.1021/ja8048332","","","0.71073","MoKα","","0.0458","0.0364","","","0.0951","0.0995","","","","","","1.07","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4108548","10.4103","0.001","17.739","0.0017","22.685","0.002","90","","98.583","0.002","90","","4142.3","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Hexa-(4-Cyanophenyloxy)benzene","Hexa-(4-Cyanophenyloxy)benzene","","- C48 H24 N6 O6 -","- C48 H24 N6 O6 -","- C192 H96 N24 O24 -","4","1","","Dinabandhu Das; Leonard J. Barbour","Polymorphism of a Hexa-host: Isolation of Four Different Single-Crystal Phases by Melt Crystallization","Journal of the American Chemical Society","2008","130","","14032","14033","10.1021/ja804940v","","","0.71073","MoKα","","0.2037","0.0628","","","0.1621","0.2389","","","","","","0.919","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108549","17.667","0.002","19.927","0.002","11.4546","0.0014","90","","99.546","0.003","90","","3976.8","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Hexa-(4-Cyanophenyloxy)benzene","Hexa-(4-Cyanophenyloxy)benzene","","- C48 H24 N6 O6 -","- C48 H24 N6 O6 -","- C192 H96 N24 O24 -","4","1","","Dinabandhu Das; Leonard J. Barbour","Polymorphism of a Hexa-host: Isolation of Four Different Single-Crystal Phases by Melt Crystallization","Journal of the American Chemical Society","2008","130","","14032","14033","10.1021/ja804940v","","","0.71073","MoKα","","0.134","0.0838","","","0.1496","0.1684","","","","","","1.156","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108550","30.66","0.014","8.656","0.004","17.054","0.008","90","","117.276","0.007","90","","4023","3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Hexa-(4-Cyanophenyloxy)benzene","Hexa-(4-Cyanophenyloxy)benzene","","- C48 H24 N6 O6 -","- C48 H24 N6 O6 -","- C192 H96 N24 O24 -","4","0.5","","Dinabandhu Das; Leonard J. Barbour","Polymorphism of a Hexa-host: Isolation of Four Different Single-Crystal Phases by Melt Crystallization","Journal of the American Chemical Society","2008","130","","14032","14033","10.1021/ja804940v","","","0.71073","MoKα","","0.1639","0.1201","","","0.3268","0.3474","","","","","","1.124","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108551","20.65","0.003","11.8192","0.0019","15.995","0.003","90","","90","","90","","3903.8","1.1","100","2","100","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","Hexa-(4-Cyanophenyloxy)benzene","Hexa-(4-Cyanophenyloxy)benzene","","- C48 H24 N6 O6 -","- C48 H24 N6 O6 -","- C192 H96 N24 O24 -","4","0.5","","Dinabandhu Das; Leonard J. Barbour","Polymorphism of a Hexa-host: Isolation of Four Different Single-Crystal Phases by Melt Crystallization","Journal of the American Chemical Society","2008","130","","14032","14033","10.1021/ja804940v","","","0.71073","MoKα","","0.1038","0.0581","","","0.1199","0.1401","","","","","","1.023","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108552","14.0704","0.0014","18.0074","0.0018","14.4245","0.0014","90","","92.244","0.002","90","","3652","0.6","173","2","173","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C32 H20 Au F20 N S4 -","- C32 H20 Au F20 N S4 -","- C128 H80 Au4 F80 N4 S16 -","4","1","","Robert E. Bachman; Sheri A. Bodolosky-Bettis; Chelsea J. Pyle; Margaret Anne Gray","Reversible Oxidative Addition and Reductive Elimination of Fluorinated Disulfides at Gold(I) Thiolate Complexes: A New Ligand Exchange Mechanism","Journal of the American Chemical Society","2008","130","","14303","14310","10.1021/ja805266r","","","0.71073","MoKα","","0.0747","0.0472","","","0.0625","0.069","","","","","","0.938","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108553","10.2038","0.0008","19.3075","0.0015","10.2546","0.0008","90","","92.171","0.001","90","","2018.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C34 H24 Au F16 N O S4 -","- C33.99 H24 Au F16 N O S4 -","- C67.98 H48 Au2 F32 N2 O2 S8 -","2","0.5","","Robert E. Bachman; Sheri A. Bodolosky-Bettis; Chelsea J. Pyle; Margaret Anne Gray","Reversible Oxidative Addition and Reductive Elimination of Fluorinated Disulfides at Gold(I) Thiolate Complexes: A New Ligand Exchange Mechanism","Journal of the American Chemical Society","2008","130","","14303","14310","10.1021/ja805266r","","","0.71073","MoKα","","0.0778","0.0362","","","0.0827","0.0974","","","","","","0.981","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108554","13.7387","0.0017","9.9116","0.0012","17.808","0.002","90","","104.81","0.002","90","","2344.4","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Au F10 N S2 -","- C20 H18 Au F10 N S2 -","- C80 H72 Au4 F40 N4 S8 -","4","1","","Robert E. Bachman; Sheri A. Bodolosky-Bettis; Chelsea J. Pyle; Margaret Anne Gray","Reversible Oxidative Addition and Reductive Elimination of Fluorinated Disulfides at Gold(I) Thiolate Complexes: A New Ligand Exchange Mechanism","Journal of the American Chemical Society","2008","130","","14303","14310","10.1021/ja805266r","","","0.71073","MoKα","","0.067","0.0396","","","0.087","0.0966","","","","","","0.942","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108555","10.477","0.0014","11.1712","0.0015","9.7209","0.0013","90","","98.117","0.002","90","","1126.3","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 Au F8 N S2 -","- C20 H22 Au F8 N S2 -","- C40 H44 Au2 F16 N2 S4 -","2","0.5","","Robert E. Bachman; Sheri A. Bodolosky-Bettis; Chelsea J. Pyle; Margaret Anne Gray","Reversible Oxidative Addition and Reductive Elimination of Fluorinated Disulfides at Gold(I) Thiolate Complexes: A New Ligand Exchange Mechanism","Journal of the American Chemical Society","2008","130","","14303","14310","10.1021/ja805266r","","","0.71073","MoKα","","0.0645","0.0331","","","0.0698","0.0781","","","","","","1.007","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108556","8.9755","0.0004","10.0418","0.0004","15.1088","0.0007","90","","90","","90","","1361.76","0.1","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H19 N O7 -","- C12 H19 N O7 -","- C48 H76 N4 O28 -","4","1","","Qin Liu; Stéphane Perreault; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Glyoxamides with Alkylidenemalonates","Journal of the American Chemical Society","2008","130","","14066","14067","10.1021/ja805680z","","","0.71073","MoKα","","0.0329","0.0292","","","0.0766","0.0791","","","","","","1.037","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108557","8.973","0.0014","10.0535","0.0015","15.128","0.002","90","","90","","90","","1364.7","0.3","110","2","110","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 O7 -","- C13 H19 O7 -","- C52 H76 O28 -","4","1","","Qin Liu; Stéphane Perreault; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Glyoxamides with Alkylidenemalonates","Journal of the American Chemical Society","2008","130","","14066","14067","10.1021/ja805680z","","","1.54178","CuKα","","0.0318","0.0307","","","0.0787","0.0796","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108558","11.613","0.001","12.79","0.001","18.008","0.001","69.383","0.003","85.262","0.004","87.001","0.004","2494.1","0.3","204","1","204","1","","","","","","","","7","P -1","-P 1","2","","","","- C67 H73 Cl N5 O4 Pt8 S32 -","- C67 H73 Cl N5 O4 Pt8 S32 -","- C67 H73 Cl N5 O4 Pt8 S32 -","1","0.5","","Minoru Mitsumi; Hidekazu Ueda; Kazumi Furukawa; Yoshiki Ozawa; Koshiro Toriumi; Mohamedally Kurmoo","Constructing Highly Conducting Metal-Metal Bonded Solids by Electrocrystallization of [PtII2(RCS2)4] (RCS2-= Dithiocarboxylato, R = Methyl or Ethyl)","Journal of the American Chemical Society","2008","130","","14102","14104","10.1021/ja805794a","","","0.564","synchrotron","","0.077","0.0545","","","0.1299","0.1398","","","","","","1.028","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108559","13.971","0.001","13.971","0.001","28.774","0.001","90","","90","","90","","5616.4","0.6","298","1","298","1","","","","","","","","6","P 4/n n c :2","-P 4a 2bc","126","","","","- C60 H100 Cl2 O8 Pt10 S40 -","- C60 H100 Cl2 O8 Pt10 S40 -","- C120 H200 Cl4 O16 Pt20 S80 -","2","0.125","","Minoru Mitsumi; Hidekazu Ueda; Kazumi Furukawa; Yoshiki Ozawa; Koshiro Toriumi; Mohamedally Kurmoo","Constructing Highly Conducting Metal-Metal Bonded Solids by Electrocrystallization of [PtII2(RCS2)4] (RCS2-= Dithiocarboxylato, R = Methyl or Ethyl)","Journal of the American Chemical Society","2008","130","","14102","14104","10.1021/ja805794a","","","0.5643","synchrotron","","0.0493","0.0311","","","0.0789","0.0916","","","","","","1.069","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108560","9.243","0.002","17.038","0.003","18.927","0.003","90","","90","","90","","2980.7","1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H47 Fe P Si2 -","- C28 H47 Fe P Si2 -","- C112 H188 Fe4 P4 Si8 -","4","1","","Arnaud Voituriez; Armen Panossian; Nicolas Fleury-Brégeot; Pascal Retailleau; Angela Marinetti","2-Phospha[3]ferrocenophanes with Planar Chirality: Synthesis and Use in Enantioselective Organocatalytic [3 + 2] Cyclizations","Journal of the American Chemical Society","2008","130","","14030","14031","10.1021/ja806060a","","","0.71069","MoKα","","0.0392","0.0308","","","0.0689","0.0732","","","","","","1.05","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108561","8.789","0.004","12.145","0.005","13.013","0.005","90","","108.875","0.005","90","","1314.3","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H39 Fe P Si2 -","- C24 H39 Fe P Si2 -","- C48 H78 Fe2 P2 Si4 -","2","1","","Arnaud Voituriez; Armen Panossian; Nicolas Fleury-Brégeot; Pascal Retailleau; Angela Marinetti","2-Phospha[3]ferrocenophanes with Planar Chirality: Synthesis and Use in Enantioselective Organocatalytic [3 + 2] Cyclizations","Journal of the American Chemical Society","2008","130","","14030","14031","10.1021/ja806060a","","","0.71069","MoKα","","0.0806","0.0528","","","0.1074","0.1205","","","","","","1.068","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108562","11.36","0.003","50.827","0.012","13.745","0.003","90","","90.208","0.005","90","","7936","3","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C40 H48 N2 O10 S -","- C40 H48 N2 O10 S -","- C320 H384 N16 O80 S8 -","8","4","","Daisuke Uraguchi; Yusuke Ueki; Takashi Ooi","Chiral Tetraaminophosphonium Carboxylate-Catalyzed Direct Mannich-Type Reaction","Journal of the American Chemical Society","2008","130","","14088","14089","10.1021/ja806311e","","","0.71073","MoKα","","0.0884","0.0653","","","0.1618","0.1789","","","","","","1.021","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108563","13.813","0.004","15.029","0.005","15.943","0.005","90","","90","","90","","3309.7","1.8","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H46 Cl N4 O P -","- C36 H44 Cl N4 O P -","- C144 H176 Cl4 N16 O4 P4 -","4","1","","Daisuke Uraguchi; Yusuke Ueki; Takashi Ooi","Chiral Tetraaminophosphonium Carboxylate-Catalyzed Direct Mannich-Type Reaction","Journal of the American Chemical Society","2008","130","","14088","14089","10.1021/ja806311e","","","0.71073","MoKα","","0.0772","0.0615","","","0.1293","0.137","","","","","","1.078","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108564","12.212","0.003","15.543","0.003","19.012","0.004","90","","90","","90","","3608.7","1.4","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H49 Cl N4 O P -","- C38 H44 Cl N4 O P -","- C152 H176 Cl4 N16 O4 P4 -","4","1","","Daisuke Uraguchi; Yusuke Ueki; Takashi Ooi","Chiral Tetraaminophosphonium Carboxylate-Catalyzed Direct Mannich-Type Reaction","Journal of the American Chemical Society","2008","130","","14088","14089","10.1021/ja806311e","","","0.71073","MoKα","","0.1062","0.0822","","","0.1771","0.1912","","","","","","1.058","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108565","16.4909","0.0006","10.7097","0.0004","18.2991","0.0006","90","","93.922","0.003","90","","3224.3","0.2","293","","293","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","","- C48 H30 -","- C48 H30 -","- C192 H120 -","4","1","","Matthew Carnes; Daniela Buccella; Theo Siegrist; Michael L. Steigerwald; Colin Nuckolls","Reactions of Strained Hydrocarbons with Alkene and Alkyne Metathesis Catalysts","Journal of the American Chemical Society","2008","130","","14078","14079","10.1021/ja806351m","","","0.71073","MoKα","","0.1704","0.0617","","0.1711","0.059","0.059","","","","","","1.5652","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108566","11.744","0.0013","12.5222","0.0014","12.5635","0.0014","87.834","0.002","62.809","0.002","80.779","0.002","1620.9","0.3","125","2","125","2","","","","","","","","2","P -1","-P 1","2","","","","- C48 H30 -","- C48 H30 -","- C96 H60 -","2","1","","Matthew Carnes; Daniela Buccella; Theo Siegrist; Michael L. Steigerwald; Colin Nuckolls","Reactions of Strained Hydrocarbons with Alkene and Alkyne Metathesis Catalysts","Journal of the American Chemical Society","2008","130","","14078","14079","10.1021/ja806351m","","","0.71073","MoKα","","0.1609","0.0574","","","0.0972","0.1287","","","","","","0.92","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108567","10.3201","0.0003","8.9747","0.0002","13.8645","0.0004","90","","100.472","0.002","90","","1262.74","0.06","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 B N O5 -","- C12 H14 B N O5 -","- C48 H56 B4 N4 O20 -","4","1","","Eric P. Gillis; Martin D. Burke","Multistep Synthesis of Complex Boronic Acids from Simple MIDA Boronates","Journal of the American Chemical Society","2008","130","","14084","14085","10.1021/ja8063759","","","0.71073","MoKα","","0.0563","0.0391","","","0.0955","0.1049","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108568","11.219","0.01","16.968","0.015","6.392","0.006","90","","90","","90","","1216.8","1.9","193","2","193","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C12 H18 B N O3 -","- C12 H18 B N O3 -","- C48 H72 B4 N4 O12 -","4","1","","Eric P. Gillis; Martin D. Burke","Multistep Synthesis of Complex Boronic Acids from Simple MIDA Boronates","Journal of the American Chemical Society","2008","130","","14084","14085","10.1021/ja8063759","","","0.71073","MoKα","","0.0602","0.037","","","0.0853","0.091","","","","","","0.993","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108569","23.651","0.009","15.403","0.006","27.484","0.011","90","","97.371","0.006","90","","9930","7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C104 H84 O8 P4 Pd4 -","- C104 H84 O8 P4 Pd4 -","- C416 H336 O32 P16 Pd16 -","4","1","","Ramesh Giri; Jin-Quan Yu","Synthesis of 1,2- and 1,3-Dicarboxylic Acids via Pd(II)-Catalyzed Carboxylation of Aryl and Vinyl C-H Bonds","Journal of the American Chemical Society","2008","130","","14082","14083","10.1021/ja8063827","","","0.71073","MoKα","","0.0516","0.0358","","","0.0825","0.0871","","","","","","1.05","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108570","9.0355","0.0002","11.3888","0.0002","12.5102","0.0003","103.056","0.001","96.27","0.001","102.349","0.0009","1208.15","0.05","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H20 Cu Fe3 N O9 Te -","- C17 H20 Cu Fe3 N O9 Te -","- C34 H40 Cu2 Fe6 N2 O18 Te2 -","2","1","","Minghuey Shieh; Chia-Hua Ho; Wen-Shyan Sheu; Bo-Gaun Chen; Yen-Yi Chu; Chia-Yeh Miu; Hsiang-Lin Liu; Chih-Chiang Shen","Semiconducting Tellurium-Iron-Copper Carbonyl Polymers","Journal of the American Chemical Society","2008","130","","14114","14116","10.1021/ja8065623","","","0.71073","MoKα","","0.0537","0.0427","","","0.1136","0.1387","","","","","","1.108","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108571","8.201","0.0006","9.986","0.0007","16.986","0.0013","84.237","0.003","88.146","0.003","89.254","0.003","1383.25","0.18","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H24 Cu4 Fe6 N6 O18 Te2 -","- C48 H24 Cu4 Fe6 N6 O18 Te2 -","- C48 H24 Cu4 Fe6 N6 O18 Te2 -","1","0.5","","Minghuey Shieh; Chia-Hua Ho; Wen-Shyan Sheu; Bo-Gaun Chen; Yen-Yi Chu; Chia-Yeh Miu; Hsiang-Lin Liu; Chih-Chiang Shen","Semiconducting Tellurium-Iron-Copper Carbonyl Polymers","Journal of the American Chemical Society","2008","130","","14114","14116","10.1021/ja8065623","","","0.71073","MoKα","","0.1315","0.0721","","","0.1581","0.1899","","","","","","1.164","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108572","12.1878","0.0003","12.6552","0.0003","13.4231","0.0003","90","","90","","90","","2070.37","0.08","298","2","298","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C13 H6 Cu2 Fe3 N2 O9 Te -","- C13 H6 Cu2 Fe3 N2 O9 Te -","- C52 H24 Cu8 Fe12 N8 O36 Te4 -","4","1","","Minghuey Shieh; Chia-Hua Ho; Wen-Shyan Sheu; Bo-Gaun Chen; Yen-Yi Chu; Chia-Yeh Miu; Hsiang-Lin Liu; Chih-Chiang Shen","Semiconducting Tellurium-Iron-Copper Carbonyl Polymers","Journal of the American Chemical Society","2008","130","","14114","14116","10.1021/ja8065623","","","0.71073","MoKα","","0.0407","0.0297","","","0.0633","0.0727","","","","","","1.157","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108573","10.652","0.001","12.256","0.001","12.595","0.001","86.96","0.01","70.73","0.01","65.17","0.01","1401.6","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","Hydrido[bis(pentafluorophenyl){2-[(2,2,6,6-tetramethylpiperidinium-1-yl)- methyl]phenyl}borate","","- C31 H26 B D3 F10 N -","- C31 H26 B D3 F10 N -","- C62 H52 B2 D6 F20 N2 -","2","1","","Victor Sumerin; Felix Schulz; Michiko Atsumi; Cong Wang; Martin Nieger; Markku Leskelä; Timo Repo; Pekka Pyykkö; Bernhard Rieger","Molecular Tweezers for Hydrogen: Synthesis, Characterization, and Reactivity","Journal of the American Chemical Society","2008","130","","14117","14119","10.1021/ja806627s","","","0.71073","MoKα","","0.0646","0.0439","","","0.0923","0.1009","","","","","","1.034","","","","has coordinates,has disorder","178831","2020-10-21","18:00:00",""
"4108574","6.0498","0.0002","18.4635","0.0006","18.5718","0.0005","90","","90","","90","","2074.48","0.11","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 Br N2 O6 -","- C20 H19 Br N2 O6 -","- C80 H76 Br4 N8 O24 -","4","1","","Andrew J. Young; M. Christina White","Catalytic Intermolecular Allylic C-H Alkylation","Journal of the American Chemical Society","2008","130","","14090","14091","10.1021/ja806867p","","","0.71073","MoKα","","0.0488","0.0313","","","0.0583","0.0624","","","","","","1.018","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108575","11.927","0.003","12.952","0.003","9.752","0.002","94","0.02","94.03","0.02","103.22","0.02","1457.2","0.6","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H36 F12 N4 O6 P4 Re2 -","- C52 H36 F12 N4 O6 P4 Re2 -","- C52 H36 F12 N4 O6 P4 Re2 -","1","0.5","","Youhei Yamamoto; Shuhei Sawa; Yusuke Funada; Tatsuki Morimoto; Magnus Falkenström; Hiroshi Miyasaka; Sayaka Shishido; Tomoji Ozeki; Kazuhide Koike; Osamu Ishitani","Systematic Synthesis, Isolation, and Photophysical Properties of Linear-Shaped Re(I) Oligomers and Polymers with 2-20 Units","Journal of the American Chemical Society","2008","130","","14659","14674","10.1021/ja8044579","","","0.71069","MoKα","","0.0448","0.043","","","0.1275","0.1295","","","","","","1.106","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108576","24.9802","0.0001","24.9802","0.0001","30.8551","0.0002","90","","90","","90","","19253.9","0.17","293","2","293","2","","","","","","","","7","I 4/m","-I 4","87","","","","- C91 H64 F19.5 N6.5 O8 P7.25 Re3 -","- C91 H64 F19.5 N6.5 O8 P7.25 Re3 -","- C728 H512 F156 N52 O64 P58 Re24 -","8","0.5","","Youhei Yamamoto; Shuhei Sawa; Yusuke Funada; Tatsuki Morimoto; Magnus Falkenström; Hiroshi Miyasaka; Sayaka Shishido; Tomoji Ozeki; Kazuhide Koike; Osamu Ishitani","Systematic Synthesis, Isolation, and Photophysical Properties of Linear-Shaped Re(I) Oligomers and Polymers with 2-20 Units","Journal of the American Chemical Society","2008","130","","14659","14674","10.1021/ja8044579","","","0.71073","MoKα","","0.0539","0.0476","","","0.1562","0.1598","","","","","","1.075","","","","has coordinates","264242","2021-04-16","08:51:52",""
"4108577","14.485","0.002","16.5421","0.0002","22.1601","0.0004","86.85","","79.297","0.001","82.714","0.001","5172.6","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C118 H50 F72 N12 O6 P16 Re3 -","- C99 H90 F18 N6 O11 P7 Re3 -","- C198 H180 F36 N12 O22 P14 Re6 -","2","1","","Youhei Yamamoto; Shuhei Sawa; Yusuke Funada; Tatsuki Morimoto; Magnus Falkenström; Hiroshi Miyasaka; Sayaka Shishido; Tomoji Ozeki; Kazuhide Koike; Osamu Ishitani","Systematic Synthesis, Isolation, and Photophysical Properties of Linear-Shaped Re(I) Oligomers and Polymers with 2-20 Units","Journal of the American Chemical Society","2008","130","","14659","14674","10.1021/ja8044579","","","0.71073","MoKα","","0.0663","0.0438","","","0.101","0.1067","","","","","","0.891","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108578","15.8437","0.0007","16.8427","0.0005","25.4088","0.001","78.1431","0.0014","85.046","0.002","83.545","0.005","6579.7","0.4","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C128 H104 F24 N8 O10 P10 Re4 -","- C128 H104 F24 N8 O10 P10 Re4 -","- C256 H208 F48 N16 O20 P20 Re8 -","2","1","","Youhei Yamamoto; Shuhei Sawa; Yusuke Funada; Tatsuki Morimoto; Magnus Falkenström; Hiroshi Miyasaka; Sayaka Shishido; Tomoji Ozeki; Kazuhide Koike; Osamu Ishitani","Systematic Synthesis, Isolation, and Photophysical Properties of Linear-Shaped Re(I) Oligomers and Polymers with 2-20 Units","Journal of the American Chemical Society","2008","130","","14659","14674","10.1021/ja8044579","","","0.7107","MoKα","","0.0688","0.0519","","","0.1459","0.1559","","","","","","0.925","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108579","10.636","0.005","9.558","0.004","13.761","0.006","90","","92.638","0.008","90","","1397.4","1.1","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H27 Br N2 O4 S -","- C30 H27 Br N2 O4 S -","- C60 H54 Br2 N4 O8 S2 -","2","1","","Xiao-Xia Yan; Qian Peng; Qing Li; Kai Zhang; Jun Yao; Xue-Long Hou; Yun-Dong Wu","Highly Diastereoselective Switchable Enantioselective Mannich Reaction of Glycine Derivatives with Imines","Journal of the American Chemical Society","2008","130","","14362","14363","10.1021/ja804527r","","","0.71073","MoKα","","0.1239","0.0698","","","0.1615","0.189","","","","","","0.865","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108580","9.517","0.003","10.707","0.003","27.359","0.007","90","","90","","90","","2787.8","1.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H27 Br N2 O4 S -","- C30 H27 Br N2 O4 S -","- C120 H108 Br4 N8 O16 S4 -","4","1","","Xiao-Xia Yan; Qian Peng; Qing Li; Kai Zhang; Jun Yao; Xue-Long Hou; Yun-Dong Wu","Highly Diastereoselective Switchable Enantioselective Mannich Reaction of Glycine Derivatives with Imines","Journal of the American Chemical Society","2008","130","","14362","14363","10.1021/ja804527r","","","0.71073","MoKα","","0.0961","0.0527","","","0.1065","0.1154","","","","","","0.805","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108581","5.3896","0.0008","9.8022","0.0015","9.3448","0.0013","90","","90.939","0.006","90","","493.62","0.13","200","2","200","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C10 H18 O2 -","- C10 H18 O2 -","- C20 H36 O4 -","2","1","","Bruce H. Lipshutz; Benjamin Amorelli; John B. Unger","CuH-Catalyzed Enantioselective Intramolecular Reductive Aldol Reactions Generating Three New Contiguous Asymmetric Stereocenters","Journal of the American Chemical Society","2008","130","","14378","14379","10.1021/ja8045475","","","1.54178","CuKα","","0.0806","0.0804","","","0.2081","0.2087","","","","","","1.036","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108582","5.699","0.002","14.472","0.005","15.647","0.006","90","","90","","90","","1290.5","0.8","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H20 O2 -","- C15 H20 O2 -","- C60 H80 O8 -","4","1","","Bruce H. Lipshutz; Benjamin Amorelli; John B. Unger","CuH-Catalyzed Enantioselective Intramolecular Reductive Aldol Reactions Generating Three New Contiguous Asymmetric Stereocenters","Journal of the American Chemical Society","2008","130","","14378","14379","10.1021/ja8045475","","","1.54178","CuKα","","0.0273","0.0263","","","0.0692","0.0703","","","","","","1.377","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108583","17.1419","0.0004","27.4558","0.0008","19.2037","0.0005","90","","90","","90","","9038.1","0.4","120","2","120","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C81 H138 N6 P6 Rh3 -","- C81 H138 N6 P6 Rh3 -","- C324 H552 N24 P24 Rh12 -","4","0.5","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0618","0.057","","","0.137","0.1391","","","","","","1.174","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108584","12.2971","0.0003","15.0942","0.0003","14.9436","0.0002","90","","100.304","0.0012","90","","2729.02","0.09","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H45 N2 O P2 Rh -","- C24 H45 N2 O P2 Rh -","- C96 H180 N8 O4 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0529","0.0363","","","0.0851","0.0903","","","","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108585","11.3362","0.0001","17.2956","0.0003","16.0962","0.0003","90","","101.095","0.001","90","","3096.94","0.08","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H48 I N2 P2 Rh -","- C26 H48 I N2 P2 Rh -","- C104 H192 I4 N8 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0497","0.0404","","","0.1138","0.1192","","","","","","1.039","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108586","16.8151","0.0006","9.1697","0.0003","19.842","0.0006","90","","94.001","0.001","90","","3051.97","0.17","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H50 I N2 O P2 Rh -","- C26 H50 I N2 O P2 Rh -","- C104 H200 I4 N8 O4 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0294","0.0219","","","0.0504","0.0537","","","","","","1.023","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108587","7.998","0.0016","12.678","0.003","28.966","0.006","90","","93.78","0.03","90","","2930.7","1.1","120","2","120","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C24 H46 B F4 I N P2 Rh -","- C24 H46 B F4 I N P2 Rh -","- C96 H184 B4 F16 I4 N4 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0419","0.0295","","","0.0597","0.0632","","","","","","1.033","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108588","8.0221","0.0016","12.745","0.003","28.956","0.006","90","","92.56","0.03","90","","2957.6","1.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H46 I2 N P2 Rh -","- C24 H46 I2 N P2 Rh -","- C96 H184 I8 N4 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0181","0.0168","","","0.0401","0.0407","","","","","","1.191","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108589","14.0741","0.0001","12.1989","0.0001","15.3447","0.0002","90","","112.524","0.0004","90","","2433.54","0.04","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H38 I N2 P2 Rh -","- C21 H38 I N2 P2 Rh -","- C84 H152 I4 N8 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0429","0.0302","","","0.0791","0.0839","","","","","","1.056","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108590","12.5803","0.0004","14.7766","0.0003","16.148","0.0006","90","","95.4492","0.0013","90","","2988.25","0.16","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H51 N2 O2 P2 Rh -","- C26 H51 N2 O2 P2 Rh -","- C104 H204 N8 O8 P8 Rh4 -","4","1","","Moran Feller; Mark A. Iron; Linda J. W. Shimon; Yael Diskin-Posner; Gregory Leitus; David Milstein","Competitive C-I versus C-CN Reductive Elimination from a RhIII Complex. Selectivity is Controlled by the Solvent","Journal of the American Chemical Society","2008","130","","14374","14375","10.1021/ja8046798","","","0.71073","MoKα","","0.0901","0.047","","","0.1043","0.1236","","","","","","1.035","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108591","20.846","0.003","20.846","0.003","50.333","0.01","90","","90","","120","","18942","5","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","2","","","- C164 H152 Cu6 F36 N24 O44 S12 -","- C163.94 H151.68 Cu6 F36 N24 O43.92 S12.02 -","- C491.82 H455.04 Cu18 F108 N72 O131.76 S36.06 -","3","0.166667","","Tamara D. Hamilton; Giannis S. Papaefstathiou; Tomislav Friščić; Dejan-Krešimir Bučar; Leonard R. MacGillivray","Onion-Shell Metal-Organic Polyhedra (MOPs): A General Approach to Decorate the Exteriors of MOPs using Principles of Supramolecular Chemistry","Journal of the American Chemical Society","2008","130","","14366","14367","10.1021/ja804863u","","","0.7107","MoKα","","0.1603","0.1318","","","0.3318","0.3493","","","","","","1.206","","4108628","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4108592","32.104","0.005","32.104","0.005","46.061","0.009","90","","90","","120","","41113","12","173","2","173","2","","","","","","","","7","R 3 2 :H","R 3 2""","155","3","","","- C238 H273 Cl6 Cu6 N35 O54.5 S6 -","- C237.99 H272.94 Cl5.995 Cu6 N34.995 O54.48 S6 -","- C1427.94 H1637.64 Cl35.97 Cu36 N209.97 O326.88 S36 -","6","0.333333","","Tamara D. Hamilton; Giannis S. Papaefstathiou; Tomislav Friščić; Dejan-Krešimir Bučar; Leonard R. MacGillivray","Onion-Shell Metal-Organic Polyhedra (MOPs): A General Approach to Decorate the Exteriors of MOPs using Principles of Supramolecular Chemistry","Journal of the American Chemical Society","2008","130","","14366","14367","10.1021/ja804863u","","","0.7107","MoKα","","0.1589","0.1181","","","0.2549","0.2769","","","","","","1.12","","4108627","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4108593","23.8971","0.0006","23.8971","0.0006","50.1378","0.0012","90","","90","","120","","24796.3","1.1","110.1","","","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C386 H348 Br6 N18 O22 -","- C385.982 H287.982 Br5.994 N18 O21.996 -","- C1157.95 H863.946 Br17.982 N54 O65.988 -","3","0.166667","","Shuichi Hiraoka; Koji Harano; Motoo Shiro; Mitsuhiko Shionoya","A Self-Assembled Organic Capsule Formed from the Union of Six Hexagram-Shaped Amphiphile Molecules","Journal of the American Chemical Society","2008","130","","14368","14369","10.1021/ja804885k","","","1.54187","CuKα","","","0.1545","","","","0.4376","","","","","","1.484","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108594","20.04","0.0009","21.658","0.0011","21.7027","0.001","70.59","0.003","85.2","0.003","64.466","0.003","7996.8","0.7","93.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C392 H318 N34 -","- C392 H318 N34 -","- C392 H318 N34 -","1","0.5","","Shuichi Hiraoka; Koji Harano; Motoo Shiro; Mitsuhiko Shionoya","A Self-Assembled Organic Capsule Formed from the Union of Six Hexagram-Shaped Amphiphile Molecules","Journal of the American Chemical Society","2008","130","","14368","14369","10.1021/ja804885k","","","1.54187","CuKα","","","0.1452","","","","0.4273","","","","","","1.538","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108595","8.9038","0.0004","15.536","0.0005","16.043","0.0007","76.0841","0.0019","88.684","0.002","75.237","0.002","2081.24","0.15","93.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C57 H41 N3 O -","- C57 H39 N3 O -","- C114 H78 N6 O2 -","2","1","","Shuichi Hiraoka; Koji Harano; Motoo Shiro; Mitsuhiko Shionoya","A Self-Assembled Organic Capsule Formed from the Union of Six Hexagram-Shaped Amphiphile Molecules","Journal of the American Chemical Society","2008","130","","14368","14369","10.1021/ja804885k","","","1.54187","CuKα","","","0.0591","","","","0.1926","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108596","8.354","0.0013","29.211","0.004","6.2171","0.0009","90","","110.621","0.003","90","","1419.9","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H17 Co N O7 P2 -","- C10 H17 Co N O7 P2 -","- C40 H68 Co4 N4 O28 P8 -","4","1","","Andrei V. Palii; Oleg S. Reu; Sergei M. Ostrovsky; Sophia I. Klokishner; Boris S. Tsukerblat; Zhong-Ming Sun; Jiang-Gao Mao; Andrey V. Prosvirin; Han-Hua Zhao; Kim R. Dunbar","A Highly Anisotropic Cobalt(II)-Based Single-Chain Magnet: Exploration of Spin Canting in an Antiferromagnetic Array","Journal of the American Chemical Society","2008","130","","14729","14738","10.1021/ja8050052","","","0.71073","MoKα","","0.1381","0.0699","","","0.1073","0.132","","","","","","1.06","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108597","16.1583","0.0011","16.1583","0.0011","4.3026","0.0006","90","","90","","90","","1123.37","0.19","100","2","100","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C8 H7 Cl N3 S2 Se2 -","- C8 H7 Cl N3 S2 Se2 -","- C32 H28 Cl4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","","MoKα","","0.0268","0.0245","","","0.0529","0.0537","","","","","","1.071","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108598","16.2209","0.0008","16.2209","0.0008","4.3831","0.0004","90","","90","","90","","1153.27","0.13","296","2","296","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C8 H7 Cl N3 S2 Se2 -","- C8 H7 Cl N3 S2 Se2 -","- C32 H28 Cl4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.025","0.023","","","0.0482","0.0488","","","","","","1.096","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108599","16.2389","0.0005","16.2389","0.0005","4.2776","0.0003","90","","90","","90","","1128.01","0.09","100","2","100","2","","","","","","","","7","P -4 21 m","P -4 2ab","113","","","","- C7 H2 Cl F3 N3 S2 Se2 -","- C7 H2 Cl F3 N3 S2 Se2 -","- C28 H8 Cl4 F12 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.0142","0.0134","","","0.0351","0.0353","","","","","","1.098","","","","has coordinates","178831","2020-10-21","18:00:00",""
"4108600","16.2612","0.0008","16.2612","0.0008","4.3882","0.0004","90","","90","","90","","1160.36","0.13","296","2","296","2","","","","","","","","7","P -4 21 m","P -4 2ab","113","ClBPTSFEt","","","- C7 H2 Cl F3 N3 S2 Se2 -","- C7 H2 Cl F3 N3 S2 Se2 -","- C28 H8 Cl4 F12 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.0246","0.0234","","","0.0609","0.0613","","","","","","1.087","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108601","16.0276","0.0012","16.0276","0.0012","4.083","0.0007","90","","90","","90","","1048.9","0.2","100","2","100","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C8 H8 N3 S2 Se2 -","- C8 H8 N3 S2 Se2 -","- C32 H32 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.035","0.0328","","","0.0662","0.0672","","","","","","1.005","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108602","16.0088","0.0017","16.0088","0.0017","4.1385","0.0009","90","","90","","90","","1060.6","0.3","296","2","296","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","MeBPTSEt","","","- C8 H8 N3 S2 Se2 -","- C8 H8 N3 S2 Se2 -","- C32 H32 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.038","0.0337","","","0.0793","0.0815","","","","","","1.084","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108603","16.0499","0.0007","16.0499","0.0007","4.0684","0.0003","90","","90","","90","","1048.02","0.1","100","2","100","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C7 H5 Br N3 S2 Se2 -","- C7 H5 Br N3 S2 Se2 -","- C28 H20 Br4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.0289","0.0273","","","0.0654","0.0662","","","","","","1.08","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108604","16.0885","0.0007","16.0885","0.0007","4.1339","0.0003","90","","90","","90","","1070.02","0.1","296","2","296","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","BrBPTSEt","","","- C7 H5 Br N3 S2 Se2 -","- C7 H5 Br N3 S2 Se2 -","- C28 H20 Br4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Alicea A. Leitch; Kristina Cvrkalj; Daniel J. T. Myles; Robert W. Reed; Paul A. Dube; Richard T. Oakley","Ferromagnetic Ordering in Bisthiaselenazolyl Radicals: Variations on a Tetragonal Theme","Journal of the American Chemical Society","2008","130","","14791","14801","10.1021/ja8054436","","","0.71073","MoKα","","0.0195","0.0173","","","0.0402","0.041","","","","","","1.077","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108605","5.30465","0.0001","10.7432","0.0002","32.9748","0.0007","90","","90","","90","","1879.2","0.06","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H21 Cl N2 O3 -","- C20 H21 Cl N2 O3 -","- C80 H84 Cl4 N8 O12 -","4","1","","Takuya Hashimoto; Nanase Uchiyama; Keiji Maruoka","Trans-Selective Asymmetric Aziridination of Diazoacetamides and N-Boc Imines Catalyzed by Axially Chiral Dicarboxylic Acid","Journal of the American Chemical Society","2008","130","","14380","14381","10.1021/ja805635c","","","1.54187","CuKα","","","0.0312","","","","0.1028","","","","","","0.851","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108606","20.6439","0.0005","22.0806","0.0005","36.0579","0.0008","96.8","","90.34","","114.67","","14803.1","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Palladium Carbonyl Phosphine cluster","","","- C302 H302 O29 P12 Pd37.05 -","- C302 H302 O29 P12 Pd37.05 -","- C604 H604 O58 P24 Pd74.1 -","2","1","","Evgueni G. Mednikov; Lawrence F. Dahl","Nanosized Pd37(CO)28{P(p-Tolyl)3}12 Containing Geometrically Unprecedented Central 23-Atom Interpenetrating Tri-icosahedral Palladium Kernel of Double Icosahedral Units: Its Postulated Metal-Core Evolution and Resulting Stereochemical Implications","Journal of the American Chemical Society","2008","130","","14813","14821","10.1021/ja805679j","","","0.71073","MoKα","","0.0652","0.0444","","","0.112","0.1289","","","","","","0.917","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108607","8.431","0.003","11.804","0.004","29.338","0.01","90","","90","","90","","2919.7","1.7","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H28 F6 N4 O2 -","- C32 H28 F6 N4 O2 -","- C128 H112 F24 N16 O8 -","4","1","","Jeremiah P. Malerich; Koji Hagihara; Viresh H. Rawal","Chiral Squaramide Derivatives are Excellent Hydrogen Bond Donor Catalysts","Journal of the American Chemical Society","2008","130","","14416","14417","10.1021/ja805693p","","","0.71073","MoKα","","0.0644","0.0539","","","0.1273","0.132","","","","","","1.022","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108608","15.1203","0.0006","18.3992","0.0006","19.3287","0.0008","90","","90","","90","","5377.3","0.4","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C62 H58 Ir N O6 P2 -","- C54 H40 Ir N O4 P2 -","- C216 H160 Ir4 N4 O16 P8 -","4","1","","In Su Kim; Ming-Yu Ngai; Michael J. Krische","Enantioselective Iridium-Catalyzed Carbonyl Allylation from the Alcohol or Aldehyde Oxidation Level via Transfer Hydrogenative Coupling of Allyl Acetate: Departure from Chirally Modified Allyl Metal Reagents in Carbonyl Addition","Journal of the American Chemical Society","2008","130","","14891","14899","10.1021/ja805722e","","","0.7107","MoKα","","0.0896","0.0662","","","0.1576","0.1677","","","","","","1.111","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108609","10.2363","0.0002","11.5311","0.0003","9.2845","0.0002","90","","97.78","0.002","90","","1085.82","0.04","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H14 F6 N2 O4 -","- C26 H14 F6 N2 O4 -","- C52 H28 F12 N4 O8 -","2","0.5","","Qingdong Zheng; Jia Huang; Amy Sarjeant; Howard E. Katz","Pyromellitic Diimides: Minimal Cores for High Mobility n-Channel Transistor Semiconductors","Journal of the American Chemical Society","2008","130","","14410","14411","10.1021/ja805746h","","","0.71073","MoKα","","0.075","0.0406","","","0.085","0.0935","","","","","","1.029","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108610","19.851","0.006","19.851","","8.639","0.003","90","","90","","90","","3404.3","1.6","173","2","173","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C24 H60 Li4 N8 -","- C24 H60 Li4 N8 -","- C96 H240 Li16 N32 -","4","0.25","","Viktoria H. Gessner; Carsten Strohmann","Lithiation of TMEDA and its Higher Homologous TEEDA: Understanding Observed α- and β-Deprotonation","Journal of the American Chemical Society","2008","130","","14412","14413","10.1021/ja8058205","","","0.71073","MoKα","","0.0614","0.0496","","","0.1155","0.1237","","","","","","1.088","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108611","9.0546","0.0018","14.205","0.003","17.048","0.004","107.979","0.005","97.871","0.005","102.869","0.006","1982.6","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H76 Li4 N8 -","- C32 H76 Li4 N8 -","- C64 H152 Li8 N16 -","2","1","","Viktoria H. Gessner; Carsten Strohmann","Lithiation of TMEDA and its Higher Homologous TEEDA: Understanding Observed α- and β-Deprotonation","Journal of the American Chemical Society","2008","130","","14412","14413","10.1021/ja8058205","","","0.71073","MoKα","","0.1042","0.0698","","","0.1719","0.1903","","","","","","1.032","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108612","8.3693","0.0004","8.3693","0.0004","28.955","0.003","90","","90","","90","","2028.2","0.3","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C26 H24 N2 O2 -","- C26 H24 N2 O2 -","- C104 H96 N8 O8 -","4","0.5","","Kiran Kumar Solingapuram Sai; Matthew J. Tokarz; Andrew P. Malunchuk; Chong Zheng; Thomas M. Gilbert; Douglas A. Klumpp","N-Heterocyclic Superelectrophiles and Evidence for Single Electron Transfer Chemistry","Journal of the American Chemical Society","2008","130","","14388","14389","10.1021/ja8062953","","","0.71073","MoKα","","0.0344","0.0323","","","0.0762","0.0771","","","","","","1.182","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108613","19.8377","0.0016","6.0562","0.0006","6.057","0.0005","90","","90","","90","","727.69","0.11","150","2","","","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- Ag2 Ba2 O2 Se2 Zn0.953 -","- Ag2 Ba2 O2 Se2 Zn0.952 -","- Ag8 Ba8 O8 Se8 Zn3.808 -","4","","","Sebastian J. C. Herkelrath; Ian Saratovsky; Joke Hadermann; Simon J. Clarke","Fragmentation of an Infinite ZnO2 Square Plane into Discrete [ZnO2]2- Linear Units in the Oxyselenide Ba2ZnO2Ag2Se2","Journal of the American Chemical Society","2008","130","","14426","14427","10.1021/ja8063414","","x-ray","0.71073","MoKα","","","0.0273","","","","0.065","","","","","","1.053","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108614","4.2849","0.0004","4.2849","0.0004","19.8793","0.0019","90","","90","","90","","364.99","0.06","150","2","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- Ag2 Ba2 O2 Se2 Zn0.955 -","- Ag2 Ba2 O2 Se2 Zn0.957 -","- Ag4 Ba4 O4 Se4 Zn1.914 -","2","0.0625","","Sebastian J. C. Herkelrath; Ian Saratovsky; Joke Hadermann; Simon J. Clarke","Fragmentation of an Infinite ZnO2 Square Plane into Discrete [ZnO2]2- Linear Units in the Oxyselenide Ba2ZnO2Ag2Se2","Journal of the American Chemical Society","2008","130","","14426","14427","10.1021/ja8063414","","x-ray","0.71073","MoKα","","","0.0233","","","","0.0403","","","","","","1.095","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108615","20.339","0.0008","14.6476","0.0007","16.2867","0.0007","90","","97.636","0.003","90","","4809.1","0.4","93.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 N2 O4 P -","- C24 H24 N2 O4 P -","- C192 H192 N16 O32 P8 -","8","1","","Ryo Yazaki; Tatsuya Nitabaru; Naoya Kumagai; Masakatsu Shibasaki","Direct Catalytic Asymmetric Addition of Allylic Cyanides to Ketoimines","Journal of the American Chemical Society","2008","130","","14477","14479","10.1021/ja806572b","","","1.54187","CuKα","","","0.0662","","","","0.2095","","","","","","1.141","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108616","12.9714","0.0001","20.0178","0.0002","26.8437","0.0002","90","","93.4556","0","90","","6957.53","0.1","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C59 H78 B2 F24 N P2 Rh -","- C59 H78 B2 F24 N P2 Rh -","- C236 H312 B8 F96 N4 P8 Rh4 -","4","1","","Thomas M. Douglas; Adrian B. Chaplin; Andrew S. Weller","Amine-Borane σ-Complexes of Rhodium. Relevance to the Catalytic Dehydrogenation of Amine-Boranes","Journal of the American Chemical Society","2008","130","","14432","14433","10.1021/ja806582n","","","0.71073","MoKα","","0.0655","0.0542","","","0.1387","0.1484","","","","","","1.02","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108617","21.0042","0.0003","18.2723","0.0003","37.9197","0.0007","90","","102.29","0.0006","90","","14219.9","0.4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C58 H78 B2 F24 N P2 Rh -","- C58 H78 B2 F24 N P2 Rh -","- C464 H624 B16 F192 N8 P16 Rh8 -","8","1","","Thomas M. Douglas; Adrian B. Chaplin; Andrew S. Weller","Amine-Borane σ-Complexes of Rhodium. Relevance to the Catalytic Dehydrogenation of Amine-Boranes","Journal of the American Chemical Society","2008","130","","14432","14433","10.1021/ja806582n","","","0.71073","MoKα","","0.161","0.0862","","","0.1909","0.2212","","","","","","1.038","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108618","14.2225","0.0002","50.9939","0.0007","19.584","0.0003","90","","91.5253","0.0007","90","","14198.5","0.4","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H82 B3 F24 N2 P2 Rh -","- C60 H82 B3 F24 N2 P2 Rh -","- C480 H656 B24 F192 N16 P16 Rh8 -","8","2","","Thomas M. Douglas; Adrian B. Chaplin; Andrew S. Weller","Amine-Borane σ-Complexes of Rhodium. Relevance to the Catalytic Dehydrogenation of Amine-Boranes","Journal of the American Chemical Society","2008","130","","14432","14433","10.1021/ja806582n","","","0.71073","MoKα","","0.1179","0.0685","","","0.1284","0.1528","","","","","","1.093","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108619","11.1076","0.0007","14.3788","0.001","26.76","0.002","105.153","0.006","93.63","0.007","94.286","0.006","4098.5","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C37.5 H59 F6 Fe N4 O4.5 P -","- C37.5 H59 F6.019 Fe N4 O4.5 P -","- C150 H236 F24.076 Fe4 N16 O18 P4 -","4","2","","Claudio Gandolfi; Christian Moitzi; Peter Schurtenberger; Grace G. Morgan; Martin Albrecht","Improved Cooperativity of Spin-Labile Iron(III) Centers by Self-Assembly in Solution","Journal of the American Chemical Society","2008","130","","14434","14435","10.1021/ja806611y","","","0.71073","MoKα","","0.1113","0.059","","","0.1315","0.1487","","","","","","0.921","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108620","7.4389","0.0003","30.738","0.0012","15.2729","0.0006","90","","91.338","0.001","90","","3491.3","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35.28 H47.28 N P2 Sc -","- C35.266 H47.266 N P2 Sc -","- C141.064 H189.064 N4 P8 Sc4 -","4","0.5","","Jennifer Scott; Hongjun Fan; Benjamin F. Wicker; Alison R. Fout; Mu-Hyun Baik; Daniel J. Mindiola","Lewis Acid Stabilized Methylidene and Oxoscandium Complexes","Journal of the American Chemical Society","2008","130","","14438","14439","10.1021/ja806635x","","","0.71073","MoKα","","0.0521","0.0416","","","0.1216","0.1288","","","","","","1.068","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108621","14.7065","0.0005","20.5075","0.0007","14.8336","0.0005","90","","103.317","0.001","90","","4353.4","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H74 Al2 N P2 Sc -","- C39 H74 Al2 N P2 Sc -","- C156 H296 Al8 N4 P8 Sc4 -","4","1","","Jennifer Scott; Hongjun Fan; Benjamin F. Wicker; Alison R. Fout; Mu-Hyun Baik; Daniel J. Mindiola","Lewis Acid Stabilized Methylidene and Oxoscandium Complexes","Journal of the American Chemical Society","2008","130","","14438","14439","10.1021/ja806635x","","","0.71073","MoKα","","0.0409","0.0322","","","0.09","0.0946","","","","","","1.036","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108622","18.848","0.003","11.3543","0.0018","22.607","0.003","90","","95.725","0.004","90","","4813.9","1.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H76 N3 P2 Sc -","- C50 H76 N3 P2 Sc -","- C200 H304 N12 P8 Sc4 -","4","1","","Jennifer Scott; Hongjun Fan; Benjamin F. Wicker; Alison R. Fout; Mu-Hyun Baik; Daniel J. Mindiola","Lewis Acid Stabilized Methylidene and Oxoscandium Complexes","Journal of the American Chemical Society","2008","130","","14438","14439","10.1021/ja806635x","","","0.71073","MoKα","","0.1245","0.0589","","","0.1293","0.1576","","","","","","1.012","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108623","10.822","0.004","14.58","0.005","17.981","0.007","96.519","0.006","104.568","0.005","106.793","0.005","2575.2","1.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C99 H156 Al4 N2 O2 P4 Sc2 -","- C99 H156 Al4 N2 O2 P4 Sc2 -","- C99 H156 Al4 N2 O2 P4 Sc2 -","1","0.5","","Jennifer Scott; Hongjun Fan; Benjamin F. Wicker; Alison R. Fout; Mu-Hyun Baik; Daniel J. Mindiola","Lewis Acid Stabilized Methylidene and Oxoscandium Complexes","Journal of the American Chemical Society","2008","130","","14438","14439","10.1021/ja806635x","","","0.71073","MoKα","","0.0995","0.0635","","","0.1627","0.1847","","","","","","1.028","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108624","18.266","0.005","20.589","0.005","21.014","0.005","63.743","0.005","83.532","0.005","88.224","0.005","7041","3","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C142 H152 Cl8 N11 Ni2 Pt -","- C142 H152 Cl8 N11 Ni2 Pt -","- C284 H304 Cl16 N22 Ni4 Pt2 -","2","1","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Pt(II)- and Pt(IV)-Bridged Cofacial Diporphyrins via Carbon-Transition Metal σ-Bonds","Journal of the American Chemical Society","2008","130","","14440","14441","10.1021/ja8066385","","","0.71069","MoKα","","0.0671","0.0537","","","0.1441","0.1537","","","","","","1.043","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108625","13.5747","0.0015","30.56","0.003","33.71","0.004","90","","90","","90","","13984","3","90","2","90","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C158 H167 Cl6 N10 Ni2 Pt -","- C158 H167 Cl6 N10 Ni2 Pt -","- C632 H668 Cl24 N40 Ni8 Pt4 -","4","1","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Pt(II)- and Pt(IV)-Bridged Cofacial Diporphyrins via Carbon-Transition Metal σ-Bonds","Journal of the American Chemical Society","2008","130","","14440","14441","10.1021/ja8066385","","","0.71073","MoKα","","0.0429","0.0356","","","0.0846","0.0917","","","","","","1.009","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108626","35.482","0.005","27.205","0.005","17.098","0.005","90","0.005","111.967","0.005","90","0.005","15306","6","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C166 H184 N12 Ni2 Pt -","- C166 H184 N12 Ni2 Pt -","- C664 H736 N48 Ni8 Pt4 -","4","0.5","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Pt(II)- and Pt(IV)-Bridged Cofacial Diporphyrins via Carbon-Transition Metal σ-Bonds","Journal of the American Chemical Society","2008","130","","14440","14441","10.1021/ja8066385","","","0.71069","MoKα","","0.0484","0.0405","","","0.1144","0.1197","","","","","","1.111","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108627","32.104","0.005","32.104","0.005","46.061","0.009","90","","90","","120","","41113","12","173","2","173","2","","","","","","","","7","R 3 2 :H","R 3 2""","155","4","","","- C238 H273 Cl6 Cu6 N35 O54.5 S6 -","- C237.99 H272.94 Cl5.995 Cu6 N34.995 O53.97 S6 -","- C1427.94 H1637.64 Cl35.97 Cu36 N209.97 O323.82 S36 -","6","0.333333","","Tamara D. Hamilton; Giannis S. Papaefstathiou; Tomislav Friščić; Dejan-Krešimir Bučar; Leonard R. MacGillivray","Onion-Shell Metal-Organic Polyhedra (MOPs): A General Approach to Decorate the Exteriors of MOPs using Principles of Supramolecular Chemistry","Journal of the American Chemical Society","2008","130","","14366","14367","10.1021/ja804863u","","","0.7107","MoKα","","0.1328","0.0854","","","0.2184","0.26","","","","","","1.042","","","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4108628","20.846","0.003","20.846","0.003","50.333","0.01","90","","90","","120","","18942","5","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C164 H152 Cu6 F36 N24 O44 S12 -","- C163.94 H151.68 Cu6 F35.04 N24 O42.96 S12.02 -","- C491.82 H455.04 Cu18 F105.12 N72 O128.88 S36.06 -","3","0.166667","","Tamara D. Hamilton; Giannis S. Papaefstathiou; Tomislav Friščić; Dejan-Krešimir Bučar; Leonard R. MacGillivray","Onion-Shell Metal-Organic Polyhedra (MOPs): A General Approach to Decorate the Exteriors of MOPs using Principles of Supramolecular Chemistry","Journal of the American Chemical Society","2008","130","","14366","14367","10.1021/ja804863u","","","0.7107","MoKα","","0.1355","0.1181","","","0.3458","0.36","","","","","","1.204","","","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4108629","17.879","0.005","12.945","0.005","31.057","0.005","90","0.005","90","0.005","90","0.005","7188","4","110","2","110","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C34 H55 N3 Ni O S3 -","- C34 H55 N3 Ni O S3 -","- C272 H440 N24 Ni8 O8 S24 -","8","2","","Andrew G. Tennyson; Shanta Dhar; Stephen J. Lippard","Synthesis and Characterization of {Ni(NO)}10 and {Co(NO)2}10 Complexes Supported by Thiolate Ligands","Journal of the American Chemical Society","2008","130","","15087","15098","10.1021/ja803992y","","","0.71073","MoKα","","0.0841","0.0775","","","0.1686","0.1717","","","","","","1.23","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108630","11.428","0.005","12.295","0.005","16.705","0.007","90","","106.599","0.006","90","","2249.4","1.6","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H60 N5 Ni2 O2 S4 -","- C42 H60 N5 Ni2 O2 S4 -","- C84 H120 N10 Ni4 O4 S8 -","2","0.5","","Andrew G. Tennyson; Shanta Dhar; Stephen J. Lippard","Synthesis and Characterization of {Ni(NO)}10 and {Co(NO)2}10 Complexes Supported by Thiolate Ligands","Journal of the American Chemical Society","2008","130","","15087","15098","10.1021/ja803992y","","","0.71073","MoKα","","0.0685","0.0516","","","0.0965","0.1022","","","","","","1.169","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108631","13.4199","0.0017","16.051","0.002","11.0093","0.0014","90","","108.937","0.002","90","","2243.1","0.5","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Co N3 O2 S2 -","- C20 H30 Co N3 O2 S2 -","- C80 H120 Co4 N12 O8 S8 -","4","1","","Andrew G. Tennyson; Shanta Dhar; Stephen J. Lippard","Synthesis and Characterization of {Ni(NO)}10 and {Co(NO)2}10 Complexes Supported by Thiolate Ligands","Journal of the American Chemical Society","2008","130","","15087","15098","10.1021/ja803992y","","","0.71073","MoKα","","0.0787","0.0511","","","0.1004","0.1104","","","","","","1.08","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108632","17.05","0.003","9.0194","0.0015","32.227","0.006","90","","90","","90","","4955.9","1.5","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H15 Co3 N6 O6 S3 -","- C18 H15 Co3 N6 O6 S3 -","- C144 H120 Co24 N48 O48 S24 -","8","1","","Andrew G. Tennyson; Shanta Dhar; Stephen J. Lippard","Synthesis and Characterization of {Ni(NO)}10 and {Co(NO)2}10 Complexes Supported by Thiolate Ligands","Journal of the American Chemical Society","2008","130","","15087","15098","10.1021/ja803992y","","","0.71073","MoKα","","0.0685","0.0437","","","0.0908","0.0995","","","","","","1.052","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108633","8.784","0.0004","14.031","0.0004","22.2306","0.0009","90","","90","","90","","2739.88","0.18","150","","150","","","","","","","","","3","P c a b","-P 2bc 2ac","61","","","","- C14 H16 O6 -","- C14 H16 O6 -","- C112 H128 O48 -","8","1","","Manon Chaumontet; Riccardo Piccardi; Nicolas Audic; Julien Hitce; Jean-Louis Peglion; Eric Clot; Olivier Baudoin","Synthesis of Benzocyclobutenes by Palladium-Catalyzed C-H Activation of Methyl Groups: Method and Mechanistic Study","Journal of the American Chemical Society","2008","130","","15157","15166","10.1021/ja805598s","","","0.71069","MoKα","","0.0948","0.0509","","0.0986","0.0587","0.0587","","","","","","1.1357","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108634","9.8274","0.0012","10.3168","0.0012","17.424","0.002","82.862","0.009","77.587","0.008","75.293","0.008","1664.2","0.3","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H22 N6 -","- C28 H22 N6 -","- C84 H66 N18 -","3","1.5","","Ian S. Tidmarsh; Thomas B. Faust; Harry Adams; Lindsay P. Harding; Luca Russo; William Clegg; Michael D. Ward","Octanuclear Cubic Coordination Cages","Journal of the American Chemical Society","2008","130","","15167","15175","10.1021/ja805605y","","","0.71073","MoKα","","0.2374","0.0513","","","0.1016","0.1643","","","","","","0.771","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108635","10.7709","0.0015","11.1673","0.0018","19.954","0.004","90","","90","","90","","2400.1","0.7","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C32 H24 N6 -","- C32 H24 N6 -","- C128 H96 N24 -","4","0.5","","Ian S. Tidmarsh; Thomas B. Faust; Harry Adams; Lindsay P. Harding; Luca Russo; William Clegg; Michael D. Ward","Octanuclear Cubic Coordination Cages","Journal of the American Chemical Society","2008","130","","15167","15175","10.1021/ja805605y","","","0.71073","MoKα","","0.0502","0.0324","","","0.0704","0.0779","","","","","","1.026","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108636","26.5388","0.0014","26.5941","0.0013","30.384","0.002","99.664","0.003","113.727","0.003","110.117","0.002","17224.3","1.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C403 H343 B16 F64 N87 O31 Zn8 -","- C403 H343 B9 F36 N87 O31 Zn8 -","- C403 H343 B9 F36 N87 O31 Zn8 -","1","0.5","","Ian S. Tidmarsh; Thomas B. Faust; Harry Adams; Lindsay P. Harding; Luca Russo; William Clegg; Michael D. Ward","Octanuclear Cubic Coordination Cages","Journal of the American Chemical Society","2008","130","","15167","15175","10.1021/ja805605y","","","0.71073","MoKα","","0.1469","0.1056","","","0.2885","0.3114","","","","","","0.988","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108637","44.45","0.02","30.288","0.015","31.745","0.016","90","","124.28","0.006","90","","35314","3","120","2","120","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C394 H318 B16 Cu8 F64 N82 O20 -","- C394 H318 B4 Cu8 F16 N82 O20 -","- C788 H636 B8 Cu16 F32 N164 O40 -","2","0.25","","Ian S. Tidmarsh; Thomas B. Faust; Harry Adams; Lindsay P. Harding; Luca Russo; William Clegg; Michael D. Ward","Octanuclear Cubic Coordination Cages","Journal of the American Chemical Society","2008","130","","15167","15175","10.1021/ja805605y","","","0.6926","synchrotron","","0.1564","0.1097","","","0.2931","0.3137","","","","","","0.918","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108638","32.9366","0.0013","29.9278","0.0012","39.8346","0.0015","90","","96.502","0.002","90","","39013","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C342 H288 B16 Co8 F64 N72 O6 -","- C342 H282 B10 Co8 F40 N72 O6 -","- C1368 H1128 B40 Co32 F160 N288 O24 -","4","0.5","","Ian S. Tidmarsh; Thomas B. Faust; Harry Adams; Lindsay P. Harding; Luca Russo; William Clegg; Michael D. Ward","Octanuclear Cubic Coordination Cages","Journal of the American Chemical Society","2008","130","","15167","15175","10.1021/ja805605y","","","0.71073","MoKα","","0.1127","0.0733","","","0.1968","0.2146","","","","","","1.012","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108639","33.0351","0.0015","29.5646","0.0014","39.8684","0.0018","90","","97.011","0.002","90","","38647","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C341 H284 B16 F64 N72 Ni8 O5 -","- C341 H279 B12 F48 N72 Ni8 O5 -","- C1364 H1116 B48 F192 N288 Ni32 O20 -","4","0.5","","Ian S. Tidmarsh; Thomas B. Faust; Harry Adams; Lindsay P. Harding; Luca Russo; William Clegg; Michael D. Ward","Octanuclear Cubic Coordination Cages","Journal of the American Chemical Society","2008","130","","15167","15175","10.1021/ja805605y","","","0.71073","MoKα","","0.1025","0.0853","","","0.2575","0.2716","","","","","","1.119","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108640","9.3839","0.0006","17.3423","0.0011","10.0786","0.0006","90","","93.516","0.001","90","","1637.09","0.18","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H22 Cu2 F8 N4 O2 -","- C38 H22 Cu2 F8 N4 O2 -","- C76 H44 Cu4 F16 N8 O4 -","2","0.5","","Hien-Quang Do; Rana M. Kashif Khan; Olafs Daugulis","A General Method for Copper-Catalyzed Arylation of Arene C-H Bonds","Journal of the American Chemical Society","2008","130","","15185","15192","10.1021/ja805688p","","","0.71073","MoKα","","0.04","0.0282","","","0.076","0.0834","","","","","","0.996","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108641","9.6991","0.0001","15.7821","0.0002","24.6302","0.0002","88.4421","0.0007","84.1063","0.0006","76.9381","0.0006","3653.21","0.07","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C42 H30 F6 Ir N4 P S -","- C42 H30 F6 Ir N4 P S -","- C168 H120 F24 Ir4 N16 P4 S4 -","4","2","","Stefan Graber; Kevin Doyle; Markus Neuburger; Catherine E. Housecroft; Edwin C. Constable; Rubén D. Costa; Enrique Ortí; Diego Repetto; Henk J. Bolink","A Supramolecularly-Caged Ionic Iridium(III) Complex Yielding Bright and Very Stable Solid-State Light-Emitting Electrochemical Cells","Journal of the American Chemical Society","2008","130","","14944","14945","10.1021/ja805900e","","","0.71073","MoKα","","0.0425","0.025","","0.0464","0.0277","0.0277","","","","","","1.0934","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108642","7.5475","0.0015","18.249","0.004","8.2324","0.0016","90","","102.21","0.03","90","","1108.2","0.4","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H26 Cl2 N2 O6 -","- C20 H26 Cl2 N2 O6 -","- C40 H52 Cl4 N4 O12 -","2","1","","K. C. Nicolaou; Stephen M. Dalby; Utpal Majumder","A Concise Asymmetric Total Synthesis of Aspidophytine","Journal of the American Chemical Society","2008","130","","14942","14943","10.1021/ja806176w","","","0.71073","MoKα","","0.0597","0.0498","","","0.1291","0.1367","","","","","","1.057","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108643","8.924","0.0002","36.684","0.0011","11.411","0.0003","90","","112.71","0.0015","90","","3445.98","0.16","110","2","110","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C42 H55 Co2 Cr2 F K N O40 -","- C42 H55 Co2 Cr2 F K N O40 -","- C84 H110 Co4 Cr4 F2 K2 N2 O80 -","2","0.5","","Eugenio Coronado; José R. Galán-Mascarós; Carlos Martí-Gastaldo","Single Chain Magnets Based on the Oxalate Ligand","Journal of the American Chemical Society","2008","130","","14987","14989","10.1021/ja806298t","","","0.71073","MoKα","","0.1154","0.0665","","","0.158","0.1756","","","","","","0.895","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108644","28.5869","0.0006","7.9194","0.0002","15.1338","0.0003","90","","112.617","0.001","90","","3162.67","0.12","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H32 Cl6 N4 Ta2 -","- C28 H32 Cl6 N4 Ta2 -","- C112 H128 Cl24 N16 Ta8 -","4","0.5","","Seth B. Herzon; John F. Hartwig","Hydroaminoalkylation of Unactivated Olefins with Dialkylamines","Journal of the American Chemical Society","2008","130","","14940","14941","10.1021/ja806367e","","","0.71073","MoKα","","0.0247","0.019","","","0.0352","0.0366","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108645","6.8727","0.0019","11.358","0.003","21.931","0.006","90","","96.067","0.004","90","","1702.3","0.8","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H18 Cl4 N O Ta -","- C11 H18 Cl4 N O Ta -","- C44 H72 Cl16 N4 O4 Ta4 -","4","1","","Seth B. Herzon; John F. Hartwig","Hydroaminoalkylation of Unactivated Olefins with Dialkylamines","Journal of the American Chemical Society","2008","130","","14940","14941","10.1021/ja806367e","","","0.71073","MoKα","","0.0518","0.0266","","","0.0492","0.0528","","","","","","0.897","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4108646","42.907","0.0014","13.2352","0.0006","36.6384","0.0016","90","","93.304","0.004","90","","20771.7","1.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H94 K24 O225 P4 W52 -","- K14.8 O207.4 P4 W52 -","- K59.2 O829.6 P16 W208 -","4","0.5","","Chullikkattil P. Pradeep; De-Liang Long; Carsten Streb; Leroy Cronin","""Bottom-Up"" Meets ""Top-Down"" Assembly in Nanoscale Polyoxometalate Clusters: Self-Assembly of [P4W52O178]24- and Disassembly to [P3W39O134]19-","Journal of the American Chemical Society","2008","130","","14946","14947","10.1021/ja806596j","","","0.71073","MoKα","","0.1021","0.064","","","0.172","0.1863","","","","","","1.061","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108647","18.8407","0.0005","19.7247","0.0007","29.5038","0.0008","76.332","0.002","88.495","0.002","65.954","0.003","9699","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- H96 K20 O200 P4 W44 -","- K20 O196.9 P4 W44 -","- K40 O393.8 P8 W88 -","2","1","","Chullikkattil P. Pradeep; De-Liang Long; Carsten Streb; Leroy Cronin","""Bottom-Up"" Meets ""Top-Down"" Assembly in Nanoscale Polyoxometalate Clusters: Self-Assembly of [P4W52O178]24- and Disassembly to [P3W39O134]19-","Journal of the American Chemical Society","2008","130","","14946","14947","10.1021/ja806596j","","","0.71073","MoKα","","0.054","0.0347","","","0.0827","0.0874","","","","","","0.94","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108648","20.5411","0.0009","21.1805","0.0011","22.446","0.0007","69.588","0.004","79.143","0.003","67.42","0.004","8434.1","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- H60 K19 O164 P3 W39 -","- K18.5 O161.3 P3 W39 -","- K37 O322.6 P6 W78 -","2","1","","Chullikkattil P. Pradeep; De-Liang Long; Carsten Streb; Leroy Cronin","""Bottom-Up"" Meets ""Top-Down"" Assembly in Nanoscale Polyoxometalate Clusters: Self-Assembly of [P4W52O178]24- and Disassembly to [P3W39O134]19-","Journal of the American Chemical Society","2008","130","","14946","14947","10.1021/ja806596j","","","0.71073","MoKα","","0.083","0.0443","","","0.0913","0.0992","","","","","","0.907","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108649","26.0197","0.0004","34.9666","0.0007","44.9034","0.001","90","","90","","90","","40854","1.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- H60 K19 O164 P3 W39 -","- K18.75 O162.5 P3 W39 -","- K150 O1300 P24 W312 -","8","1","","Chullikkattil P. Pradeep; De-Liang Long; Carsten Streb; Leroy Cronin","""Bottom-Up"" Meets ""Top-Down"" Assembly in Nanoscale Polyoxometalate Clusters: Self-Assembly of [P4W52O178]24- and Disassembly to [P3W39O134]19-","Journal of the American Chemical Society","2008","130","","14946","14947","10.1021/ja806596j","","","0.71073","MoKα","","0.1346","0.0705","","","0.1307","0.145","","","","","","1.002","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108650","19.3532","0.0011","7.5226","0.0005","23.5522","0.0014","90","","90","","90","","3428.9","0.4","200.1","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-Oxo-1-hydro-2-tert-butylbenzo[bc]corannulene","","- C27 H18 O -","- C27 H18 O -","- C216 H144 O8 -","8","1","","Shinsuke Nishida; Yasushi Morita; Akira Ueda; Tadahiro Kobayashi; Kozo Fukui; Kanako Ogasawara; Kazunobu Sato; Takeji Takui; Kazuhiro Nakasuji","Curve-Structured Phenalenyl Chemistry: Synthesis, Electronic Structure, and Bowl-Inversion Barrier of a Phenalenyl-Fused Corannulene Anion","Journal of the American Chemical Society","2008","130","","14954","14955","10.1021/ja806708j","","","0.71075","MoKα","","","0.1265","","","","0.2123","","","","","","1.112","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108651","14.2388","0.0007","14.312","0.0006","18.3101","0.001","90","","105.74","0.006","90","","3591.4","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H23 B F20 Si2 -","- C36 H23 B F20 Si2 -","- C144 H92 B4 F80 Si8 -","4","1","","Andrea Klaer; Wolfgang Saak; Detlev Haase; Thomas Müller","Molecular Structure of a Cyclopropyl Substituted Vinyl Cation","Journal of the American Chemical Society","2008","130","","14956","14957","10.1021/ja8069055","","","0.71073","MoKα","","0.0668","0.0284","","","0.0454","0.0492","","","","","","0.704","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108652","7.9537","0.0014","9.9845","0.0017","12.839","0.002","90","","90","","90","","1019.6","0.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Cl N O -","- C12 H10 Cl N O -","- C48 H40 Cl4 N4 O4 -","4","1","","Barry M. Trost; Patrick J. McDougall; Olaf Hartmann; Peter T. Wathen","Asymmetric Synthesis of Bicyclo[4.3.1]decadienes and Bicyclo[3.3.2]decadienes via [6 + 3] Trimethylenemethane Cycloaddition with Tropones","Journal of the American Chemical Society","2008","130","","14960","14961","10.1021/ja806979b","","","0.71073","MoKα","","0.0255","0.0244","","","0.0635","0.0643","","","","","","1.034","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108653","10.917","0.0016","10.9711","0.0016","12.649","0.0019","96.687","0.002","112.794","0.002","108.936","0.002","1269.1","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H72 N4 P2 -","- C54 H72 N4 P2 -","- C54 H72 N4 P2 -","1","0.5","","Yuzhong Wang; Yaoming Xie; Pingrong Wei; R. Bruce King; Henry F. Schaefer, III; Paul v. R. Schleyer; Gregory H. Robinson","Carbene-Stabilized Diphosphorus","Journal of the American Chemical Society","2008","130","","14970","14971","10.1021/ja807828t","","","0.71073","MoKα","","0.0848","0.0492","","","0.1194","0.14","","","","","","1.009","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108654","28.49","0.002","17","0.0013","20.129","0.003","90","","127.102","0.001","90","","7775.5","1.4","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H48 N4 P2 -","- C42 H48 N4 P2 -","- C336 H384 N32 P16 -","8","1","","Yuzhong Wang; Yaoming Xie; Pingrong Wei; R. Bruce King; Henry F. Schaefer, III; Paul v. R. Schleyer; Gregory H. Robinson","Carbene-Stabilized Diphosphorus","Journal of the American Chemical Society","2008","130","","14970","14971","10.1021/ja807828t","","","0.71073","MoKα","","0.0871","0.0522","","","0.1403","0.1758","","","","","","1.051","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108655","48.488","0.007","48.488","","33.48","0.007","90","","90","","90","","78714","2","213","2","213","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C528 H468 Cu8 N64 O32 -","- C528 H468 Cu8 N64 O32 -","- C2112 H1872 Cu32 N256 O128 -","4","0.25","","Jin'an Zhao; Liwei Mi; Jiyong Hu; Hongwei Hou; Yaoting Fan","Cation Exchange Induced Tunable Properties of a Nanoporous Octanuclear Cu(II) Wheel with Double-Helical Structure","Journal of the American Chemical Society","2008","130","","15222","15223","10.1021/ja8007227","","","0.71073","MoKα","","0.1794","0.1009","","","0.2289","0.2711","","","","","","1.278","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108656","13.8439","0.0009","13.2905","0.0009","16.2607","0.0013","90","","99.711","0.004","90","","2949","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H31 N5 O2 S -","- C34 H31 N5 O2 S -","- C136 H124 N20 O8 S4 -","4","1","","Jin'an Zhao; Liwei Mi; Jiyong Hu; Hongwei Hou; Yaoting Fan","Cation Exchange Induced Tunable Properties of a Nanoporous Octanuclear Cu(II) Wheel with Double-Helical Structure","Journal of the American Chemical Society","2008","130","","15222","15223","10.1021/ja8007227","","","0.7107","MoKα","","0.0778","0.0568","","","0.1448","0.1578","","","","","","1.121","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108657","6.1043","0.0012","10.424","0.002","10.53","0.002","81.52","0.03","75.98","0.03","81.64","0.03","638.8","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H20 O -","- C14 H20 O -","- C28 H40 O2 -","2","1","","Jin'an Zhao; Liwei Mi; Jiyong Hu; Hongwei Hou; Yaoting Fan","Cation Exchange Induced Tunable Properties of a Nanoporous Octanuclear Cu(II) Wheel with Double-Helical Structure","Journal of the American Chemical Society","2008","130","","15222","15223","10.1021/ja8007227","","","0.71073","MoKα","","0.1087","0.0838","","","0.1881","0.2051","","","","","","1.128","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108658","10.6964","0.0009","13.432","0.001","18.7082","0.0015","78.173","0.009","86.379","0.01","82.788","0.009","2608.1","0.4","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H52 B F4 Fe N4 O3 -","- C56 H52 B F4 Fe N4 O3 -","- C112 H104 B2 F8 Fe2 N8 O6 -","2","1","","V. K. K. Praneeth; Florian Paulat; Timothy C. Berto; Serena DeBeer George; Christian Näther; Corinne D. Sulok; Nicolai Lehnert","Electronic Structure of Six-Coordinate Iron(III)-Porphyrin NO Adducts: The Elusive Iron(III)-NO(radical) State and Its Influence on the Properties of These Complexes","Journal of the American Chemical Society","2008","130","","15288","15303","10.1021/ja801860u","","","0.71073","MoKα","","0.0716","0.0475","","","0.121","0.131","","","","","","0.939","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108659","22.778","0.0008","22.778","","13.855","0.0003","90","","90","","90","","7188.5","0.3","153","2","153","2","","","","","","","synthesis as described","4","P 42/n :2","-P 4bc","86","","C60CH2SiMe2OiPrH","","- C66 H16 O Si -","- C66 H16 O Si -","- C528 H128 O8 Si8 -","8","1","","Yutaka Matsuo; Akihiko Iwashita; Yoko Abe; Chang-Zhi Li; Keiko Matsuo; Masahiko Hashiguchi; Eiichi Nakamura","Regioselective Synthesis of 1,4-Di(organo)[60]fullerenes through DMF-assisted Monoaddition of Silylmethyl Grignard Reagents and Subsequent Alkylation Reaction","Journal of the American Chemical Society","2008","130","","15429","15436","10.1021/ja8041299","","x-ray","0.71073","MoKα","","0.0858","0.0794","","","0.2253","0.2319","","","","","","1.043","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108660","10.256","0.0006","19.238","0.001","19.982","0.0014","90","","98.016","0.004","90","","3904","0.4","153","2","153","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","C60CH2SiMe32","","- C68 H22 Si2 -","- C68 H22 Si2 -","- C272 H88 Si8 -","4","1","","Yutaka Matsuo; Akihiko Iwashita; Yoko Abe; Chang-Zhi Li; Keiko Matsuo; Masahiko Hashiguchi; Eiichi Nakamura","Regioselective Synthesis of 1,4-Di(organo)[60]fullerenes through DMF-assisted Monoaddition of Silylmethyl Grignard Reagents and Subsequent Alkylation Reaction","Journal of the American Chemical Society","2008","130","","15429","15436","10.1021/ja8041299","","x-ray","0.71073","MoKα","","0.164","0.1366","","","0.3346","0.386","","","","","","1.533","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108661","10.3602","0.0002","19.0203","0.0004","22.665","0.0004","90","","97.137","0.001","90","","4431.63","0.15","123","2","123","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","C60CH2SiMe2Ph2","","- C78 H26 Si2 -","- C80.7 H26 Si2 -","- C322.8 H104 Si8 -","4","1","","Yutaka Matsuo; Akihiko Iwashita; Yoko Abe; Chang-Zhi Li; Keiko Matsuo; Masahiko Hashiguchi; Eiichi Nakamura","Regioselective Synthesis of 1,4-Di(organo)[60]fullerenes through DMF-assisted Monoaddition of Silylmethyl Grignard Reagents and Subsequent Alkylation Reaction","Journal of the American Chemical Society","2008","130","","15429","15436","10.1021/ja8041299","","x-ray","1.54173","CuKα","","0.168","0.0989","","","0.2388","0.3024","","","","","","0.986","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108662","37.646","0.006","9.8921","0.0016","22.981","0.004","90","","106.073","0.002","90","","8224","2","173","2","173","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C37 H54 Cl2 Cu F6 N2 O2 Sb -","- C37 H54 Cl2 Cu F6 N2 O2 Sb -","- C296 H432 Cl16 Cu8 F48 N16 O16 Sb8 -","8","2","","Tim Storr; Pratik Verma; Russell C. Pratt; Erik C. Wasinger; Yuichi Shimazaki; T. Daniel P. Stack","Defining the Electronic and Geometric Structure of One-Electron Oxidized Copper-Bis-phenoxide Complexes","Journal of the American Chemical Society","2008","130","","15448","15459","10.1021/ja804339m","","","0.71073","MoKα","","0.0603","0.0556","","","0.1394","0.1423","","","","","","1.05","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108663","12.268","0.003","27.661","0.006","14.155","0.003","90","","93.29","0.02","90","","4795.5","1.9","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C49 H38 B Cl2 Cu F4 Fe O2 P2 -","- C49 H38 B Cl2 Cu F4 Fe O2 P2 -","- C196 H152 B4 Cl8 Cu4 F16 Fe4 O8 P8 -","4","1","","Sayak Roy; Biprajit Sarkar; Denis Bubrin; Mark Niemeyer; Stanislav Záliš; Goutam Kumar Lahiri; Wolfgang Kaim","Stabilizing the Elusive ortho-Quinone/Copper(I) Oxidation State Combination through π/π Interaction in an Isolated Complex","Journal of the American Chemical Society","2008","130","","15230","15231","10.1021/ja804429v","","","0.71073","MoKα","","0.2309","0.082","","","0.1922","0.2481","","","","","","0.763","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108664","15.9928","0.0011","10.8838","0.0008","16.4567","0.0011","90","","100.38","0.001","90","","2817.6","0.3","115","2","115","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H43 F6 N P2 Pt -","- C24 H43 F6 N P2 Pt -","- C96 H172 F24 N4 P8 Pt4 -","4","1","","Ainara Nova; Stefan Erhardt; Naseralla A. Jasim; Robin N. Perutz; Stuart A. Macgregor; John E. McGrady; Adrian C. Whitwood","Competing C-F Activation Pathways in the Reaction of Pt(0) with Fluoropyridines: Phosphine-Assistance versus Oxidative Addition","Journal of the American Chemical Society","2008","130","","15499","15511","10.1021/ja8046238","","","0.71073","MoKα","","0.0374","0.0272","","","0.061","0.0644","","","","","","1.034","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108665","10.5548","0.0006","19.6695","0.001","17.3098","0.0009","90","","100.816","0.001","90","","3529.8","0.3","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H55 F6 N P2 Pt -","- C36 H55 F6 N P2 Pt -","- C144 H220 F24 N4 P8 Pt4 -","4","1","","Ainara Nova; Stefan Erhardt; Naseralla A. Jasim; Robin N. Perutz; Stuart A. Macgregor; John E. McGrady; Adrian C. Whitwood","Competing C-F Activation Pathways in the Reaction of Pt(0) with Fluoropyridines: Phosphine-Assistance versus Oxidative Addition","Journal of the American Chemical Society","2008","130","","15499","15511","10.1021/ja8046238","","","0.71073","MoKα","","0.0374","0.0285","","","0.0673","0.0711","","","","","","1.035","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108666","11.9912","0.0002","18.4427","0.0002","22.0438","0.0002","113.445","0.001","105.634","0.001","90.072","0.001","4274.46","0.1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H67 F6 N P2 Pt -","- C42 H67 F6 N P2 Pt -","- C168 H268 F24 N4 P8 Pt4 -","4","2","","Ainara Nova; Stefan Erhardt; Naseralla A. Jasim; Robin N. Perutz; Stuart A. Macgregor; John E. McGrady; Adrian C. Whitwood","Competing C-F Activation Pathways in the Reaction of Pt(0) with Fluoropyridines: Phosphine-Assistance versus Oxidative Addition","Journal of the American Chemical Society","2008","130","","15499","15511","10.1021/ja8046238","","","0.71073","MoKα","","0.0418","0.0352","","","0.0749","0.0778","","","","","","1.094","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108667","10.6459","0.0004","10.6459","0.0004","10.6459","0.0004","90","","90","","90","","1206.56","0.08","150","2","150","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C16.86 H32 Cr2.81 Fe4 K0.45 N16.86 O16 -","- C16.8 Cr2.8 Fe4 K0.48 N16.8 O15.84 -","- C16.8 Cr2.8 Fe4 K0.48 N16.8 O15.84 -","1","0.00520833","","Eugenio Coronado; Mari Carmen Giménez-López; Tomasz Korzeniak; Georgiy Levchenko; Francisco M. Romero; Alfredo Segura; Valentín García-Baonza; Julio C. Cezar; Frank M. F. de Groot; Alla Milner; Moshe Paz-Pasternak","Pressure-Induced Magnetic Switching and Linkage Isomerism in K0.4Fe4[Cr(CN)6]2.8.16H2O: X-ray Absorption and Magnetic Circular Dichroism Studies","Journal of the American Chemical Society","2008","130","","15519","15532","10.1021/ja8047046","","","0.71073","MoKα","","0.0628","0.0499","","","0.1154","0.1211","","","","","","1.326","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108668","10.672","0.0002","10.672","0.0002","10.672","0.0002","90","","90","","90","","1215.45","0.04","293","2","293","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C16.86 H32 Cr2.81 Fe4 K0.45 N16.86 O16 -","- C16.8 Cr2.8 Fe4 K0.48 N8.4 O24.48 -","- C16.8 Cr2.8 Fe4 K0.48 N8.4 O24.48 -","1","0.00520833","","Eugenio Coronado; Mari Carmen Giménez-López; Tomasz Korzeniak; Georgiy Levchenko; Francisco M. Romero; Alfredo Segura; Valentín García-Baonza; Julio C. Cezar; Frank M. F. de Groot; Alla Milner; Moshe Paz-Pasternak","Pressure-Induced Magnetic Switching and Linkage Isomerism in K0.4Fe4[Cr(CN)6]2.8.16H2O: X-ray Absorption and Magnetic Circular Dichroism Studies","Journal of the American Chemical Society","2008","130","","15519","15532","10.1021/ja8047046","","","0.71073","MoKα","","0.0391","0.0367","","","0.088","0.0965","","","","","","0.856","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108669","10.4665","0.0009","10.7259","0.001","13.7218","0.0012","83.402","0.005","76.404","0.005","86.855","0.005","1486.7","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H39 Cl3 Fe3 S3 -","- C23 H39 Cl3 Fe3 S3 -","- C46 H78 Cl6 Fe6 S6 -","2","1","","Yanhui Chen; Yuhan Zhou; Pingping Chen; Yinsong Tao; Yang Li; Jingping Qu","Nitrogenase Model Complexes [Cp*Fe(μ-SR1)2(μ-η2-R2N=NH)FeCp*] (R1= Me, Et; R2= Me, Ph; Cp* = η5-C5Me5): Synthesis, Structure, and Catalytic N-N Bond Cleavage of Hydrazines on Diiron Centers","Journal of the American Chemical Society","2008","130","","15250","15251","10.1021/ja805025w","","","0.71073","MoKα","","0.092","0.0594","","","0.1558","0.1747","","","","","","1.072","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108670","11.1612","0.0002","16.6493","0.0002","16.8125","0.0003","90","","106.806","0.001","90","","2990.77","0.09","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H46 Fe2 N2 S2 -","- C30 H46 Fe2 N2 S2 -","- C120 H184 Fe8 N8 S8 -","4","1","","Yanhui Chen; Yuhan Zhou; Pingping Chen; Yinsong Tao; Yang Li; Jingping Qu","Nitrogenase Model Complexes [Cp*Fe(μ-SR1)2(μ-η2-R2N=NH)FeCp*] (R1= Me, Et; R2= Me, Ph; Cp* = η5-C5Me5): Synthesis, Structure, and Catalytic N-N Bond Cleavage of Hydrazines on Diiron Centers","Journal of the American Chemical Society","2008","130","","15250","15251","10.1021/ja805025w","","","0.71073","MoKα","","0.0302","0.0262","","","0.0711","0.073","","","","","","1.055","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108671","9.9455","0.0005","15.1956","0.0008","18.9528","0.001","90","","104.19","0.003","90","","2776.9","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H42 Fe2 N2 S2 -","- C28 H42 Fe2 N2 S2 -","- C112 H168 Fe8 N8 S8 -","4","1","","Yanhui Chen; Yuhan Zhou; Pingping Chen; Yinsong Tao; Yang Li; Jingping Qu","Nitrogenase Model Complexes [Cp*Fe(μ-SR1)2(μ-η2-R2N=NH)FeCp*] (R1= Me, Et; R2= Me, Ph; Cp* = η5-C5Me5): Synthesis, Structure, and Catalytic N-N Bond Cleavage of Hydrazines on Diiron Centers","Journal of the American Chemical Society","2008","130","","15250","15251","10.1021/ja805025w","","","0.71073","MoKα","","0.0456","0.0357","","","0.0987","0.1045","","","","","","1.024","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108672","8.6825","0.0002","20.3381","0.0004","8.7589","0.0002","90","","119.489","0.001","90","","1346.32","0.05","273","2","273","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C25 H44 Fe2 N2 S2 -","- C25 H42 Fe2 N2 S2 -","- C50 H84 Fe4 N4 S4 -","2","0.5","","Yanhui Chen; Yuhan Zhou; Pingping Chen; Yinsong Tao; Yang Li; Jingping Qu","Nitrogenase Model Complexes [Cp*Fe(μ-SR1)2(μ-η2-R2N=NH)FeCp*] (R1= Me, Et; R2= Me, Ph; Cp* = η5-C5Me5): Synthesis, Structure, and Catalytic N-N Bond Cleavage of Hydrazines on Diiron Centers","Journal of the American Chemical Society","2008","130","","15250","15251","10.1021/ja805025w","","","0.71073","MoKα","","0.0777","0.0731","","","0.1756","0.178","","","","","","1.01","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108673","9.0325","0.0003","13.7934","0.0004","18.6445","0.0006","78.138","0.001","85.117","0.001","72.306","0.001","2165.11","0.12","298","","298","","","","","","","","","3","P -1","-P 1","2","","","","- C24 H28 N4 -","- C24 H28 N4 -","- C96 H112 N16 -","4","2","","Tamotsu Takahashi; Zhiyi Song; Yi-Fang Hsieh; Kiyohiko Nakajima; Ken-ichiro Kanno","Once Cleaved C-C Bond Was Reformed: Reversible C-C Bond Cleavage of Dihydroindenyltitanium Complexes","Journal of the American Chemical Society","2008","130","","15236","15237","10.1021/ja805352z","","","0.71075","MoKα","","0.1101","0.071","","","0.163","0.1823","","","","","","1.053","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108674","9.5395","0.0004","9.9792","0.0005","14.5343","0.0007","71.5127","0.0014","69.8988","0.0012","58.3482","0.0012","1089.76","0.09","298.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H27 Cl N4 -","- C24 H27 Cl N4 -","- C48 H54 Cl2 N8 -","2","1","","Tamotsu Takahashi; Zhiyi Song; Yi-Fang Hsieh; Kiyohiko Nakajima; Ken-ichiro Kanno","Once Cleaved C-C Bond Was Reformed: Reversible C-C Bond Cleavage of Dihydroindenyltitanium Complexes","Journal of the American Chemical Society","2008","130","","15236","15237","10.1021/ja805352z","","","0.71075","MoKα","","","0.0532","","","","0.0644","","","","","","1.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108675","11.5517","0.0001","11.5517","0.0001","17.5999","0.0004","90","","90","","90","","2348.56","0.06","273","2","273","2","","","","","","","","5","P 42/m m c","-P 4c 2","131","","","","- C4 Cu8 Ge5 N8 S16 -","- C4 Cu8 Ge5 N8 S16 -","- C8 Cu16 Ge10 N16 S32 -","2","0.125","","Zhenyu Zhang; Jian Zhang; Tao Wu; Xianhui Bu; Pingyun Feng","Three-Dimensional Open Framework Built from Cu-S Icosahedral Clusters and Its Photocatalytic Property","Journal of the American Chemical Society","2008","130","","15238","15239","10.1021/ja805449p","","","0.71073","MoKα","","0.0496","0.0428","","","0.1484","0.1532","","","","","","1.094","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108676","11.4478","0.0004","26.0793","0.0007","26.0691","0.001","90","","100.872","0.004","90","","7643.2","0.5","","","100","","","","","","","","","2","P 1 n 1","P -2yac","7","alpha-Cd4Sb3","","","- Cd13 Sb10 -","- Cd156 Sb120 -","- Cd156 Sb120 -","1","0.5","","Andreas Tengå; Sven Lidin; Jean-Philippe Belieres; N. Newman; Yang Wu; Ulrich Häussermann","Metastable Cd4Sb3: A Complex Structured Intermetallic Compound with Semiconductor Properties","Journal of the American Chemical Society","2008","130","","15564","15572","10.1021/ja805454p","","","0.71069","MoKα","","0.1734","0.0607","","","0.1367","0.1773","","","","1.82","1.82","1.21","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108677","11.4975","0.0005","26.1262","0.001","26.1218","0.001","90","","100.777","0.004","90","","7708.2","0.5","","","295","","","","","","","","","2","P 1 n 1","P -2yac","7","alpha-Cd4Sb3","","","- Cd13 Sb10 -","- Cd150.474 Sb120 -","- Cd150.474 Sb120 -","1","0.5","","Andreas Tengå; Sven Lidin; Jean-Philippe Belieres; N. Newman; Yang Wu; Ulrich Häussermann","Metastable Cd4Sb3: A Complex Structured Intermetallic Compound with Semiconductor Properties","Journal of the American Chemical Society","2008","130","","15564","15572","10.1021/ja805454p","","","0.71073","MoKα","","0.2112","0.0608","","","0.141","0.1856","","","","2","2","1.12","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108678","8.979","0.003","30.661","0.01","10.361","0.003","90","","103.129","0.005","90","","2777.9","1.5","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Et4N[Fe(S-p-tolyl)2(NO)2]","","","- C24 H38 Fe N3 O2.5 S2 -","- C24 H38 Fe N3 O2.5 S2 -","- C96 H152 Fe4 N12 O10 S8 -","4","1","","Todd C. Harrop; Zachary J. Tonzetich; Erwin Reisner; Stephen J. Lippard","Reactions of Synthetic [2Fe-2S] and [4Fe-4S] Clusters with Nitric Oxide and Nitrosothiols","Journal of the American Chemical Society","2008","130","","15602","15610","10.1021/ja8054996","","","0.71073","MoKα","","0.0404","0.0355","","","0.0795","0.0818","","","","","","1.137","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108679","12.6235","0.0003","12.6966","0.0004","12.712","0.0003","80.922","0.002","86.846","0.002","69.299","0.001","1882.01","0.09","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H42 O P2 Pt -","- C46 H42 O P2 Pt -","- C92 H84 O2 P4 Pt2 -","2","1","","Erik J. Alexanian; John F. Hartwig","Mechanistic Study of β-Hydrogen Elimination from Organoplatinum(II) Enolate Complexes","Journal of the American Chemical Society","2008","130","","15627","15635","10.1021/ja8056908","","","0.71073","MoKα","","0.0584","0.0461","","","0.1162","0.1227","","","","","","1.121","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108680","9.6285","0.0003","12.3192","0.0004","10.2589","0.0004","90","","108.67","0.0016","90","","1152.83","0.07","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis(permethylpentalene)dinickel(II)","","- C28 H36 Ni2 -","- C28 H36 Ni2 -","- C56 H72 Ni4 -","2","0.5","","Andrew E. Ashley; Robert T. Cooper; Gregory G. Wildgoose; Jennifer C. Green; Dermot O'Hare","Homoleptic Permethylpentalene Complexes: ""Double Metallocenes"" of the First-Row Transition Metals","Journal of the American Chemical Society","2008","130","","15662","15677","10.1021/ja8057138","","","0.71073","MoKα","","0.0554","0.0346","","0.0769","0.0665","0.0638","","","","","","0.9948","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108681","9.5132","0.0002","12.6438","0.0003","10.295","0.0003","90","","107.995","0.001","90","","1177.74","0.05","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis(permethylpentalene)divanadium(II)","","- C28 H36 V2 -","- C28 H36 V2 -","- C56 H72 V4 -","2","0.5","","Andrew E. Ashley; Robert T. Cooper; Gregory G. Wildgoose; Jennifer C. Green; Dermot O'Hare","Homoleptic Permethylpentalene Complexes: ""Double Metallocenes"" of the First-Row Transition Metals","Journal of the American Chemical Society","2008","130","","15662","15677","10.1021/ja8057138","","","0.71073","MoKα","","0.037","0.0299","","0.0708","0.0678","0.0666","","","","","","1.0191","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108682","9.633","0.0002","12.2559","0.0003","10.2796","0.0003","90","","108.013","0.0015","90","","1154.14","0.05","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis(permethylpentalene)dichromium(II)","","- C28 H36 Cr2 -","- C28 H36 Cr2 -","- C56 H72 Cr4 -","2","0.5","","Andrew E. Ashley; Robert T. Cooper; Gregory G. Wildgoose; Jennifer C. Green; Dermot O'Hare","Homoleptic Permethylpentalene Complexes: ""Double Metallocenes"" of the First-Row Transition Metals","Journal of the American Chemical Society","2008","130","","15662","15677","10.1021/ja8057138","","","0.71073","MoKα","","0.0514","0.0353","","0.0814","0.0757","0.0732","","","","","","1.0106","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108683","9.6431","0.0003","12.3057","0.0003","10.2368","0.0003","90","","108.242","0.0018","90","","1153.7","0.06","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis(permethylpentalene)dimanganese(II)","","- C28 H36 Mn2 -","- C28 H36 Mn2 -","- C56 H72 Mn4 -","2","0.5","","Andrew E. Ashley; Robert T. Cooper; Gregory G. Wildgoose; Jennifer C. Green; Dermot O'Hare","Homoleptic Permethylpentalene Complexes: ""Double Metallocenes"" of the First-Row Transition Metals","Journal of the American Chemical Society","2008","130","","15662","15677","10.1021/ja8057138","","","0.71073","MoKα","","0.0356","0.0293","","0.0694","0.0663","0.0648","","","","","","1.0089","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108684","9.5576","0.0001","12.4752","0.0002","10.144","0.0002","90","","110.348","0.001","90","","1134.02","0.03","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Bis(permethylpentalene)dicobalt(II)","","- C28 H36 Co2 -","- C28 H36 Co2 -","- C56 H72 Co4 -","2","0.5","","Andrew E. Ashley; Robert T. Cooper; Gregory G. Wildgoose; Jennifer C. Green; Dermot O'Hare","Homoleptic Permethylpentalene Complexes: ""Double Metallocenes"" of the First-Row Transition Metals","Journal of the American Chemical Society","2008","130","","15662","15677","10.1021/ja8057138","","","0.71073","MoKα","","0.0284","0.0245","","0.0614","0.0603","0.0614","","","","","","0.9695","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108685","8.761","0.005","27.114","0.017","17.578","0.011","90","","96.807","0.011","90","","4146","4","173","1","173","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 F6 O6 P4 S2 -","- C40 H36 F6 O6 P4 S2 -","- C160 H144 F24 O24 P16 S8 -","4","1","","Yuen-ying Carpenter; C. Adam Dyker; Neil Burford; Michael D. Lumsden; Andreas Decken","2,3-Diphosphino-1,4-diphosphonium Ions","Journal of the American Chemical Society","2008","130","","15732","15741","10.1021/ja805911a","","x-ray","0.71073","MoKα","","0.1051","0.046","","","0.0963","0.107","","","","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108686","12.431","0.002","13.52","0.003","13.883","0.003","90","","94.872","0.003","90","","2324.8","0.8","198","1","198","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H24 F6 O6 P4 S2 -","- C10 H24 F6 O6 P4 S2 -","- C40 H96 F24 O24 P16 S8 -","4","1","","Yuen-ying Carpenter; C. Adam Dyker; Neil Burford; Michael D. Lumsden; Andreas Decken","2,3-Diphosphino-1,4-diphosphonium Ions","Journal of the American Chemical Society","2008","130","","15732","15741","10.1021/ja805911a","","x-ray","0.71073","MoKα","","0.0548","0.0375","","","0.0951","0.1009","","","","","","0.97","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108687","15.5968","0.0016","14.5043","0.0016","19.895","0.002","90","","102.483","0.002","90","","4394.3","0.8","173","1","173","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H40 F6 O6 P4 S2 -","- C42 H40 F6 O6 P4 S2 -","- C168 H160 F24 O24 P16 S8 -","4","0.5","","Yuen-ying Carpenter; C. Adam Dyker; Neil Burford; Michael D. Lumsden; Andreas Decken","2,3-Diphosphino-1,4-diphosphonium Ions","Journal of the American Chemical Society","2008","130","","15732","15741","10.1021/ja805911a","","x-ray","0.71073","MoKα","","0.0618","0.0461","","","0.1108","0.1282","","","","","","1.069","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108688","8.3728","0.001","11.0797","0.0013","12.4662","0.0015","83.415","0.001","72.798","0.002","85.04","0.002","1095.8","0.2","198","1","198","1","","","","","","","","7","P -1","-P 1","2","","","","- C20 H18 Cl F3 O3 P2 S -","- C20 H18 Cl F3 O3 P2 S -","- C40 H36 Cl2 F6 O6 P4 S2 -","2","1","","Yuen-ying Carpenter; C. Adam Dyker; Neil Burford; Michael D. Lumsden; Andreas Decken","2,3-Diphosphino-1,4-diphosphonium Ions","Journal of the American Chemical Society","2008","130","","15732","15741","10.1021/ja805911a","","x-ray","0.71073","MoKα","","0.048","0.0347","","","0.0854","0.0972","","","","","","1.065","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108689","6.891","0.0004","16.614","0.0012","24.756","0.0017","90","","95.8","0.004","90","","2819.7","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H47 B N2 O3 -","- C26 H47 B N2 O3 -","- C104 H188 B4 N8 O12 -","4","1","","Takuji Hatakeyama; Masaharu Nakamura; Eiichi Nakamura","Diastereoselective Addition of Zincated Hydrazones to Alkenylboronates and Stereospecific Trapping of Boron/Zinc Bimetallic Intermediates by Carbon Electrophiles","Journal of the American Chemical Society","2008","130","","15688","15701","10.1021/ja806258v","","x-ray","0.71073","MoKα","","0.0939","0.0762","","","0.2186","0.2461","","","","","","1.052","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108690","7.969","0.0003","16.396","0.0013","20.776","0.0017","90","","90","","90","","2714.6","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H45 B N2 O3 -","- C24 H45 B N2 O3 -","- C96 H180 B4 N8 O12 -","4","1","","Takuji Hatakeyama; Masaharu Nakamura; Eiichi Nakamura","Diastereoselective Addition of Zincated Hydrazones to Alkenylboronates and Stereospecific Trapping of Boron/Zinc Bimetallic Intermediates by Carbon Electrophiles","Journal of the American Chemical Society","2008","130","","15688","15701","10.1021/ja806258v","","x-ray","0.71073","MoKα","","0.0693","0.058","","","0.1626","0.1785","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108691","9.744","0.001","12.409","0.0008","15.523","0.0015","91.937","0.005","105.989","0.004","107.197","0.005","1710","0.3","153","2","153","2","","","","","","","synthesis as described","3","P -1","-P 1","2","","","","- C40 H44 O4 -","- C40 H44 O4 -","- C80 H88 O8 -","2","1","","Takuji Hatakeyama; Masaharu Nakamura; Eiichi Nakamura","Diastereoselective Addition of Zincated Hydrazones to Alkenylboronates and Stereospecific Trapping of Boron/Zinc Bimetallic Intermediates by Carbon Electrophiles","Journal of the American Chemical Society","2008","130","","15688","15701","10.1021/ja806258v","","x-ray","0.71073","MoKα","","0.1042","0.0864","","","0.2585","0.283","","","","","","1.083","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108692","9.725","0.005","10.608","0.005","11.225","0.005","79.6","0.005","67.79","0.005","71.001","0.005","1011.5","0.8","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C18 H35 B O3 -","- C18 H35 B O3 -","- C36 H70 B2 O6 -","2","1","","Takuji Hatakeyama; Masaharu Nakamura; Eiichi Nakamura","Diastereoselective Addition of Zincated Hydrazones to Alkenylboronates and Stereospecific Trapping of Boron/Zinc Bimetallic Intermediates by Carbon Electrophiles","Journal of the American Chemical Society","2008","130","","15688","15701","10.1021/ja806258v","","x-ray","0.71069","MoKα","","0.2049","0.1816","","","0.441","0.5057","","","","","","1.816","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108693","18.7599","0.0013","13.4186","0.0009","13.8694","0.0008","90","","90","","90","","3491.4","0.4","193","2","193","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- C56 Cl10 -","- C56 Cl10 -","- C224 Cl40 -","4","0.25","","Yuan-Zhi Tan; Xiao Han; Xin Wu; Ye-Yong Meng; Feng Zhu; Zhuo-Zhen Qian; Zhao-Jiang Liao; Ming-Hui Chen; Xin Lu; Su-Yuan Xie; Rong-Bin Huang; Lan-Sun Zheng","An Entrant of Smaller Fullerene: C56 Captured by Chlorines and Aligned in Linear Chains","Journal of the American Chemical Society","2008","130","","15240","15241","10.1021/ja806352v","","","0.71073","MoKα","","0.0742","0.0408","","","0.0819","0.0872","","","","","","0.892","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108694","12.8437","0.0003","19.8696","0.0005","16.4609","0.0004","90","","109.82","0.001","90","","3951.96","0.17","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C44 H31 F3 O3 P2 Pd S Si -","- C44 H31 F3 O3 P2 Pd S Si -","- C176 H124 F12 O12 P8 Pd4 S4 Si4 -","4","1","","Jun Takaya; Nobuharu Iwasawa","Hydrocarboxylation of Allenes with CO2 Catalyzed by Silyl Pincer-Type Palladium Complex","Journal of the American Chemical Society","2008","130","","15254","15255","10.1021/ja806677w","","","0.71075","MoKα","","0.0452","0.0375","","","0.1496","0.1602","","","","","","1.388","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108695","25.121","0.004","10.4755","0.0015","18.364","0.003","90","","102.302","0.007","90","","4721.6","1.3","95","2","95","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H51 Cu N6 O4.5 S -","- C57 H51 Cu N6 O4.5 S -","- C228 H204 Cu4 N24 O18 S4 -","4","1","","Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski","Expansion by Contraction: Diversifying the Photochemical Reactivity Scope of Diazo-oxochlorins toward Development of in Situ Alkylating Agents","Journal of the American Chemical Society","2008","130","","15864","15871","10.1021/ja800094e","","","0.49595","synchrotron","","0.064","0.0512","","","0.1381","0.1569","","","","","","1.195","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108696","9.8552","0.0009","12.7732","0.0012","16.4636","0.0015","67.566","0.002","82.61","0.002","70.749","0.002","1808.5","0.3","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H36 Cu N4 O2 -","- C48 H36 Cu N4 O2 -","- C96 H72 Cu2 N8 O4 -","2","1","","Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski","Expansion by Contraction: Diversifying the Photochemical Reactivity Scope of Diazo-oxochlorins toward Development of in Situ Alkylating Agents","Journal of the American Chemical Society","2008","130","","15864","15871","10.1021/ja800094e","","","0.71073","MoKα","","0.0808","0.0496","","","0.1206","0.1349","","","","","","1.017","","","","has coordinates","178832","2020-10-21","18:00:00",""
"4108697","14.788","0.003","9.9818","0.0016","24.751","0.004","90","","92.106","0.006","90","","3651","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C49 H36 Cu N4 O3 -","- C49 H36 Cu N4 O3 -","- C196 H144 Cu4 N16 O12 -","4","1","","Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski","Expansion by Contraction: Diversifying the Photochemical Reactivity Scope of Diazo-oxochlorins toward Development of in Situ Alkylating Agents","Journal of the American Chemical Society","2008","130","","15864","15871","10.1021/ja800094e","","","0.48595","synchrotron","","0.1108","0.0759","","","0.1767","0.1906","","","","","","1.121","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108698","13.552","0.003","18.959","0.005","14.881","0.003","90","","109.326","0.005","90","","3608","1.4","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C47.43 H34.58 Cu N4 O1.86 -","- C47.432 H34.58 Cu N4 O1.858 -","- C189.728 H138.32 Cu4 N16 O7.432 -","4","1","","Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski","Expansion by Contraction: Diversifying the Photochemical Reactivity Scope of Diazo-oxochlorins toward Development of in Situ Alkylating Agents","Journal of the American Chemical Society","2008","130","","15864","15871","10.1021/ja800094e","","","0.71073","MoKα","","0.0951","0.0595","","","0.1475","0.166","","","","","","1.04","","","","has coordinates,has disorder","178832","2020-10-21","18:00:00",""
"4108699","9.865","0.003","12.648","0.003","16.413","0.004","69.02","0.006","83.633","0.006","70.674","0.005","1804.3","0.8","130","2","130","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H38 N4 O2 -","- C48 H38 N4 O2 -","- C96 H76 N8 O4 -","2","1","","Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski","Expansion by Contraction: Diversifying the Photochemical Reactivity Scope of Diazo-oxochlorins toward Development of in Situ Alkylating Agents","Journal of the American Chemical Society","2008","130","","15864","15871","10.1021/ja800094e","","","0.71073","MoKα","","0.0826","0.0549","","","0.1387","0.1574","","","","","","0.992","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4108700","21.0884","0.0005","17.8198","0.0005","39.0041","0.001","90","","92.381","0.001","90","","14644.7","0.7","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C95.9 H71.71 Cl0.19 N8 O3.95 -","- C95.9039 H71.7118 Cl0.1918 N8 O3.952 -","- C767.231 H573.694 Cl1.5344 N64 O31.616 -","8","1","","Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski","Expansion by Contraction: Diversifying the Photochemical Reactivity Scope of Diazo-oxochlorins toward Development of in Situ Alkylating Agents","Journal of the American Chemical Society","2008","130","","15864","15871","10.1021/ja800094e","","","0.71073","MoKα","","0.0975","0.0579","","","0.1477","0.1795","","","","","","1.016","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108701","13.3774","0.0003","24.1261","0.0005","34.2459","0.0007","90","","90","","90","","11052.7","0.4","153.2","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C58 H140 Al2 N8 O47 Si W10 -","- C58 Al2 N8 O47 Si W10 -","- C232 Al8 N32 O188 Si4 W40 -","4","1","","Yuji Kikukawa; Syuhei Yamaguchi; Yoshinao Nakagawa; Kazuhiro Uehara; Sayaka Uchida; Kazuya Yamaguchi; Noritaka Mizuno","Synthesis of a Dialuminum-Substituted Silicotungstate and the Diastereoselective Cyclization of Citronellal Derivatives","Journal of the American Chemical Society","2008","130","","15872","15878","10.1021/ja8014154","","","0.71069","MoKα","","","0.0691","","","","0.2086","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108702","24.7994","0.0002","14.5822","0.0001","26.8752","0.0003","90","","90","","90","","9718.87","0.15","153.2","","","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C65 H129 Al2 N7 O38 Si W10 -","- C65 Al2 N7 O38 Si W10 -","- C260 Al8 N28 O152 Si4 W40 -","4","1","","Yuji Kikukawa; Syuhei Yamaguchi; Yoshinao Nakagawa; Kazuhiro Uehara; Sayaka Uchida; Kazuya Yamaguchi; Noritaka Mizuno","Synthesis of a Dialuminum-Substituted Silicotungstate and the Diastereoselective Cyclization of Citronellal Derivatives","Journal of the American Chemical Society","2008","130","","15872","15878","10.1021/ja8014154","","","0.71069","MoKα","","","0.0695","","","","0.1963","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108703","27.83424","0.00011","27.83424","","6.242081","0.000026","90","","90","","120","","4188.12","0.02","","","100","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C3 N Ni O6.94 P -","- C3 N Ni O6.9336 P -","- C54 N18 Ni18 O124.805 P18 -","18","1","","Stuart R. Miller; Gordon M. Pearce; Paul A. Wright; Francesca Bonino; Sachin Chavan; Silvia Bordiga; Irene Margiolaki; Nathalie Guillou; Gérard Férey; Sandrine Bourrelly; Philip L. Llewellyn","Structural Transformations and Adsorption of Fuel-Related Gases of a Structurally Responsive Nickel Phosphonate Metal-Organic Framework, Ni-STA-12","Journal of the American Chemical Society","2008","130","","15967","15981","10.1021/ja804936z","powder diffraction","x-ray","0.8002","synchrotron","","","","","","","","0.07533","","2.45","","","","","","","has coordinates,has Fobs","178833","2020-10-21","18:00:00",""
"4108704","27.91436","0.00012","27.91436","","6.165502","0.000021","90","","90","","120","","4160.59","0.02","","","100","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C3 N Ni O4 P -","- C3 N Ni O4 P -","- C54 N18 Ni18 O72 P18 -","18","1","","Stuart R. Miller; Gordon M. Pearce; Paul A. Wright; Francesca Bonino; Sachin Chavan; Silvia Bordiga; Irene Margiolaki; Nathalie Guillou; Gérard Férey; Sandrine Bourrelly; Philip L. Llewellyn","Structural Transformations and Adsorption of Fuel-Related Gases of a Structurally Responsive Nickel Phosphonate Metal-Organic Framework, Ni-STA-12","Journal of the American Chemical Society","2008","130","","15967","15981","10.1021/ja804936z","powder diffraction","x-ray","0.8002","synchrotron","","","","","","","","0.064","","4.14","","","","","","","has coordinates,has Fobs","178833","2020-10-21","18:00:00",""
"4108705","6.03475","0.00005","14.91565","0.00022","16.15721","0.00021","112.572","0.0007","95.7025","0.0011","96.495","0.0011","1318.06","0.03","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C3 N Ni O3 P -","- C3 N Ni O3 P -","- C18 N6 Ni6 O18 P6 -","6","3","","Stuart R. Miller; Gordon M. Pearce; Paul A. Wright; Francesca Bonino; Sachin Chavan; Silvia Bordiga; Irene Margiolaki; Nathalie Guillou; Gérard Férey; Sandrine Bourrelly; Philip L. Llewellyn","Structural Transformations and Adsorption of Fuel-Related Gases of a Structurally Responsive Nickel Phosphonate Metal-Organic Framework, Ni-STA-12","Journal of the American Chemical Society","2008","130","","15967","15981","10.1021/ja804936z","powder diffraction","x-ray","0.8002","","","","","","","","","0.07196","","3.01","","","","","","","has coordinates,has Fobs","178833","2020-10-21","18:00:00",""
"4108706","10.3598","0.0002","22.2422","0.0003","10.8117","0.0002","90","","104.302","0.001","90","","2414.07","0.07","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C20 H31 Cl F6 N3 Pd Sb -","- C20 H31 Cl F6 N3 Pd Sb -","- C80 H124 Cl4 F24 N12 Pd4 Sb4 -","4","2","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0709","0.0503","","","0.0842","0.0864","","","","","","1.664","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108707","12.3773","0.0002","13.1425","0.0002","18.706","0.0003","90","","90","","90","","3042.88","0.08","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C29 H41 Cl F6 N3 Pd Sb -","- C29 H41 Cl F6 N3 Pd Sb -","- C116 H164 Cl4 F24 N12 Pd4 Sb4 -","4","1","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.045","0.0313","","","0.0489","0.0507","","","","","","1.165","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108708","9.75","0.0005","21.3471","0.001","13.1934","0.0006","90","","91.426","0.001","90","","2745.1","0.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H35 Cl F6 N3 Pd Sb -","- C25 H35 Cl F6 N3 Pd Sb -","- C100 H140 Cl4 F24 N12 Pd4 Sb4 -","4","2","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0505","0.044","","","0.0763","0.0772","","","","","","2.14","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4108709","14.8633","0.0003","13.4427","0.0003","15.0189","0.0003","90","","98.541","0.001","90","","2967.54","0.11","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H36 Cl5 F3 N2 O Pd -","- C25 H36 Cl5 F3 N2 O Pd -","- C100 H144 Cl20 F12 N8 O4 Pd4 -","4","2","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0826","0.0401","","","0.0608","0.0669","","","","","","0.987","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108710","9.2815","0.0003","11.4873","0.0004","15.1073","0.0005","90","","90","","90","","1610.73","0.09","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H26 Cl2 N2 Pd -","- C15 H26 Cl2 N2 Pd -","- C60 H104 Cl8 N8 Pd4 -","4","1","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0452","0.0317","","","0.0525","0.0542","","","","","","1.139","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108711","10.7694","0.0004","13.1518","0.0005","11.4564","0.0004","90","","105.682","0.001","90","","1562.25","0.1","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C32 H40 Cl2 F6 N2 O2 Pd -","- C32 H40 Cl2 F6 N2 O2 Pd -","- C64 H80 Cl4 F12 N4 O4 Pd2 -","2","1","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0489","0.0375","","","0.0708","0.0733","","","","","","1.067","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108712","9.7607","0.0003","12.7153","0.0004","15.4067","0.0005","90","","90","","90","","1912.13","0.1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 Cl4 N2 Pd -","- C16 H28 Cl4 N2 Pd -","- C64 H112 Cl16 N8 Pd4 -","4","1","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0766","0.0466","","","0.0737","0.0788","","","","","","1.108","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108713","8.8518","0.0003","14.7348","0.0004","15.4442","0.0004","90","","90","","90","","2014.38","0.1","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 Br2 Cl2 N2 Pd -","- C16 H28 Br2 Cl2 N2 Pd -","- C64 H112 Br8 Cl8 N8 Pd4 -","4","1","","Raissa M. Trend; Brian M. Stoltz","Structural Features and Reactivity of (Sparteine)PdCl2: A Model for Selectivity in the Oxidative Kinetic Resolution of Secondary Alcohols","Journal of the American Chemical Society","2008","130","","15957","15966","10.1021/ja804955e","","","0.71073","MoKα","","0.0565","0.0341","","","0.0526","0.0574","","","","","","1.046","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108714","7.6625","0.0003","15.8593","0.0006","15.9895","0.0005","101.764","0.003","92.604","0.003","96.27","0.003","1886.3","0.12","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H36 Cl F N6 O7 Ru -","- C39 H36 Cl F N6 O7 Ru -","- C78 H72 Cl2 F2 N12 O14 Ru2 -","2","1","","Jasna Maksimoska; Li Feng; Klaus Harms; Chunling Yi; Joseph Kissil; Ronen Marmorstein; Eric Meggers","Targeting Large Kinase Active Site with Rigid, Bulky Octahedral Ruthenium Complexes","Journal of the American Chemical Society","2008","130","","15764","15765","10.1021/ja805555a","","","0.71073","MoKα","","0.0616","0.0454","","","0.0958","0.1015","","","","","","1.066","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108715","11.81","0.005","21.803","0.009","13.251","0.006","90","","90.155","0.006","90","","3412","3","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","di(methyltripticil)difluorosilane","","","- C48 H36 F2 Si -","- C48 H36 F2 Si -","- C192 H144 F8 Si4 -","4","1","","Wataru Setaka; Takayoshi Nirengi; Chizuko Kabuto; Mitsuo Kira","Introduction of Clutch Function into a Molecular Gear System by Silane-Silicate Interconversion","Journal of the American Chemical Society","2008","130","","15762","15763","10.1021/ja805777p","","","0.71073","MoKα","","0.0791","0.0442","","","0.1051","0.1226","","","","","","1.024","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108716","12.461","0.003","18.925","0.005","22.839","0.006","90","","90","","90","","5386","2","90","2","90","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","Trifluorobistryptycilsilicate","","","- C56 H58 Cl4 F3 K O6 Si -","- C56 H56 Cl4 F3 K O6 Si -","- C224 H224 Cl16 F12 K4 O24 Si4 -","4","1","","Wataru Setaka; Takayoshi Nirengi; Chizuko Kabuto; Mitsuo Kira","Introduction of Clutch Function into a Molecular Gear System by Silane-Silicate Interconversion","Journal of the American Chemical Society","2008","130","","15762","15763","10.1021/ja805777p","","","0.71073","MoKα","","0.1044","0.0779","","","0.1993","0.2175","","","","","","1.065","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108717","19.153","0.012","6.945","0.004","19.384","0.013","90","","105.996","0.009","90","","2479","3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H36 B Br N2 -","- C26 H36 B Br N2 -","- C104 H144 B4 Br4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.1086","0.0912","","","0.2386","0.257","","","","","","1.099","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108718","7.4883","0.0002","9.4835","0.0001","18.5512","0.0004","77.6015","0.0008","86.8095","0.0012","80.4265","0.0012","1268.5","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H36 B I N2 -","- C26 H36 B I N2 -","- C52 H72 B2 I2 N4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.71069","MoKα","","0.0168","0.0165","","","0.0421","0.0423","","","","","","1.106","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108719","19.222","0.014","6.924","0.005","19.362","0.014","90","","105.271","0.003","90","","2486","3","103.15","","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H38 B Br N2 -","- C26 H38 B Br N2 -","- C104 H152 B4 Br4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0688","0.0647","","","0.1569","0.1599","","","","","","1.111","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108720","17.0118","0.0011","19.5103","0.0011","18.357","0.0011","90","","90","","90","","6092.8","0.6","103","2","103","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H46 B Li N2 O2 -","- C30 H46 B Li N2 O2 -","- C240 H368 B8 Li8 N16 O16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.71069","MoKα","","0.1036","0.0814","","","0.2329","0.2575","","","","","","1.071","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108721","11.5625","0.001","19.603","0.002","28.941","0.002","90","","90","","90","","6559.8","1","103.15","","103","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H52 B Li N2 O2 -","- C34 H52 B Li N2 O2 -","- C272 H416 B8 Li8 N16 O16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0892","0.0874","","","0.1634","0.1642","","","","","","1.223","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108722","12.58","0.003","16.395","0.004","16.766","0.004","90","","90","","90","","3458","1.4","103.15","","103","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C34 H54 B Li N2 O2 -","- C34 H54 B Li N2 O2 -","- C136 H216 B4 Li4 N8 O8 -","4","0.5","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.053","0.0481","","","0.114","0.1169","","","","","","1.139","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108723","11.19","0.011","17.754","0.017","18.41","0.018","90","","99.29","0.006","90","","3609","6","103.15","","103","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H54 B Li N2 O2 -","- C38 H54 B Li N2 O2 -","- C152 H216 B4 Li4 N8 O8 -","4","0.5","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.1072","0.0829","","","0.1853","0.1993","","","","","","1.155","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108724","18.891","0.005","15.567","0.004","16.711","0.005","90","","90","","90","","4914","2","120","2","120","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C26 H37 B N2 -","- C26 H37 B N2 -","- C208 H296 B8 N16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0717","0.0638","","","0.155","0.1633","","","","","","1.067","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108725","10.45","0.006","12.028","0.009","12.684","0.007","69.23","0.05","67","0.05","75.57","0.06","1360.8","1.6","103.15","","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H39 B N2 -","- C30 H39 B N2 -","- C60 H78 B2 N4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0834","0.0629","","","0.1622","0.1813","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108726","7.413","0.005","9.362","0.007","18.458","0.014","77.366","0.018","86.92","0.02","77.526","0.019","1220.4","1.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H39 B N2 -","- C27 H39 B N2 -","- C54 H78 B2 N4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.1329","0.0925","","","0.2483","0.2771","","","","","","1.107","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108727","12.099","0.004","13.535","0.004","18.125","0.006","90","","90","","90","","2968.1","1.6","103.15","","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H43 B N2 -","- C33 H43 B N2 -","- C132 H172 B4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0363","0.0351","","","0.0841","0.0849","","","","","","1.081","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108728","12.205","0.003","13.677","0.003","17.907","0.004","90","","90","","90","","2989.2","1.2","103.15","","103","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H43 B N2 O -","- C33 H43 B N2 O -","- C132 H172 B4 N8 O4 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0419","0.0402","","","0.1034","0.1051","","","","","","1.086","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108729","12.66","0.006","15.48","0.008","14.755","0.007","90","","90.479","0.002","90","","2892","2","103.15","","103","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H41 B N2 O -","- C33 H41 B N2 O -","- C132 H164 B4 N8 O4 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0782","0.0572","","","0.1295","0.1415","","","","","","1.122","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108730","9.294","0.004","11.154","0.004","14.663","0.006","81.83","0.011","82.698","0.011","85.549","0.011","1489.7","1","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H43 B N2 O -","- C33 H43 B N2 O -","- C66 H86 B2 N4 O2 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0825","0.0554","","","0.1337","0.1498","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108731","9.3","0.003","12.312","0.004","25.655","0.008","90","","94.2715","0.0014","90","","2929.4","1.6","103.15","","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H45 B N2 O2 -","- C31 H45 B N2 O2 -","- C124 H180 B4 N8 O8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0641","0.0559","","","0.1134","0.1174","","","","","","1.189","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108732","9.474","0.004","10.358","0.005","16.62","0.009","81.12","0.03","74.61","0.03","71.7","0.02","1488.4","1.3","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H41 B N2 O2 -","- C33 H41 B N2 O2 -","- C66 H82 B2 N4 O4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0949","0.0653","","","0.1472","0.1659","","","","","","1.154","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108733","18.522","0.004","15.505","0.004","16.871","0.004","90","","90","","90","","4845","2","103.15","","103","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C26 H37 B N2 O -","- C26 H37 B N2 O -","- C208 H296 B8 N16 O8 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0796","0.0725","","","0.1389","0.142","","","","","","1.287","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108734","13.378","0.01","12.642","0.009","16.528","0.011","90","","95.338","0.005","90","","2783","3","103.15","","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H41 B N2 -","- C32 H41 B N2 -","- C128 H164 B4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2008","130","","16069","16079","10.1021/ja8057919","","","0.7107","MoKα","","0.0633","0.0498","","","0.1071","0.1137","","","","","","1.108","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108735","13.7643","0.0005","12.5749","0.0004","12.7096","0.0004","90","","96.977","0.002","90","","2183.55","0.13","102","2","102","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 Cl3 Mn O5 Si -","- C5 Cl3 Mn O5 Si -","- C40 Cl24 Mn8 O40 Si8 -","8","2","","Jeremy M. Higgins; Andrew L. Schmitt; Ilia A. Guzei; Song Jin","Higher Manganese Silicide Nanowires of Nowotny Chimney Ladder Phase","Journal of the American Chemical Society","2008","130","","16086","16094","10.1021/ja8065122","","","1.54178","Cu-Kα","","0.0301","0.0264","","","0.0696","0.0725","","","","","","0.911","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108736","17.2428","0.0001","22.0385","0.0001","35.3168","0.0003","90","","90","","90","","13420.6","0.15","210","","210","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C56 H42 B F24 I O4 Ru2 -","- C56 H42 B F24 I O4 Ru2 -","- C448 H336 B8 F192 I8 O32 Ru16 -","8","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.114","0.0991","","0.3593","0.3445","0.3593","","","","","","0.923","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108737","11.068","0.002","24.636","0.005","15.587","0.003","90","","100.11","0.03","90","","4184.1","1.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H47 Fe Ga I2 O P2 -","- C44 H47 Fe Ga I2 O P2 -","- C176 H188 Fe4 Ga4 I8 O4 P8 -","4","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.0634","0.0437","","","0.0791","0.0849","","","","","","1.053","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108738","11.0237","0.0002","19.0641","0.0003","22.2038","0.0004","109.44","0.001","95.792","0.001","90.752","0.001","4372.37","0.13","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C44.75 H49 Fe Ga I2 P2 -","- C44.75 H49 Fe Ga I2 P2 -","- C179 H196 Fe4 Ga4 I8 P8 -","4","2","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.139","0.0663","","","0.1484","0.1776","","","","","","1.008","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108739","14.5305","0.0004","15.2373","0.0004","21.0196","0.0007","90","","106.221","0.0009","90","","4468.6","0.2","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H57.5 Fe Ga I O0.75 P2 -","- C48 H57.5 Fe Ga I O0.75 P2 -","- C192 H230 Fe4 Ga4 I4 O3 P8 -","4","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.1222","0.0834","","0.0857","0.0736","0.0736","","","","","","1.0986","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108740","12.7935","0.0006","12.8963","0.0008","13.4322","0.0008","90","","98.653","0.004","90","","2190.9","0.2","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 Fe Ga I O2 -","- C21 H26 Fe Ga I O2 -","- C84 H104 Fe4 Ga4 I4 O8 -","4","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.2303","0.0436","","0.1439","0.0456","0.0456","","","","","","0.9873","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108741","8.8295","0.0002","11.3312","0.0003","17.4071","0.0003","91.802","0.002","95.121","0.001","93.949","0.001","1729.25","0.07","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H48 Fe2 Ga N O4 Si2 -","- C30 H48 Fe2 Ga N O4 Si2 -","- C60 H96 Fe4 Ga2 N2 O8 Si4 -","2","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.0501","0.038","","","0.085","0.0907","","","","","","1.03","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108742","12.5823","0.0014","14.2036","0.0016","19.828","0.002","83.4582","0.0013","73.2027","0.0014","86.7306","0.0014","3369.2","0.6","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C68 H51 B F24 Fe Ga I P2 -","- C67.408 H50.778 B0.9815 F23.5575 Fe Ga I1.0185 P2 -","- C134.816 H101.556 B1.963 F47.115 Fe2 Ga2 I2.037 P4 -","2","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.671","synchrotron","","0.0931","0.0575","","","0.1388","0.1571","","","","","","1.041","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108743","18.6058","0.0002","16.364","0.0002","21.0354","0.0002","90","","93.6797","0.0006","90","","6391.35","0.12","150","","150","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C62 H47 B F25 Fe2 I O4 -","- C62 H47 B F25 Fe2 I O4 -","- C248 H188 B4 F100 Fe8 I4 O16 -","4","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.0853","0.0641","","0.0922","0.0718","0.0718","","","","","","1.1249","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108744","14.928","0.005","25.697","0.008","17.157","0.005","90","","92.724","0.004","90","","6574","4","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C68 H51 B Cl F24 Fe P2 -","- C68 H51 B Cl F24 Fe P2 -","- C272 H204 B4 Cl4 F96 Fe4 P8 -","4","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.6911","synchrotron","","0.0902","0.0593","","","0.1495","0.1703","","","","","","1.018","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108745","8.6253","0.0002","9.8332","0.0002","11.6061","0.0002","73.355","0.001","73.115","0.001","67.537","0.001","853.15","0.03","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H30 Ga2 I4 O4 Ru2 -","- C24 H30 Ga2 I4 O4 Ru2 -","- C24 H30 Ga2 I4 O4 Ru2 -","1","0.5","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.0341","0.0317","","","0.0803","0.0815","","","","","","1.162","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108746","10.8243","0.0002","11.0082","0.0002","15.2923","0.0003","73.8264","0.0008","69.7145","0.0007","85.1463","0.0009","1641.36","0.05","150","","150","","","","","","","","","8","P -1","-P 1","2","","","","- C31 H32 F Ga I2 O2 P Ru -","- C31 H32 F Ga I2 O2 P Ru -","- C62 H64 F2 Ga2 I4 O4 P2 Ru2 -","2","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.0463","0.0352","","0.0854","0.0814","0.0854","","","","","","0.991","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108747","11.1829","0.0002","17.9378","0.0004","16.8549","0.0003","90","","108.825","0.0013","90","","3200.19","0.11","210","","210","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H39 I P2 Ru -","- C36 H39 I P2 Ru -","- C144 H156 I4 P8 Ru4 -","4","1","","Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge","Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2","Journal of the American Chemical Society","2008","130","","16111","16124","10.1021/ja806655f","","","0.71073","MoKα","","0.099","0.0567","","0.1454","0.1262","0.1452","","","","","","0.9846","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108748","9.9134","0.0006","12.5819","0.0007","15.4598","0.0009","97.573","0.001","98.187","0.001","110.544","0.001","1752.55","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31.5 H59 B10 P Ru -","- C31.5 H55 B10 P Ru -","- C63 H110 B20 P2 Ru2 -","2","1","","Dongmei Liu; Li Dang; Yi Sun; Hoi-Shan Chan; Zhenyang Lin; Zuowei Xie","Hydrogen-Mediated Metal-Carbon to Metal-Boron Bond Conversion in Metal-Carboranyl Complexes","Journal of the American Chemical Society","2008","130","","16103","16110","10.1021/ja8067098","","","0.71073","MoKα","","0.0313","0.0291","","","0.0802","0.082","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108749","9.2911","0.0008","26.196","0.002","14.6014","0.0013","90","","93.202","0.002","90","","3548.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H43 B10 P Ru -","- C34 H43 B10 P Ru -","- C136 H172 B40 P4 Ru4 -","4","1","","Dongmei Liu; Li Dang; Yi Sun; Hoi-Shan Chan; Zhenyang Lin; Zuowei Xie","Hydrogen-Mediated Metal-Carbon to Metal-Boron Bond Conversion in Metal-Carboranyl Complexes","Journal of the American Chemical Society","2008","130","","16103","16110","10.1021/ja8067098","","","0.71073","MoKα","","0.0578","0.0392","","","0.0918","0.1008","","","","","","1.043","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108750","9.153","0.0018","17.736","0.004","11.175","0.002","90","","90.96","0.03","90","","1813.9","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H44 B10 P2 Ru -","- C36 H44 B10 P2 Ru -","- C72 H88 B20 P4 Ru2 -","2","1","","Dongmei Liu; Li Dang; Yi Sun; Hoi-Shan Chan; Zhenyang Lin; Zuowei Xie","Hydrogen-Mediated Metal-Carbon to Metal-Boron Bond Conversion in Metal-Carboranyl Complexes","Journal of the American Chemical Society","2008","130","","16103","16110","10.1021/ja8067098","","","0.71073","MoKα","","0.0373","0.031","","","0.0776","0.081","","","","","","1.024","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108751","10.75","0.002","20.386","0.004","18.477","0.004","90","","102.82","0.03","90","","3948.3","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H50 B10 O3 P2 Ru -","- C34 H50 B10 O3 P2 Ru -","- C136 H200 B40 O12 P8 Ru4 -","4","1","","Dongmei Liu; Li Dang; Yi Sun; Hoi-Shan Chan; Zhenyang Lin; Zuowei Xie","Hydrogen-Mediated Metal-Carbon to Metal-Boron Bond Conversion in Metal-Carboranyl Complexes","Journal of the American Chemical Society","2008","130","","16103","16110","10.1021/ja8067098","","","0.71073","MoKα","","0.0508","0.0468","","","0.1261","0.1291","","","","","","1.097","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108752","10.4337","0.0012","10.75","0.0012","15.0934","0.0017","97.231","0.002","90.234","0.002","92.507","0.002","1677.8","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H40 B10 N P Ru -","- C33 H40 B10 N P Ru -","- C66 H80 B20 N2 P2 Ru2 -","2","1","","Dongmei Liu; Li Dang; Yi Sun; Hoi-Shan Chan; Zhenyang Lin; Zuowei Xie","Hydrogen-Mediated Metal-Carbon to Metal-Boron Bond Conversion in Metal-Carboranyl Complexes","Journal of the American Chemical Society","2008","130","","16103","16110","10.1021/ja8067098","","","0.71073","MoKα","","0.0365","0.0296","","","0.0743","0.0791","","","","","","1.05","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108753","11.304","0.0015","12.7372","0.0016","14.1634","0.0018","77.41","0.003","68.633","0.002","78.164","0.003","1835.6","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C64 H92 B20 K2 O4 P2 Ru2 -","- C64 H92 B20 K2 O4 P2 Ru2 -","- C64 H92 B20 K2 O4 P2 Ru2 -","1","0.5","","Dongmei Liu; Li Dang; Yi Sun; Hoi-Shan Chan; Zhenyang Lin; Zuowei Xie","Hydrogen-Mediated Metal-Carbon to Metal-Boron Bond Conversion in Metal-Carboranyl Complexes","Journal of the American Chemical Society","2008","130","","16103","16110","10.1021/ja8067098","","","0.71073","MoKα","","0.0646","0.0414","","","0.0917","0.1058","","","","","","1.01","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108754","9.6888","0.0005","11.7838","0.0007","21.5338","0.0012","90","","90","","90","","2458.5","0.2","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 Cl2 N4 O2 -","- C24 H29.67 Cl2 N4 O2 -","- C96 H118.68 Cl8 N16 O8 -","4","1","","Xu Cheng; Sreekumar Vellalath; Richard Goddard; Benjamin List","Direct Catalytic Asymmetric Synthesis of Cyclic Aminals from Aldehydes","Journal of the American Chemical Society","2008","130","","15786","15787","10.1021/ja8071034","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108755","13.207","0.002","13.372","0.002","16.028","0.003","83.814","0.003","76.198","0.003","60.728","0.003","2397.7","0.7","110","2","110","2","","","","","","","","6","P -1","-P 1","2","ZPP1","","","- C48 H48 Cl2 N8 O8.5 S2 -","- C47.998 H47.994 Cl2 N8 O8.499 S1.999 -","- C95.996 H95.988 Cl4 N16 O16.998 S3.998 -","2","1","","Xiao-an Zhang; Dugan Hayes; Sarah J. Smith; Simone Friedle; Stephen J. Lippard","New Strategy for Quantifying Biological Zinc by a Modified Zinpyr Fluorescence Sensor","Journal of the American Chemical Society","2008","130","","15788","15789","10.1021/ja807156b","","","0.71073","MoKα","","0.0949","0.0674","","","0.1564","0.1704","","","","","","1.052","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108756","11.9729","0.0016","12.259","0.002","12.508","0.002","115.616","0.008","94.121","0.009","103.653","0.008","1576.6","0.4","143","1","143","1","","","","","","","","5","P -1","-P 1","2","","","","- C32 H34 N2 O5 S -","- C32 H34 N2 O5 S -","- C64 H68 N4 O10 S2 -","2","1","","Joshua S. Dickstein; Michael W. Fennie; Amber L. Norman; Betty J. Paulose; Marisa C. Kozlowski","Three Component Coupling of α-Iminoesters via Umpolung Addition of Organometals: Synthesis of α,α-Disubstituted α-Amino Acids","Journal of the American Chemical Society","2008","130","","15794","15795","10.1021/ja8073006","","","0.71073","MoKα","","0.0835","0.0632","","","0.1617","0.1743","","","","","","1.08","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108757","35.095","0.0014","17.143","0.0013","17.421","0.0013","90","","99.812","0.004","90","","10327.7","1.2","143","2","143","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","CpFeC60Me10FeCp_CHCl3","","- C81 H41 Cl3 Fe2 -","- C81 H41 Cl3 Fe2 -","- C648 H328 Cl24 Fe16 -","8","1","","Renata Marczak; Mateusz Wielopolski; S. Shankara Gayathri; Dirk M. Guldi; Yutaka Matsuo; Keiko Matsuo; Kazukuni Tahara; Eiichi Nakamura","Uniquely Shaped Double-Decker Buckyferrocenes-Distinct Electron Donor-Acceptor Interactions","Journal of the American Chemical Society","2008","130","","16207","16215","10.1021/ja8013902","","x-ray","0.71073","MoKα","","0.0844","0.0634","","","0.1647","0.1831","","","","","","1.036","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108758","11.276","0.006","21.827","0.013","19.094","0.011","90","","90.723","0.015","90","","4699","5","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","La@C82BzCl3","La@C82BzCl3","","- C90 H4 Cl3 La S2 -","- C90 H4 Cl3 La S2 -","- C360 H16 Cl12 La4 S8 -","4","1","","Yuta Takano; Akinori Yomogida; Hidefumi Nikawa; Michio Yamada; Takatsugu Wakahara; Takahiro Tsuchiya; Midori O. Ishitsuka; Yutaka Maeda; Takeshi Akasaka; Tatsuhisa Kato; Zdenek Slanina; Naomi Mizorogi; Shigeru Nagase","Radical Coupling Reaction of Paramagnetic Endohedral Metallofullerene La@C82","Journal of the American Chemical Society","2008","130","","16224","16230","10.1021/ja802748q","","x-ray","0.6888","synchrotron","","0.1712","0.1235","","","0.332","0.3617","","","","","","1.3","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108759","10.0974","0.0002","10.4407","0.0003","11.4272","0.0003","104.745","0.002","112.477","0.001","100.54","0.001","1022.22","0.05","200","2","200","2","","","","","","","","6","P 1","P 1","1","","","","- C37 H69 Al Li N O4 -","- C37 H69 Al Li N O4 -","- C37 H69 Al Li N O4 -","1","1","","Hiroshi Naka; James V. Morey; Joanna Haywood; Dana J. Eisler; Mary McPartlin; Felipe García; Hironaga Kudo; Yoshinori Kondo; Masanobu Uchiyama; Andrew E. H. Wheatley","Mixed Alkylamido Aluminate as a Kinetically Controlled Base","Journal of the American Chemical Society","2008","130","","16193","16200","10.1021/ja804749y","","","0.71073","MoKα","","0.1028","0.0847","","","0.2264","0.2492","","","","","","1.06","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108760","10.514","0.0001","19.7762","0.0003","22.3649","0.0004","71.163","0.005","88.705","0.005","80.96","0.01","4344.6","0.2","220","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H71 Al Li N O4 -","- C41 H71 Al Li N O4 -","- C164 H284 Al4 Li4 N4 O16 -","4","2","","Hiroshi Naka; James V. Morey; Joanna Haywood; Dana J. Eisler; Mary McPartlin; Felipe García; Hironaga Kudo; Yoshinori Kondo; Masanobu Uchiyama; Andrew E. H. Wheatley","Mixed Alkylamido Aluminate as a Kinetically Controlled Base","Journal of the American Chemical Society","2008","130","","16193","16200","10.1021/ja804749y","","","0.71073","MoKα","","0.1066","0.0928","","","0.2406","0.2569","","","","","","1.028","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108761","14.3169","0.0017","29.023","0.003","18.438","0.002","90","","90","","90","","7661.3","1.5","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C76 H108 Mo2 N6 O9 -","- C72 H96 Mo2 N6 O8 -","- C288 H384 Mo8 N24 O32 -","4","1","","Soumya Sarkar; Khalil A. Abboud; Adam S. Veige","Addition of Mild Electrophiles to a Mo\τbN Triple Bond and Nitrile Synthesis via Metal-Mediated N-Atom Transfer to Acid Chlorides","Journal of the American Chemical Society","2008","130","","16128","16129","10.1021/ja805629x","","","0.71073","MoKα","","0.1412","0.071","","","0.1666","0.1949","","","","","","0.866","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108762","8.0173","0.0005","19.397","0.0013","16.3635","0.0011","90","","95.6603","0.0009","90","","2532.3","0.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H37 Ir N P S -","- C27 H37 Ir N P S -","- C108 H148 Ir4 N4 P4 S4 -","4","1","","Kevin D. Hesp; Robert McDonald; Michael J. Ferguson; Mark Stradiotto","New Cationic and Zwitterionic Cp*M(κ2-P,S) Complexes (M = Rh, Ir): Divergent Reactivity Pathways Arising from Alternative Modes of Ancillary Ligand Participation in Substrate Activation","Journal of the American Chemical Society","2008","130","","16394","16406","10.1021/ja8062277","","","0.71073","MoKα","","0.0227","0.0203","","","0.0501","0.0512","","","","","","1.097","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108763","8.4287","0.0009","18.747","0.002","15.3597","0.0017","90","","91.1555","0.0015","90","","2426.5","0.5","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H35 Cl Ir P S -","- C25 H35 Cl Ir P S -","- C100 H140 Cl4 Ir4 P4 S4 -","4","1","","Kevin D. Hesp; Robert McDonald; Michael J. Ferguson; Mark Stradiotto","New Cationic and Zwitterionic Cp*M(κ2-P,S) Complexes (M = Rh, Ir): Divergent Reactivity Pathways Arising from Alternative Modes of Ancillary Ligand Participation in Substrate Activation","Journal of the American Chemical Society","2008","130","","16394","16406","10.1021/ja8062277","","","0.71073","MoKα","","0.0258","0.0245","","","0.0612","0.0617","","","","","","1.169","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108764","16.276","0.0012","9.3991","0.0007","22.3078","0.0016","90","","90","","90","","3412.6","0.4","193","2","193","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C37 H46 Ir P S Si -","- C37 H46 Ir P S Si -","- C148 H184 Ir4 P4 S4 Si4 -","4","1","","Kevin D. Hesp; Robert McDonald; Michael J. Ferguson; Mark Stradiotto","New Cationic and Zwitterionic Cp*M(κ2-P,S) Complexes (M = Rh, Ir): Divergent Reactivity Pathways Arising from Alternative Modes of Ancillary Ligand Participation in Substrate Activation","Journal of the American Chemical Society","2008","130","","16394","16406","10.1021/ja8062277","","","0.71073","MoKα","","0.0315","0.0274","","","0.0639","0.0657","","","","","","1.028","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108765","9.1759","0.0008","10.9655","0.0008","15.4658","0.0009","80.643","0.002","75.359","0.002","80.987","0.002","1474.66","0.19","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H35 F3 Ir O4 P S2 -","- C27 H35 F3 Ir O4 P S2 -","- C54 H70 F6 Ir2 O8 P2 S4 -","2","1","","Kevin D. Hesp; Robert McDonald; Michael J. Ferguson; Mark Stradiotto","New Cationic and Zwitterionic Cp*M(κ2-P,S) Complexes (M = Rh, Ir): Divergent Reactivity Pathways Arising from Alternative Modes of Ancillary Ligand Participation in Substrate Activation","Journal of the American Chemical Society","2008","130","","16394","16406","10.1021/ja8062277","","","0.71073","MoKα","","0.0408","0.0378","","","0.0932","0.0945","","","","","","1.027","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108766","11.2171","0.0009","12.4867","0.001","18.0424","0.0014","90","","103.933","0.001","90","","2452.7","0.3","193","2","193","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C51 H41 B F20 Ir P S -","- C51 H41 B F20 Ir P S -","- C102 H82 B2 F40 Ir2 P2 S2 -","2","1","","Kevin D. Hesp; Robert McDonald; Michael J. Ferguson; Mark Stradiotto","New Cationic and Zwitterionic Cp*M(κ2-P,S) Complexes (M = Rh, Ir): Divergent Reactivity Pathways Arising from Alternative Modes of Ancillary Ligand Participation in Substrate Activation","Journal of the American Chemical Society","2008","130","","16394","16406","10.1021/ja8062277","","","0.71073","MoKα","","0.0272","0.0244","","","0.0538","0.0548","","","","","","0.921","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108767","13.7735","0.0003","21.8039","0.0004","16.3499","0.0003","90","","98.217","0.001","90","","4859.73","0.17","193","2","193","2","","","","","","","chemical synthesis","4","C 1 2/c 1","-C 2yc","15","","9,10,19,21-Tetraphenyldiphenanthro[9,10-b:9,10-h]carbazole Bis(1,2-dichloroethane) Solvate","","- C64 H45 Cl4 N -","- C64 H45 Cl4 N -","- C256 H180 Cl16 N4 -","4","0.5","","Robert S. Walters; Christina M. Kraml; Neal Byrne; Douglas M. Ho; Qian Qin; Frederick J. Coughlin; Stefan Bernhard; Robert A. Pascal","Configurationally Stable Longitudinally Twisted Polycyclic Aromatic Compounds","Journal of the American Chemical Society","2008","130","","16435","16441","10.1021/ja806958x","","","0.71073","MoKα","","0.0697","0.0482","","0.1268","","0.1107","","","1.017","","","1.039","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108768","12.8717","0.0007","14.1496","0.001","14.7329","0.001","62.804","0.002","80.102","0.004","84.972","0.003","2351","0.3","200","2","200","2","","","","","","","chemical synthesis","5","P -1","-P 1","2","","9,10,11,12,13,14-Hexaphenyl-15-oxo-9,14-dihydro-9,14- methanobenzo[h]naphtho[2,3-f]quinoline Bis(dichloromethane) Solvate","","- C60 H41 Cl4 N O -","- C60 H41 Cl4 N O -","- C120 H82 Cl8 N2 O2 -","2","1","","Robert S. Walters; Christina M. Kraml; Neal Byrne; Douglas M. Ho; Qian Qin; Frederick J. Coughlin; Stefan Bernhard; Robert A. Pascal","Configurationally Stable Longitudinally Twisted Polycyclic Aromatic Compounds","Journal of the American Chemical Society","2008","130","","16435","16441","10.1021/ja806958x","","","0.71073","MoKα","","0.1116","0.0758","","0.1691","","0.1501","","","1.134","","","1.189","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108769","13.1255","0.0007","12.2959","0.0004","27.6935","0.0015","90","","115.011","0.001","90","","4050.3","0.3","200","2","200","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","","9,10,11,12,13,14-Hexaphenylbenzo[h]naphtho[2,3-f]quinoline carbon disulfide solvate","","- C57.33 H37 N S0.67 -","- C57.335 H37 N S0.67 -","- C229.34 H148 N4 S2.68 -","4","1","","Robert S. Walters; Christina M. Kraml; Neal Byrne; Douglas M. Ho; Qian Qin; Frederick J. Coughlin; Stefan Bernhard; Robert A. Pascal","Configurationally Stable Longitudinally Twisted Polycyclic Aromatic Compounds","Journal of the American Chemical Society","2008","130","","16435","16441","10.1021/ja806958x","","","0.71073","MoKα","","0.1245","0.072","","0.1015","","0.0864","","","1.152","","","1.24","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108770","8.7058","0.001","13.9305","0.0016","9.1612","0.001","90","","94.954","0.003","90","","1106.9","0.2","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H27 N O6 S -","- C23 H27 N O6 S -","- C46 H54 N2 O12 S2 -","2","1","","Elizabeth C. Linton; Marisa C. Kozlowski","Catalytic Enantioselective Meerwein-Eschenmoser Claisen Rearrangement: Asymmetric Synthesis of Allyl Oxindoles","Journal of the American Chemical Society","2008","130","","16162","16163","10.1021/ja807026z","","","0.71073","MoKα","","0.0495","0.0442","","","0.1074","0.113","","","","","","1.05","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108771","15.366","0.0007","17.5521","0.0008","19.3972","0.0009","90","","90","","90","","5231.5","0.4","170","2","170","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H42 Mo P4 S -","- C20 H42 Mo P4 S -","- C160 H336 Mo8 P32 S8 -","8","1","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.0293","0.0226","","","0.054","0.0578","","","","","","1.049","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108772","18.868","0.004","16.258","0.003","17.723","0.004","90","","102.89","0.003","90","","5299.6","1.9","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H42 Mo P4 S -","- C20 H42 Mo P4 S -","- C160 H336 Mo8 P32 S8 -","8","2","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.149","0.0546","","","0.0797","0.1012","","","","","","1.01","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108773","9.5865","0.0009","9.9755","0.0009","14.1841","0.0013","77.351","0.001","84.974","0.001","72.905","0.001","1264.6","0.2","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H42 Mo P4 S -","- C20 H42 Mo P4 S -","- C40 H84 Mo2 P8 S2 -","2","1","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.0272","0.0242","","","0.062","0.0639","","","","","","1.034","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108774","15.3325","0.0009","17.6221","0.001","19.508","0.0011","90","","90","","90","","5270.9","0.5","125","2","125","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H42 Mo P4 Se -","- C20 H42 Mo P4 Se -","- C160 H336 Mo8 P32 Se8 -","8","1","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.0774","0.0436","","","0.1017","0.1203","","","","","","1.048","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108775","9.8588","0.0004","16.0839","0.0006","21.5188","0.0008","90","","99.622","0.001","90","","3364.2","0.2","125","2","125","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H48 Mo2 P4 Se2 -","- C28 H48 Mo2 P4 Se2 -","- C112 H192 Mo8 P16 Se8 -","4","1","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.0571","0.0323","","","0.0618","0.0691","","","","","","1.001","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108776","10.4797","0.0004","10.8499","0.0004","12.0185","0.0004","66.694","0.001","78.146","0.001","69.722","0.001","1173.55","0.07","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H30 Mo P2 Se2 -","- C22 H30 Mo P2 Se2 -","- C44 H60 Mo2 P4 Se4 -","2","1","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.0314","0.0227","","","0.0529","0.0559","","","","","","1.01","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108777","17.9949","0.0008","18.7079","0.0008","20.3149","0.0009","90","","112.478","0.001","90","","6319.4","0.5","125","2","125","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C45 H106 Mo3 P10 Se2 -","- C45 H106 Mo3 P10 Se2 -","- C180 H424 Mo12 P40 Se8 -","4","1","","Daniela Buccella; Kevin E. Janak; Gerard Parkin","Reactivity of Mo(PMe3)6 towards Benzothiophene and Selenophenes: New Pathways Relevant to Hydrodesulfurization","Journal of the American Chemical Society","2008","130","","16187","16189","10.1021/ja8070545","","","0.71073","MoKα","","0.0454","0.0325","","","0.0582","0.0613","","","","","","1.058","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108778","14.333","0.002","16.55","0.003","27.977","0.005","93.212","0.003","103.856","0.003","110.975","0.003","5942.4","1.7","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C127 H147 Cl9 N8 O4 -","- C127 H147 Cl9 N8 O4 -","- C254 H294 Cl18 N16 O8 -","2","1","","Satoru Hiroto; Ichiro Hisaki; Hiroshi Shinokubo; Atsuhiro Osuka","Synthesis of Directly and Doubly Linked Dioxoisobacteriochlorin Dimers","Journal of the American Chemical Society","2008","130","","16172","16173","10.1021/ja807659h","","","0.71073","MoKα","","0.1343","0.0937","","","0.2646","0.3056","","","","","","1.047","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108779","13.188","0.005","14.388","0.005","16.656","0.007","66.993","0.012","86.554","0.014","78.472","0.012","2849.8","1.9","123.1","","123.1","","","","","","","","","6","P -1","-P 1","2","","","","- C126.66 H143.32 Cl4.02 N8.66 Ni2 O4 -","- C126.662 H143.322 Cl4.026 N8.66 Ni2 O4 -","- C126.662 H143.322 Cl4.026 N8.66 Ni2 O4 -","1","0.5","","Satoru Hiroto; Ichiro Hisaki; Hiroshi Shinokubo; Atsuhiro Osuka","Synthesis of Directly and Doubly Linked Dioxoisobacteriochlorin Dimers","Journal of the American Chemical Society","2008","130","","16172","16173","10.1021/ja807659h","","","0.71075","MoKα","","0.1517","0.086","","","0.219","0.2661","","","","","","1.029","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108780","8.561","0.0019","11.733","0.004","20.575","0.006","90","","90","","90","","2066.7","1","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H24 Cl N O3 -","- C23 H24 Cl N O3 -","- C92 H96 Cl4 N4 O12 -","4","1","","Ryo Shintani; Soyoung Park; Fumitaka Shirozu; Masataka Murakami; Tamio Hayashi","Palladium-Catalyzed Asymmetric Decarboxylative Lactamization of γ-Methylidene-δ-valerolactones with Isocyanates: Conversion of Racemic Lactones to Enantioenriched Lactams","Journal of the American Chemical Society","2008","130","","16174","16175","10.1021/ja807662b","","","0.71075","MoKα","","","0.0435","","","","0.0519","","","","","","0.837","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108781","8.0654","0.0016","20.143","0.003","24.741","0.004","90","","90","","90","","4019.5","1.2","123.1","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C45 H49 Cl N O5 P Pd -","- C45 H49 Cl N O5 P Pd -","- C180 H196 Cl4 N4 O20 P4 Pd4 -","4","1","","Ryo Shintani; Soyoung Park; Fumitaka Shirozu; Masataka Murakami; Tamio Hayashi","Palladium-Catalyzed Asymmetric Decarboxylative Lactamization of γ-Methylidene-δ-valerolactones with Isocyanates: Conversion of Racemic Lactones to Enantioenriched Lactams","Journal of the American Chemical Society","2008","130","","16174","16175","10.1021/ja807662b","","","0.71075","MoKα","","","0.0741","","","","0.1625","","","","","","1.171","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108782","19.903","0.003","14.063","0.002","19.279","0.003","90","","100.987","0.002","90","","5297.2","1.4","157","2","157","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C20 H24 F6 N2 O6 Pt S2 -","- C20 H24 F6 N2 O6 Pt S2 -","- C160 H192 F48 N16 O48 Pt8 S16 -","8","1","","Jennifer L. McBee; Alexis T. Bell; T. Don Tilley","Mechanistic Studies of the Hydroamination of Norbornene with Electrophilic Platinum Complexes: The Role of Proton Transfer","Journal of the American Chemical Society","2008","130","","16562","16571","10.1021/ja8030104","","","0.71073","MoKα","","0.0667","0.0373","","","0.0689","0.0719","","","","","","0.788","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108783","12.5853","0.0008","15.744","0.001","24.1309","0.0017","90","","90","","90","","4781.4","0.5","153","2","15.3","0.2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C50 H42 F6 O7 P2 Pt S2 -","- C50 H42 F6 O7 P2 Pt S2 -","- C200 H168 F24 O28 P8 Pt4 S8 -","4","1","","Jennifer L. McBee; Alexis T. Bell; T. Don Tilley","Mechanistic Studies of the Hydroamination of Norbornene with Electrophilic Platinum Complexes: The Role of Proton Transfer","Journal of the American Chemical Society","2008","130","","16562","16571","10.1021/ja8030104","","","0.71073","MoKα","","0.0362","0.0305","","","0.062","0.0632","","","","","","1.018","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108784","11.779","0.003","16.296","0.004","20.316","0.008","100.69","0.03","106.84","0.03","96.14","0.02","3614","2","141","2","141","2","","","","","","","","8","P -1","-P 1","2","","","","- C59 H78 Cl2 F6 N6 O10 Pt2 S4 -","- C59 H78 Cl2 F6 N6 O10 Pt2 S4 -","- C118 H156 Cl4 F12 N12 O20 Pt4 S8 -","2","1","","Jennifer L. McBee; Alexis T. Bell; T. Don Tilley","Mechanistic Studies of the Hydroamination of Norbornene with Electrophilic Platinum Complexes: The Role of Proton Transfer","Journal of the American Chemical Society","2008","130","","16562","16571","10.1021/ja8030104","","","0.71073","MoKα","","0.0475","0.0385","","","0.1086","0.1135","","","","","","1.035","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108785","15.801","0.009","15.752","0.009","18.259","0.01","90","","90","","90","","4545","4","173","1","173","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C37 H57 Cu2 F6 N4 O4 Sb -","- C37 H57 Cu2 F6 N4 O4 Sb -","- C148 H228 Cu8 F24 N16 O16 Sb4 -","4","1","","Yasuhiro Funahashi; Tomohide Nishikawa; Yuko Wasada-Tsutsui; Yuji Kajita; Syuhei Yamaguchi; Hidekazu Arii; Tomohiro Ozawa; Koichiro Jitsukawa; Takehiko Tosha; Shun Hirota; Teizo Kitagawa; Hideki Masuda","Formation of a Bridged Butterfly-Type μ-η2:η2-Peroxo Dicopper Core Structure with a Carboxylate Group","Journal of the American Chemical Society","2008","130","","16444","16445","10.1021/ja804201z","","","0.7107","MoKα","","","0.0744","","","","0.1098","","","","","","1.002","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108786","5.936","0.003","10.222","0.005","16.668","0.009","99.372","0.01","95.847","0.009","98.583","0.012","978.4","0.9","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H18 B N O3 -","- C25 H18 B N O3 -","- C50 H36 B2 N2 O6 -","2","1","","Peter F. Kaiser; Jonathan M. White; Craig A. Hutton","Enantioselective Preparation of a Stable Boronate Complex Stereogenic Only at Boron","Journal of the American Chemical Society","2008","130","","16450","16451","10.1021/ja8044629","","","0.71073","MoKα","","0.1157","0.0592","","","0.121","0.137","","","","","","0.845","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108787","11.2836","0.0002","9.1586","0.0001","11.5208","0.0002","90","","117.414","0.002","90","","1056.88","0.03","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C25 H17 B Br N O3 -","- C25 H17 B Br N O3 -","- C50 H34 B2 Br2 N2 O6 -","2","1","","Peter F. Kaiser; Jonathan M. White; Craig A. Hutton","Enantioselective Preparation of a Stable Boronate Complex Stereogenic Only at Boron","Journal of the American Chemical Society","2008","130","","16450","16451","10.1021/ja8044629","","","1.54184","CuKα","","0.0321","0.0315","","","0.0872","0.0876","","","","","","0.986","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108788","10.3748","0.0015","15.862","0.003","10.7396","0.0016","90","","99.82","0.004","90","","1741.5","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N4 O6 -","- C18 H18 N4 O6 -","- C72 H72 N16 O24 -","4","1","","Neel H. Shah; Glenn L. Butterfoss; Khanh Nguyen; Barney Yoo; Richard Bonneau; Dallas L. Rabenstein; Kent Kirshenbaum","Oligo(N-aryl glycines): A New Twist on Structured Peptoids","Journal of the American Chemical Society","2008","130","","16622","16632","10.1021/ja804580n","","","0.71073","MoKα","","0.0475","0.035","","","0.0845","0.099","","","","","","1.071","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108789","30.537","0.017","14.227","0.008","31.856","0.018","90","","101.202","0.011","90","","13576","13","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C138 H115 K4 N9 O24 U4 -","- C138 H112 K4 N9 O24 U4 -","- C552 H448 K16 N36 O96 U16 -","4","0.5","","Grégory Nocton; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti","Polynuclear Cation-Cation Complexes of Pentavalent Uranyl: Relating Stability and Magnetic Properties to Structure","Journal of the American Chemical Society","2008","130","","16633","16645","10.1021/ja804766r","","","0.71073","MoKα","","0.0838","0.0697","","","0.1846","0.1913","","","","","","1.122","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108790","12.657","0.005","12.883","0.005","14.939","0.007","64.541","0.006","73.031","0.009","87.072","0.006","2095.8","1.5","223","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H92 K2 O24 U2 -","- C84 H92 K2 O24 U2 -","- C84 H92 K2 O24 U2 -","1","0.5","","Grégory Nocton; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti","Polynuclear Cation-Cation Complexes of Pentavalent Uranyl: Relating Stability and Magnetic Properties to Structure","Journal of the American Chemical Society","2008","130","","16633","16645","10.1021/ja804766r","","","0.71073","MoKα","","0.0395","0.0326","","","0.082","0.0842","","","","","","1.164","","","","has coordinates","187017","2020-10-21","18:00:00",""
"4108791","10.7024","0.0007","10.9502","0.0007","23.4669","0.0015","80.043","0.001","52.828","0.001","89.314","0.001","2143.4","0.2","100","2","100","2","","","","","","","","3","P 1","P 1","1","1209 YY-056 1209a2n.CIF, neutron H positions calculated from the X-ray H-positions, unconventional unit cell (not reduced)","Cyclohexyl 4'-O-cyclohexyl-beta-D-glucopyranosyl- (1->-4)-beta-D-glucopyranoside, solvate with cyclohexane in 3:2 ratio","","- C84 H150 O33 -","- C84 H150 O33 -","- C84 H150 O33 -","1","1","","Yuko Yoneda; Kurt Mereiter; Christian Jaeger; Lothar Brecker; Paul Kosma; Thomas Rosenau; Alfred French","van der Waals versus Hydrogen-Bonding Forces in a Crystalline Analog of Cellotetraose: Cyclohexyl 4'-O-Cyclohexyl β-d-Cellobioside Cyclohexane Solvate","Journal of the American Chemical Society","2008","130","","16678","16690","10.1021/ja805147t","","","0.71073","MoKα","","0.0492","0.0451","","","0.1121","0.1161","","","","","","1.041","","","","has coordinates,has disorder","212006","2020-10-21","18:00:00",""
"4108792","8.3834","0.0009","13.102","0.002","14.396","0.002","90","","90","","90","","1581.2","0.4","293.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 Br O3 -","- C15 H21 Br O3 -","- C60 H84 Br4 O12 -","4","1","","Byungsook Kim; Miseon Lee; Mi Jung Kim; Hyunjoo Lee; Sanghee Kim; Deukjoon Kim; Minseob Koh; Seung Bum Park; Kye Jung Shin","Biomimetic Asymmetric Total Synthesis of (-)-Laurefucin via an Organoselenium-Mediated Intramolecular Hydroxyetherification","Journal of the American Chemical Society","2008","130","","16807","16811","10.1021/ja806304s","","","0.7107","MoKα","","","0.06","","","","0.162","","","","","","0.984","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108793","5.7314","0.0005","13.9725","0.0013","17.716","0.0016","90","","90","","90","","1418.7","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H13 Br N2 O2 -","- C16 H13 Br N2 O2 -","- C64 H52 Br4 N8 O8 -","4","1","","Madhu Ganesh; Daniel Seidel","Catalytic Enantioselective Additions of Indoles to Nitroalkenes","Journal of the American Chemical Society","2008","130","","16464","16465","10.1021/ja8063292","","","0.71073","MoKα","","0.0244","0.0235","","","0.0601","0.0605","","","","","","1.002","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108794","4.4875","0.0004","6.9458","0.0007","12.8851","0.0012","75.995","0.002","87.823","0.002","86.401","0.002","388.8","0.06","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C19 H16 N2 O S -","- C19 H16 N2 O S -","- C19 H16 N2 O S -","1","1","","Madhu Ganesh; Daniel Seidel","Catalytic Enantioselective Additions of Indoles to Nitroalkenes","Journal of the American Chemical Society","2008","130","","16464","16465","10.1021/ja8063292","","","0.71073","MoKα","","0.0513","0.0502","","","0.1266","0.1275","","","","","","1.008","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108795","13.9963","0.0012","12.9223","0.0011","10.2536","0.0009","90","","90.65","0.002","90","","1854.4","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H19 F3 N2 O3 S2 -","- C17 H19 F3 N2 O3 S2 -","- C68 H76 F12 N8 O12 S8 -","4","1","","Madhu Ganesh; Daniel Seidel","Catalytic Enantioselective Additions of Indoles to Nitroalkenes","Journal of the American Chemical Society","2008","130","","16464","16465","10.1021/ja8063292","","","0.71073","MoKα","","0.0445","0.0375","","","0.0914","0.0957","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108796","10.5097","0.0007","13.7167","0.0009","27.347","0.002","76.727","0.002","83.313","0.004","76.375","0.003","3720.9","0.4","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","","","- C104 H68 N6 O -","- C104 H67.9998 N6 O -","- C208 H136 N12 O2 -","2","1","","Zhao-Li Xue; Zhen Shen; John Mack; Daiki Kuzuhara; Hiroko Yamada; Tetsuo Okujima; Noboru Ono; Xiao-Zeng You; Nagao Kobayashi","A Facile One-Pot Synthesis of meso-Aryl-Substituted [14]Triphyrin(2.1.1)","Journal of the American Chemical Society","2008","130","","16478","16479","10.1021/ja8068769","","","0.71075","MoKα","","0.0806","0.0601","","","0.1299","0.1357","","","","","","0.996","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108797","14.3541","0.0016","14.7454","0.0014","22.349","0.003","90","","108.054","0.002","90","","4497.4","0.9","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C58 H47 N3 O -","- C58 H46.99 N3 O -","- C232 H187.96 N12 O4 -","4","1","","Zhao-Li Xue; Zhen Shen; John Mack; Daiki Kuzuhara; Hiroko Yamada; Tetsuo Okujima; Noboru Ono; Xiao-Zeng You; Nagao Kobayashi","A Facile One-Pot Synthesis of meso-Aryl-Substituted [14]Triphyrin(2.1.1)","Journal of the American Chemical Society","2008","130","","16478","16479","10.1021/ja8068769","","","0.71075","MoKα","","0.0759","0.0544","","","0.1242","0.1305","","","","","","0.992","","","","has coordinates,has disorder","178833","2020-10-21","18:00:00",""
"4108798","11.5086","0.0005","22.173","0.0009","25.2558","0.0011","90","","90","","90","","6444.8","0.5","298","","298","","","","","","","","","3","C m c m","-C 2c 2","63","Zeolite ITQ-34","","","- Ge0.09 O2 Si0.91 -","- Ge0.0959286 O2 Si0.904071 -","- Ge10.744 O224 Si101.256 -","112","7","","Avelino Corma; Maria J. Diaz-Cabanas; Jose L. Jorda; Fernando Rey; German Sastre; Karl G. Strohmaier","A Zeolitic Structure (ITQ-34) with Connected 9- and 10-Ring Channels Obtained with Phosphonium Cations as Structure Directing Agents","Journal of the American Chemical Society","2008","130","","16482","16483","10.1021/ja806903c","powder diffraction","","","CuKα","","","","","","","","","6.2573","","","","","","","","has coordinates","178833","2020-10-21","18:00:00",""
"4108799","10.8577","0.0003","19.0236","0.0006","20.0634","0.0006","90","","104.999","0.002","90","","4003","0.2","120","","120","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C43 H62 B Ni P3 -","- C43 H62 B Ni P3 -","- C172 H248 B4 Ni4 P12 -","4","1","","Marie Sircoglou; Sébastien Bontemps; Ghenwa Bouhadir; Nathalie Saffon; Karinne Miqueu; Weixing Gu; Maxime Mercy; Chun-Hsing Chen; Bruce M. Foxman; Laurent Maron; Oleg V. Ozerov; Didier Bourissou","Group 10 and 11 Metal Boratranes (Ni, Pd, Pt, CuCl, AgCl, AuCl, and Au+) Derived from a Triphosphine-Borane","Journal of the American Chemical Society","2008","130","","16729","16738","10.1021/ja8070072","","","0.71073","MoKα","","0.0281","0.0261","","0.0623","0.0618","0.0623","","","","","","0.9909","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108800","11.0591","0.0005","11.2426","0.0006","16.7043","0.0008","76.909","0.002","78.583","0.002","60.716","0.002","1755.09","0.15","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H54 B P3 Pd -","- C36 H54 B P3 Pd -","- C72 H108 B2 P6 Pd2 -","2","1","","Marie Sircoglou; Sébastien Bontemps; Ghenwa Bouhadir; Nathalie Saffon; Karinne Miqueu; Weixing Gu; Maxime Mercy; Chun-Hsing Chen; Bruce M. Foxman; Laurent Maron; Oleg V. Ozerov; Didier Bourissou","Group 10 and 11 Metal Boratranes (Ni, Pd, Pt, CuCl, AgCl, AuCl, and Au+) Derived from a Triphosphine-Borane","Journal of the American Chemical Society","2008","130","","16729","16738","10.1021/ja8070072","","","0.71073","MoKα","","0.0365","0.0327","","0.0914","0.0882","0.0914","","","","","","0.9776","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108801","17.8985","0.0004","17.8985","0.0004","25.1626","0.0011","90","","90","","120","","6981","0.4","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C39 H60 Ag B Cl7 P3 -","- C39 H60 Ag B Cl7 P3 -","- C234 H360 Ag6 B6 Cl42 P18 -","6","0.333333","","Marie Sircoglou; Sébastien Bontemps; Ghenwa Bouhadir; Nathalie Saffon; Karinne Miqueu; Weixing Gu; Maxime Mercy; Chun-Hsing Chen; Bruce M. Foxman; Laurent Maron; Oleg V. Ozerov; Didier Bourissou","Group 10 and 11 Metal Boratranes (Ni, Pd, Pt, CuCl, AgCl, AuCl, and Au+) Derived from a Triphosphine-Borane","Journal of the American Chemical Society","2008","130","","16729","16738","10.1021/ja8070072","","","0.71073","MoKα","","0.0242","0.0199","","","0.0509","0.0531","","","","","","1.038","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108802","17.751","0.0004","17.751","0.0004","25.16","0.0012","90","","90","","120","","6865.7","0.4","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C39 H60 B Cl7 Cu P3 -","- C39 H60 B Cl7 Cu P3 -","- C234 H360 B6 Cl42 Cu6 P18 -","6","0.333333","","Marie Sircoglou; Sébastien Bontemps; Ghenwa Bouhadir; Nathalie Saffon; Karinne Miqueu; Weixing Gu; Maxime Mercy; Chun-Hsing Chen; Bruce M. Foxman; Laurent Maron; Oleg V. Ozerov; Didier Bourissou","Group 10 and 11 Metal Boratranes (Ni, Pd, Pt, CuCl, AgCl, AuCl, and Au+) Derived from a Triphosphine-Borane","Journal of the American Chemical Society","2008","130","","16729","16738","10.1021/ja8070072","","","0.71073","MoKα","","0.03","0.0252","","","0.0661","0.0691","","","","","","1.058","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108803","11.1685","0.001","14.4053","0.0014","15.9131","0.0014","81.638","0.002","70.938","0.002","68.797","0.002","2254.9","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H56 Au B Cl6 Ga P3 -","- C37 H56 Au B Cl6 Ga P3 -","- C74 H112 Au2 B2 Cl12 Ga2 P6 -","2","1","","Marie Sircoglou; Sébastien Bontemps; Ghenwa Bouhadir; Nathalie Saffon; Karinne Miqueu; Weixing Gu; Maxime Mercy; Chun-Hsing Chen; Bruce M. Foxman; Laurent Maron; Oleg V. Ozerov; Didier Bourissou","Group 10 and 11 Metal Boratranes (Ni, Pd, Pt, CuCl, AgCl, AuCl, and Au+) Derived from a Triphosphine-Borane","Journal of the American Chemical Society","2008","130","","16729","16738","10.1021/ja8070072","","","0.71073","MoKα","","0.064","0.0483","","","0.1132","0.1213","","","","","","1.019","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108804","9.4977","0.001","30.723","0.004","9.5901","0.0011","90","","90","","90","","2798.4","0.6","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C26 H40 Ir N3 P2 -","- C26 H40 Ir N3 P2 -","- C104 H160 Ir4 N12 P8 -","4","1","","Matthew T. Whited; Robert H. Grubbs","A Catalytic Cycle for Oxidation of tert-Butyl Methyl Ether by a Double C-H Activation-Group Transfer Process","Journal of the American Chemical Society","2008","130","","16476","16477","10.1021/ja8071385","","","0.71073","MoKα","","0.0861","0.0383","","","0.0512","0.0575","","","","","","1.065","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108805","13.8471","0.0018","16.144","0.002","24.435","0.003","88.172","0.003","88.307","0.003","87.923","0.002","5453.8","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H24 Cl0.5 N8 Ni O0.75 -","- C22.5 H25.5 N2.5 Ni0.5 O2 -","- C180 H204 N20 Ni4 O16 -","8","4","","Jongwoo Park; Kai Lang; Khalil A. Abboud; Sukwon Hong","Self-Assembled Dinuclear Cobalt(II)-Salen Catalyst Through Hydrogen-Bonding and Its Application to Enantioselective Nitro-Aldol (Henry) Reaction","Journal of the American Chemical Society","2008","130","","16484","16485","10.1021/ja807221s","","","0.71073","MoKα","","0.1212","0.0783","","","0.1905","0.2047","","","","","","0.955","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108806","16.4925","0.0013","16.4925","0.0013","8.4974","0.0013","90","","90","","90","","2311.3","0.4","295","2","295","2","","","","","","","","3","P 4 n c","P 4 -2n","104","","","","- C14 H16 O -","- C14 H16 O -","- C112 H128 O8 -","8","1","","Sabyasachi Bhunia; Rai-Shung Liu","Gold-Catalyzed 1,3-Addition of a sp3-Hybridized C-H Bond to Alkenylcarbenoid Intermediate","Journal of the American Chemical Society","2008","130","","16488","16489","10.1021/ja807384a","","","0.71073","MoKα","","0.0564","0.0387","","","0.0866","0.0938","","","","","","0.911","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108807","14.683","0.001","15.244","0.001","18.748","0.001","112.132","0.001","102.516","0.001","91.066","0.001","3771.4","0.4","85","2","85","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H21 N O6 -","- C21 H21 N O6 -","- C168 H168 N8 O48 -","8","4","","Jing Chen; Anne J. McNeil","Analyte-Triggered Gelation: Initiating Self-Assembly via Oxidation-Induced Planarization","Journal of the American Chemical Society","2008","130","","16496","16497","10.1021/ja807651a","","","0.71073","MoKα","","0.0538","0.0399","","","0.1038","0.1126","","","","","","1.022","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108808","7.316","0.0014","9.663","0.0019","13.434","0.003","98.369","0.003","97.204","0.003","91.651","0.003","931.1","0.3","85","2","85","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H23 N O6 -","- C21 H23 N O6 -","- C42 H46 N2 O12 -","2","1","","Jing Chen; Anne J. McNeil","Analyte-Triggered Gelation: Initiating Self-Assembly via Oxidation-Induced Planarization","Journal of the American Chemical Society","2008","130","","16496","16497","10.1021/ja807651a","","","0.71073","MoKα","","0.054","0.0429","","","0.1121","0.1183","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108809","9.352","0.003","17.763","0.005","18.934","0.006","90","","102.44","0.005","90","","3071.5","1.6","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H29 N2 P Pd S -","- C41 H29 N2 P Pd S -","- C164 H116 N8 P4 Pd4 S4 -","4","1","","Yoshihiro Matano; Takashi Nakabuchi; Shinya Fujishige; Haruyuki Nakano; Hiroshi Imahori","Redox-Coupled Complexation of 23-Phospha-21-thiaporphyrin with Group 10 Metals: A Convenient Access to Stable Core-Modified Isophlorin-Metal Complexes","Journal of the American Chemical Society","2008","130","","16446","16447","10.1021/ja807742g","","","0.7107","MoKα","","0.0636","0.0528","","","0.1004","0.1061","","","","","","1.01","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108810","10.7024","0.0007","10.9502","0.0007","23.4669","0.0015","80.043","0.001","52.828","0.001","89.314","0.001","2143.4","0.2","100","2","100","2","","","","","","","","3","P 1","P 1","1","1209 YY-056 1209a2.CIF, X-ray H positions, unconventional unit cell (not reduced)","Cyclohexyl 4'-O-cyclohexyl-beta-D-glucopyranosyl- (1->-4)-beta-D-glucopyranoside, solvate with cyclohexane in 3:2 ratio","","- C84 H150 O33 -","- C84 H150 O33 -","- C84 H150 O33 -","1","1","","Yuko Yoneda; Kurt Mereiter; Christian Jaeger; Lothar Brecker; Paul Kosma; Thomas Rosenau; Alfred French","van der Waals versus Hydrogen-Bonding Forces in a Crystalline Analog of Cellotetraose: Cyclohexyl 4'-O-Cyclohexyl β-d-Cellobioside Cyclohexane Solvate","Journal of the American Chemical Society","2008","130","","16678","16690","10.1021/ja805147t","","","0.71073","MoKα","","0.0492","0.0451","","","0.1121","0.1161","","","","","","1.041","","4108791","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4108811","10.8425","0.0015","9.7909","0.0015","15.057","0.002","90","","105.699","0.006","90","","1538.8","0.4","128","2","128","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","KY4-106","methyl (1R*,7S*)-1-(1-oxoethyl)-2-methylene-7-phenylcycloheptanecarboxylate","","- C19 H22 O3 -","- C18 H22 O3 -","- C72 H88 O12 -","4","1","","Yoshimitsu Itoh; Hayato Tsuji; Ken-ichi Yamagata; Kohei Endo; Iku Tanaka; Masaharu Nakamura; Eiichi Nakamura","Efficient Formation of Ring Structures Utilizing Multisite Activation by Indium Catalysis","Journal of the American Chemical Society","2008","130","","17161","17167","10.1021/ja805657h","","","0.7107","MoKα","","0.0478","0.0382","","","0.1036","0.1092","","","","","","1.104","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108812","10.8158","0.0006","12.6567","0.0007","16.287","0.0011","90","","90","","90","","2229.6","0.2","200","2","200","2","","","","","","","","6","P b n a","-P 2ac 2b","60","","","","- C8 H24 Fe4 N6 O4 S4 -","- C8 H24 Fe4 N6 O4 S4 -","- C32 H96 Fe16 N24 O16 S16 -","4","0.5","","Chih-Chin Tsou; Zong-Sian Lin; Tsai-Te Lu; Wen-Feng Liaw","Transformation of Dinitrosyl Iron Complexes [(NO)2Fe(SR)2]- (R = Et, Ph) into [4Fe-4S] Clusters [Fe4S4(SPh)4]2-: Relevance to the Repair of the Nitric Oxide-Modified Ferredoxin [4Fe-4S] Clusters","Journal of the American Chemical Society","2008","130","","17154","17160","10.1021/ja806050x","","","0.71073","MoKα","","0.1016","0.0538","","","0.1218","0.1605","","","","","","1.094","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108813","16.416","0.003","14.519","0.002","16.745","0.003","90","","118.479","0.002","90","","3508.1","1","173.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H47 Cl Fe N2 -","- C38 H47 Cl Fe N2 -","- C152 H188 Cl4 Fe4 N8 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0452","","","","0.0567","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108814","28.804","0.008","10.617","0.003","14.556","0.004","90","","90","","90","","4451","2","173.1","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C21 H35 Cl Fe N2 -","- C21 H35 Cl Fe N2 -","- C168 H280 Cl8 Fe8 N16 -","8","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0411","","","","0.056","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108815","12.562","0.003","14.724","0.003","15.912","0.003","90","","107.457","0.004","90","","2807.6","1","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H42 Fe N2 -","- C32 H42 Fe N2 -","- C128 H168 Fe4 N8 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0397","","","","0.0665","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108816","13.078","0.005","13.533","0.004","18.648","0.007","90","","108.835","0.007","90","","3123.7","1.9","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H44 Fe N2 -","- C37 H44 Fe N2 -","- C148 H176 Fe4 N8 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0534","","","","0.078","","","","","","1.24","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108817","13.177","0.003","12.491","0.003","16.988","0.003","90","","99.092","0.003","90","","2761","1","173.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 Fe N2 O -","- C32 H38 Fe N2 O -","- C128 H152 Fe4 N8 O4 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0338","","","","0.0511","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108818","9.957","0.002","11.791","0.003","17.63","0.004","90","","90.031","0.003","90","","2069.8","0.8","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H34 Fe N2 -","- C21 H28 Fe N2 -","- C84 H112 Fe4 N8 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0815","","","","0.1077","","","","","","1.444","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108819","9.257","0.007","10.883","0.007","12.182","0.008","101.044","0.006","110.649","0.003","109.369","0.008","1015.1","1.2","173.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H34 Fe N3 -","- C21 H34 Fe N3 -","- C42 H68 Fe2 N6 -","2","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0303","","","","0.047","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108820","17.646","0.003","14.218","0.003","9.5866","0.0016","90","","90","","90","","2405.2","0.8","173.1","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C25 H38 Fe N2 S -","- C25 H38 Fe N2 S -","- C100 H152 Fe4 N8 S4 -","4","0.5","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0281","","","","0.039","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108821","11.583","0.003","13.746","0.003","17.565","0.004","90","","105.828","0.003","90","","2690.7","1.1","173.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27.5 H44 Fe N2 O -","- C27.5 H29 Fe N2 O -","- C110 H116 Fe4 N8 O4 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0687","","","","0.1228","","","","","","1.291","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108822","8.696","0.002","9.286","0.003","17.219","0.005","76.553","0.012","84.382","0.019","80.048","0.015","1329.6","0.7","173.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C29 H40 Fe N2 S -","- C29 H20 Fe N2 S -","- C58 H40 Fe2 N4 S2 -","2","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0499","","","","0.0737","","","","","","1.387","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108823","11.626","0.003","14.076","0.003","18.009","0.004","90","","99.585","0.003","90","","2906","1.2","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H48 Fe N4 -","- C31 H48 Fe N4 -","- C124 H192 Fe4 N16 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0394","","","","0.0581","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108824","16.603","0.003","13.69","0.003","11.323","0.002","90","","90","","90","","2573.7","0.9","173.1","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C27 H41 B Fe N2 O2 -","- C27 H41 B Fe N2 O2 -","- C108 H164 B4 Fe4 N8 O8 -","4","0.5","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.0558","","","","0.0712","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108825","11.2542","0.0013","16.9402","0.0019","13.5726","0.0016","90","","90.0129","0.0017","90","","2587.6","0.5","173.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H40 Fe N2 O -","- C29 H40 Fe N2 O -","- C116 H160 Fe4 N8 O4 -","4","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.1858","","","","0.3122","","","","","","1.406","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108826","30.02","0.12","41.81","0.16","8.44","0.03","90","","90","","90","","10593","7","173.1","","","","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C31 H39 Fe N2 -","- C31 Fe N2 -","- C496 Fe16 N32 -","16","1","","Yasuhiro Ohki; Tsubasa Hatanaka; Kazuyuki Tatsumi","C-H Bond Activation of Heteroarenes Mediated by a Half-Sandwich Iron Complex of N-Heterocyclic Carbene","Journal of the American Chemical Society","2008","130","","17174","17186","10.1021/ja8063028","","","0.7107","MoKα","","","0.2438","","","","0.2745","","","","","","3.386","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108827","20.048","0.003","19.537","0.002","30.521","0.004","90","","96.874","0.002","90","","11868","3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","tetrakis[4-(carboxyphenyl)oxamethyl]methane","","","- C94 H81.5 N7 O30 Zn4 -","- C94 H81.5 N7 O30.02 Zn4 -","- C376 H326 N28 O120.08 Zn16 -","4","0.5","","Praveen K. Thallapally; Jian Tian; Motkuri Radha Kishan; Carlos A. Fernandez; Scott J. Dalgarno; Peter B. McGrail; John E. Warren; Jerry L. Atwood","Flexible (Breathing) Interpenetrated Metal-Organic Frameworks for CO2 Separation Applications","Journal of the American Chemical Society","2008","130","","16842","16843","10.1021/ja806391k","","","0.671","","","0.0969","0.08","","","0.2392","0.2482","","","","","","1.793","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108828","12.0885","0.0005","11.7834","0.0005","10.4501","0.0006","90","","90","","90","","1488.55","0.12","180","2","180","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C5 H15 B N2 -","- C5 H15 B N2 -","- C40 H120 B8 N16 -","8","2","","Dominik Wechsler; Yi Cui; Darrell Dean; Boyd Davis; Philip G. Jessop","Production of H2 from Combined Endothermic and Exothermic Hydrogen Carriers","Journal of the American Chemical Society","2008","130","","17195","17203","10.1021/ja806721s","","","0.71073","MoKα","","0.0345","0.0312","","","0.0781","0.0806","","","","","","1.065","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108829","11.3241","0.0017","20.604","0.003","35.073","0.006","90","","90","","90","","8183","2","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C77 H57 K3 N4 O23 S6 -","- C77 H57 K3 N4 O23 S6 -","- C308 H228 K12 N16 O92 S24 -","4","1","","Manabu Hatano; Toshikatsu Maki; Katsuhiko Moriyama; Manabu Arinobe; Kazuaki Ishihara","Pyridinium 1,1'-Binaphthyl-2,2'-disulfonates as Highly Effective Chiral Brønsted Acid-Base Combined Salt Catalysts for Enantioselective Mannich-Type Reaction","Journal of the American Chemical Society","2008","130","","16858","16860","10.1021/ja806875c","","","0.71073","MoKα","","0.0979","0.0753","","","0.2221","0.2439","","","","","","1.071","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108830","6.001","0.005","10.898","0.005","29.128","0.005","90","0.005","90","0.005","90","0.005","1904.9","1.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","[2-Acetyl-1-(4-bromo-phenyl)-2-hydroxy-3-oxo-butyl] -carbamic acid benzyl ester","","","- C20 H20 Br N O5 -","- C20 H20 Br N O5 -","- C80 H80 Br4 N4 O20 -","4","1","","Manabu Hatano; Toshikatsu Maki; Katsuhiko Moriyama; Manabu Arinobe; Kazuaki Ishihara","Pyridinium 1,1'-Binaphthyl-2,2'-disulfonates as Highly Effective Chiral Brønsted Acid-Base Combined Salt Catalysts for Enantioselective Mannich-Type Reaction","Journal of the American Chemical Society","2008","130","","16858","16860","10.1021/ja806875c","","","0.71069","MoKα","","0.0361","0.0312","","","0.0741","0.0759","","","","","","1.003","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108831","9.9855","0.0017","8.2071","0.0014","24.322","0.004","90","","90.099","0.003","90","","1993.2","0.6","203","2","203","2","","","","","","","","4","P 1 21 1","P 2yb","4","(1R,2R)-[3-Oxo-2-(2-oxo-oxazolidine-3-carbonyl) -1-phenyl-butyl]-carbamic acid benzyl ester","","","- C22 H22 N2 O6 -","- C22 H22 N2 O6 -","- C88 H88 N8 O24 -","4","2","","Manabu Hatano; Toshikatsu Maki; Katsuhiko Moriyama; Manabu Arinobe; Kazuaki Ishihara","Pyridinium 1,1'-Binaphthyl-2,2'-disulfonates as Highly Effective Chiral Brønsted Acid-Base Combined Salt Catalysts for Enantioselective Mannich-Type Reaction","Journal of the American Chemical Society","2008","130","","16858","16860","10.1021/ja806875c","","","0.71073","MoKα","","0.0386","0.0355","","","0.0885","0.0908","","","","","","1.058","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108832","7.2563","0.0003","20.5934","0.0009","21.5442","0.0009","90","","106.777","0.003","90","","3082.4","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C54 H60 Cr2 N24 -","- C54 H60 Cr2 N24 -","- C108 H120 Cr4 N48 -","2","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.1183","0.0576","","","0.1329","0.1578","","","","","","1.027","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108833","7.0949","0.0003","12.3765","0.0005","17.9534","0.0007","83.58","0.002","87.6101","0.001","83.934","0.001","1557.12","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H74 Fe2 N24 O7 -","- C54 H66 Fe2 N24 O7 -","- C54 H66 Fe2 N24 O7 -","1","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.0814","0.0588","","","0.154","0.1728","","","","","","1.087","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108834","7.0982","0.0004","12.3509","0.0007","17.8586","0.001","83.535","0.002","87.428","0.001","83.967","0.002","1546.21","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H74 Co2 N24 O7 -","- C54 H66 Co2 N24 O7 -","- C54 H66 Co2 N24 O7 -","1","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.0718","0.0517","","","0.1352","0.1533","","","","","","1.015","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108835","7.1142","0.0004","21.4319","0.0013","20.9403","0.0013","90","","91.702","0.002","90","","3191.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H74 Cr2 N24 O7 -","- C54 H74 Cr2 N24 O7 -","- C108 H148 Cr4 N48 O14 -","2","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.1085","0.0631","","","0.1492","0.1825","","","","","","1.042","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108836","7.2526","0.0009","19.894","0.003","20.773","0.003","90","","93.909","0.004","90","","2990.2","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H30 Cr N12 O3 -","- C27 H24 Cr N12 O3 -","- C108 H96 Cr4 N48 O12 -","4","1","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.2541","0.0731","","","0.1377","0.2139","","","","","","1.02","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108837","7.2655","0.001","19.6845","0.0018","20.427","0.003","90","","93.837","0.007","90","","2914.9","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H30 Fe N12 O3 -","- C27 H24 Fe N12 O3 -","- C108 H96 Fe4 N48 O12 -","4","1","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.3045","0.1084","","","0.2008","0.2797","","","","","","1.055","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108838","7.2138","0.0006","12.1706","0.0011","17.309","0.0016","84.987","0.002","89.044","0.003","83.821","0.002","1505","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H60 Fe2 N24 -","- C54 H60 Fe2 N24 -","- C54 H60 Fe2 N24 -","1","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.093","0.0487","","","0.0656","0.0718","","","","","","1.283","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108839","7.2141","0.0004","12.1497","0.0008","17.2052","0.0013","84.582","0.004","88.96","0.004","84.052","0.004","1493.15","0.17","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H60 Co2 N24 -","- C54 H60 Co2 N24 -","- C54 H60 Co2 N24 -","1","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.1379","0.068","","","0.1604","0.1918","","","","","","1.013","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108840","7.2886","0.0002","19.5917","0.0005","20.3127","0.0005","90","","93.611","0.002","90","","2894.81","0.13","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H30 Co N12 O3 -","- C27 H24 Co N12 O3 -","- C108 H96 Co4 N48 O12 -","4","1","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.0846","0.0443","","","0.1118","0.1286","","","","","","1.042","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108841","7.0978","0.0005","22.2254","0.0016","20.6357","0.0012","90","","92.363","0.003","90","","3252.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H76 Fe2 N24 O14 -","- C54 H76 Fe2 N24 O14 -","- C108 H152 Fe4 N48 O28 -","2","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.0944","0.0503","","","0.1314","0.1601","","","","","","1.022","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108842","7.118","0.001","22.252","0.004","20.508","0.004","90","","92.239","0.006","90","","3245.8","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H76 Co2 N24 O14 -","- C54 H76 Co2 N24 O14 -","- C108 H152 Co4 N48 O28 -","2","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.1019","0.0513","","","0.1191","0.1376","","","","","","1.012","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108843","7.119","0.0002","22.325","0.0006","21.011","0.0006","90","","92.819","0.0017","90","","3335.27","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H76 Cr2 N24 O14 -","- C54 H76 Cr2 N24 O14 -","- C108 H152 Cr4 N48 O28 -","2","0.5","","Pierre Dechambenoit; Sylvie Ferlay; Nathalie Kyritsakas; Mir Wais Hosseini","Molecular Tectonics: Control of Reversible Water Release in Porous Charge-Assisted H-Bonded Networks","Journal of the American Chemical Society","2008","130","","17106","17113","10.1021/ja806916t","","","0.71073","MoKα","","0.101","0.0549","","","0.1138","0.1299","","","","","","1.028","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108844","10.566","0.003","11.45","0.003","13.4","0.003","110.076","0.004","103.1","0.002","98.843","0.002","1434.7","0.6","123.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H32 F3 Ir N2 O6 S -","- C27 H32 F3 Ir N2 O6 S -","- C54 H64 F6 Ir2 N4 O12 S2 -","2","1","","Hironobu Kanemitsu; Keiji Uehara; Shunichi Fukuzumi; Seiji Ogo","Isolation and Crystal Structures of Both Enol and Keto Tautomer Intermediates in a Hydration of an Alkyne-Carboxylic Acid Ester Catalyzed by Iridium Complexes in Water","Journal of the American Chemical Society","2008","130","","17141","17147","10.1021/ja807254d","","","0.7107","MoKα","","","0.0302","","","","0.076","","","","","","0.968","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108845","14.7539","0.0009","12.9194","0.0005","16.236","0.001","90","","105.899","0.003","90","","2976.4","0.3","123.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H36 F6 Ir N2 O4 P -","- C27 H36 F6 Ir N2 O4 P -","- C108 H144 F24 Ir4 N8 O16 P4 -","4","1","","Hironobu Kanemitsu; Keiji Uehara; Shunichi Fukuzumi; Seiji Ogo","Isolation and Crystal Structures of Both Enol and Keto Tautomer Intermediates in a Hydration of an Alkyne-Carboxylic Acid Ester Catalyzed by Iridium Complexes in Water","Journal of the American Chemical Society","2008","130","","17141","17147","10.1021/ja807254d","","","0.7107","MoKα","","","0.0256","","","","0.0746","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108846","7.729","0.001","12.317","0.0012","14.172","0.0013","85.373","0.001","76.905","0.001","87.755","0.002","1309.5","0.2","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C18 H25 B F3 N8 O4 P S W -","- C18 H25 B F3 N8 O4 P S W -","- C36 H50 B2 F6 N16 O8 P2 S2 W2 -","2","1","","Daniel P. Harrison; Kevin D. Welch; Adam C. Nichols-Nielander; Michal Sabat; William H. Myers; W. Dean Harman","Efficient Synthesis of an η2-Pyridine Complex and a Preliminary Investigation of the Bound Heterocycle's Reactivity","Journal of the American Chemical Society","2008","130","","16844","16845","10.1021/ja807521d","","","0.71074","MoKα","","0.0636","0.0523","","","0.1393","0.1465","","","","","","1.119","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108847","10.283","0.0006","10.4018","0.0006","26.9845","0.0015","90","","99.849","0.001","90","","2843.8","0.3","273","2","273","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C18 H28 B2 Cl3 N8 O P W -","- C18 H28 B2 Cl3 N8 O P W -","- C72 H112 B8 Cl12 N32 O4 P4 W4 -","4","1","","Daniel P. Harrison; Kevin D. Welch; Adam C. Nichols-Nielander; Michal Sabat; William H. Myers; W. Dean Harman","Efficient Synthesis of an η2-Pyridine Complex and a Preliminary Investigation of the Bound Heterocycle's Reactivity","Journal of the American Chemical Society","2008","130","","16844","16845","10.1021/ja807521d","","","0.71073","MoKα","","0.0569","0.0398","","","0.0895","0.0941","","","","","","0.916","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108848","7.6919","0.0003","18.7778","0.0007","19.2958","0.0007","90","","90","","90","","2787.03","0.18","293","2","293","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C20 H27 B F3 N8 O5 P S W -","- C20 H27 B F3 N8 O5 P S W -","- C80 H108 B4 F12 N32 O20 P4 S4 W4 -","4","1","","Daniel P. Harrison; Kevin D. Welch; Adam C. Nichols-Nielander; Michal Sabat; William H. Myers; W. Dean Harman","Efficient Synthesis of an η2-Pyridine Complex and a Preliminary Investigation of the Bound Heterocycle's Reactivity","Journal of the American Chemical Society","2008","130","","16844","16845","10.1021/ja807521d","","","0.71073","MoKα","","0.0402","0.033","","","0.064","0.0657","","","","","","0.861","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108849","11.631","0.001","13.951","0.001","16.647","0.001","90","","91.69","0.002","90","","2700","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 B N8 O3 P W -","- C22 H32 B N8 O3 P W -","- C88 H128 B4 N32 O12 P4 W4 -","4","1","","Daniel P. Harrison; Kevin D. Welch; Adam C. Nichols-Nielander; Michal Sabat; William H. Myers; W. Dean Harman","Efficient Synthesis of an η2-Pyridine Complex and a Preliminary Investigation of the Bound Heterocycle's Reactivity","Journal of the American Chemical Society","2008","130","","16844","16845","10.1021/ja807521d","","","0.71074","MoKα","","0.0892","0.056","","","0.1449","0.1582","","","","","","1.054","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108850","10.2881","0.0001","14.059","0.0001","18.7375","0.0002","90","","97.642","0.001","90","","2686.13","0.04","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H30 B N8 O3 P W -","- C22 H30 B N8 O3 P W -","- C88 H120 B4 N32 O12 P4 W4 -","4","1","","Daniel P. Harrison; Kevin D. Welch; Adam C. Nichols-Nielander; Michal Sabat; William H. Myers; W. Dean Harman","Efficient Synthesis of an η2-Pyridine Complex and a Preliminary Investigation of the Bound Heterocycle's Reactivity","Journal of the American Chemical Society","2008","130","","16844","16845","10.1021/ja807521d","","","0.71073","MoKα","","0.0291","0.0187","","","0.0358","0.0378","","","","","","1.033","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108851","17.516","0.0002","20.988","0.0004","18.377","0.0003","90","","101.865","0.001","90","","6611.52","0.18","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,1,4,4-Tetrakis[bis(trimethylsilyl)methyl]-1,4-diisopropyl-2-tetrasilyne bis(trimethysilylisocyanide) complex","","- C42 H108 N2 Si14 -","- C42 H108 N2 Si14 -","- C168 H432 N8 Si56 -","4","1","","Katsuhiko Takeuchi; Masaaki Ichinohe; Akira Sekiguchi","Reactivity of the Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) toward Silylcyanide: Two Pathways To Form the Bis-Adduct [RSiSiR(CNSiMe3)2] with Some Silaketenimine Character and a 1,4-Diaza-2,3-disilabenzene Analogue","Journal of the American Chemical Society","2008","130","","16848","16849","10.1021/ja807974a","","","0.7107","MoKα","","0.0658","0.0562","","","0.1455","0.1534","","","","","","1.025","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108852","9.627","0.0005","10.958","0.0003","14.608","0.0008","105.456","0.003","95.914","0.003","110.091","0.003","1362.31","0.12","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","meso-1,1,4,4-Tetrakis[bis(trimethylsilyl)methyl]- 3,4-dicyano-1,4-diisopropyltetrasilane","","- C36 H92 N2 Si12 -","- C36 H92 N2 Si12 -","- C36 H92 N2 Si12 -","1","0.5","","Katsuhiko Takeuchi; Masaaki Ichinohe; Akira Sekiguchi","Reactivity of the Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) toward Silylcyanide: Two Pathways To Form the Bis-Adduct [RSiSiR(CNSiMe3)2] with Some Silaketenimine Character and a 1,4-Diaza-2,3-disilabenzene Analogue","Journal of the American Chemical Society","2008","130","","16848","16849","10.1021/ja807974a","","","0.7107","MoKα","","0.0492","0.0432","","","0.1183","0.123","","","","","","1.024","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108853","9.9476","0.0019","36.449","0.007","20.012","0.004","90","","97.625","0.002","90","","7192","2","123.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C72 H70 Cl4 N O11 P7 Ru -","- C72 H70 Cl4 N O11 P7 Ru -","- C288 H280 Cl16 N4 O44 P28 Ru4 -","4","1","","Yousuke Ikeda; Takafumi Yamaguchi; Keiichiro Kanao; Kazuhiro Kimura; Sou Kamimura; Yuichiro Mutoh; Yoshiaki Tanabe; Youichi Ishii","Formation of Vinylidenes from Internal Alkynes at a Cyclotriphosphato Ruthenium Complex","Journal of the American Chemical Society","2008","130","","16856","16857","10.1021/ja8080567","","","0.7107","MoKα","","","0.0787","","","","0.1796","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108854","17.828","0.003","18.996","0.004","19.444","0.004","90","","90.293","0.003","90","","6585","2","123.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C66 H70 N O13 P7 Ru -","- C66 H70 N O13 P7 Ru -","- C264 H280 N4 O52 P28 Ru4 -","4","1","","Yousuke Ikeda; Takafumi Yamaguchi; Keiichiro Kanao; Kazuhiro Kimura; Sou Kamimura; Yuichiro Mutoh; Yoshiaki Tanabe; Youichi Ishii","Formation of Vinylidenes from Internal Alkynes at a Cyclotriphosphato Ruthenium Complex","Journal of the American Chemical Society","2008","130","","16856","16857","10.1021/ja8080567","","","0.7107","MoKα","","","0.049","","","","0.138","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108855","9.8148","0.0018","16.692","0.003","20.779","0.004","85.009","0.005","82.014","0.004","84.929","0.005","3348.3","1.1","123.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C73 H70 N O11 P7 Ru -","- C73 H69 N O11 P7 Ru -","- C146 H138 N2 O22 P14 Ru2 -","2","1","","Yousuke Ikeda; Takafumi Yamaguchi; Keiichiro Kanao; Kazuhiro Kimura; Sou Kamimura; Yuichiro Mutoh; Yoshiaki Tanabe; Youichi Ishii","Formation of Vinylidenes from Internal Alkynes at a Cyclotriphosphato Ruthenium Complex","Journal of the American Chemical Society","2008","130","","16856","16857","10.1021/ja8080567","","","0.7107","MoKα","","","0.0608","","","","0.1369","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108856","21.3016","0.0016","21.595","0.0018","15.8181","0.0013","90","","99.408","0.002","90","","7178.6","1","117","2","117","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C74 H116 Cl2 Cr2 N4 O -","- C75.87 H104.04 Cl2 Cr2 N4 O0.662 -","- C303.48 H416.16 Cl8 Cr8 N16 O2.648 -","4","0.5","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.0605","0.034","","","0.0795","0.0903","","","","","","0.946","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108857","9.9035","0.0007","17.606","0.0012","21.5766","0.0016","90","","97.806","0.002","90","","3727.3","0.5","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H64 Cr N2 -","- C40 H64 Cr N2 -","- C160 H256 Cr4 N8 -","4","1","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.0686","0.037","","","0.073","0.0819","","","","","","0.884","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108858","16.8123","0.0015","9.5254","0.0008","22.6128","0.0019","90","","108.231","0.002","90","","3439.5","0.5","122","2","122","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C36 H56 Cr N2 -","- C36 H56 Cr N2 -","- C144 H224 Cr4 N8 -","4","0.5","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.0664","0.0419","","","0.1004","0.1098","","","","","","0.954","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108859","24.296","0.003","18.01","0.002","16.747","0.0019","90","","109.941","0.004","90","","6888.6","1.4","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H58 Cr N2 -","- C37 H58 Cr N2 -","- C296 H464 Cr8 N16 -","8","2","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.3157","0.0669","","","0.106","0.1473","","","","","","0.642","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108860","34.221","0.003","13.3963","0.0012","21.1992","0.0019","90","","90","","90","","9718.5","1.5","128","2","128","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C53 H76 Cr N2 Si -","- C53 H76 Cr N2 Si -","- C424 H608 Cr8 N16 Si8 -","8","1","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.1184","0.0427","","","0.0764","0.0923","","","","","","0.804","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108861","10.0616","0.0011","10.1069","0.0011","21.264","0.002","91.477","0.003","93.136","0.003","94.606","0.003","2151.2","0.4","118","2","118","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H70 Cr N2 O -","- C47 H70 Cr N2 O -","- C94 H140 Cr2 N4 O2 -","2","1","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.0989","0.0552","","","0.1141","0.1273","","","","","","0.843","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108862","9.7282","0.0007","17.3211","0.0011","21.309","0.0014","90","","95.8084","0.0012","90","","3572.2","0.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H59 Cr N3 -","- C37 H59 Cr N3 -","- C148 H236 Cr4 N12 -","4","1","","Hongjun Fan; Debashis Adhikari; Anas A. Saleh; Rodney L. Clark; Francisco J. Zuno-Cruz; Gloria Sanchez Cabrera; John C. Huffman; Maren Pink; Daniel J. Mindiola; Mu-Hyun Baik","Understanding and Predicting Distorted T- versus Y-Geometries for Neutral Chromous Complexes Supported by a Sterically Encumbering β-Diketiminate Ligand","Journal of the American Chemical Society","2008","130","","17351","17361","10.1021/ja803798b","","","0.71073","MoKα","","0.0681","0.0511","","","0.1514","0.1649","","","","","","1.067","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4108863","8.4917","0.0002","11.2276","0.0003","19.7051","0.0006","96.163","0.001","97.129","0.001","103.888","0.001","1791.26","0.08","120","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H45 Fe P2 Si -","- C40 H45 Fe P2 Si -","- C80 H90 Fe2 P4 Si2 -","2","1","","Paul Hamon; Frederic Justaud; Olivier Cador; Philippe Hapiot; Stéphane Rigaut; Loïc Toupet; Lahcène Ouahab; Harald Stueger; Jean-René Hamon; Claude Lapinte","Redox-Active Organometallics: Magnetic and Electronic Couplings through Carbon-Silicon Hybrid Molecular Connectors","Journal of the American Chemical Society","2008","130","","17372","17383","10.1021/ja804608z","","","0.71069","MoKα","","0.0944","0.0578","","","0.1503","0.18","","","","","","1.044","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108864","44.817","0.003","44.817","0.003","25.2047","0.0016","90","","90","","90","","50625","6","100","2","100","2","","","","","","","synthesis as described","5","I 41/a :2","-I 4ad","88","","","","- C88.66667 H107.33333 Fe2 P4 Si4 -","- C88.6667 H107.333 Fe2 P4 Si4 -","- C2128 H2576 Fe48 P96 Si96 -","24","1.5","","Paul Hamon; Frederic Justaud; Olivier Cador; Philippe Hapiot; Stéphane Rigaut; Loïc Toupet; Lahcène Ouahab; Harald Stueger; Jean-René Hamon; Claude Lapinte","Redox-Active Organometallics: Magnetic and Electronic Couplings through Carbon-Silicon Hybrid Molecular Connectors","Journal of the American Chemical Society","2008","130","","17372","17383","10.1021/ja804608z","","x-ray","0.71073","MoKα","","0.089","0.0632","","","0.1305","0.1422","","","","","","1.063","","","","has coordinates","264242","2021-04-16","08:51:53",""
"4108865","23.907","0.005","12.136","0.002","19.718","0.004","90","","120.5","0.03","90","","4929","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H84 F K O6 Si6 -","- C36 H84 F K O6 Si6 -","- C144 H336 F4 K4 O24 Si24 -","4","0.5","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Formation of Formal Disilene Fluoride Adducts","Journal of the American Chemical Society","2008","130","","17460","17470","10.1021/ja805753d","","","0.71073","MoKα","","0.1069","0.0944","","","0.2264","0.2362","","","","","","1.053","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108866","10.7","0.002","11.556","0.002","12.86","0.003","103.33","0.03","93.43","0.03","97.87","0.03","1525.8","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H108 F K O6 Si6 -","- C48 H108 F K O6 Si6 -","- C48 H108 F K O6 Si6 -","1","0.5","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Formation of Formal Disilene Fluoride Adducts","Journal of the American Chemical Society","2008","130","","17460","17470","10.1021/ja805753d","","","0.71073","MoKα","","0.0536","0.0472","","","0.1293","0.1347","","","","","","1.04","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108867","20.967","0.004","8.2457","0.0016","20.565","0.004","90","","108.63","0.03","90","","3369.1","1.3","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H60 Si6 -","- C24 H60 Si6 -","- C96 H240 Si24 -","4","0.5","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Formation of Formal Disilene Fluoride Adducts","Journal of the American Chemical Society","2008","130","","17460","17470","10.1021/ja805753d","","","0.71073","MoKα","","0.0489","0.0467","","","0.1062","0.1074","","","","","","1.25","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108868","10.041","0.002","16.881","0.003","20.115","0.004","90","","100.84","0.03","90","","3348.7","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H51 F Si9 -","- C17 H51 F Si9 -","- C68 H204 F4 Si36 -","4","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Formation of Formal Disilene Fluoride Adducts","Journal of the American Chemical Society","2008","130","","17460","17470","10.1021/ja805753d","","","0.71073","MoKα","","0.071","0.0512","","","0.1279","0.1382","","","","","","1.027","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108869","20.354","0.003","6.2351","0.001","28.492","0.004","90","","94.193","0.003","90","","3606.2","0.9","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H44 Cu N4 O11 -","- C35 H44 Cu N4 O11 -","- C140 H176 Cu4 N16 O44 -","4","0.5","","Chun-Long Chen; Alicia M. Beatty","Guest Inclusion and Structural Dynamics in 2-D Hydrogen-Bonded Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","17222","17223","10.1021/ja806180z","","","0.71073","MoKα","","0.0809","0.0408","","","0.0901","0.1077","","","","","","1.013","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108870","20.36","0.009","6.236","0.003","27.844","0.012","90","","94.643","0.008","90","","3524","3","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H38 Cl2 Cu N4 O10 -","- C33 H38 Cl2 Cu N4 O11 -","- C132 H152 Cl8 Cu4 N16 O44 -","4","0.5","","Chun-Long Chen; Alicia M. Beatty","Guest Inclusion and Structural Dynamics in 2-D Hydrogen-Bonded Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","17222","17223","10.1021/ja806180z","","","0.71073","MoKα","","0.0704","0.0379","","","0.0811","0.0961","","","","","","1.008","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108871","20.38","0.004","6.2728","0.0011","28.11","0.005","90","","94.406","0.003","90","","3583","1.1","233","2","233","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H38 Br2 Cu N4 O11 -","- C33 H38 Br2 Cu N4 O11 -","- C132 H152 Br8 Cu4 N16 O44 -","4","0.5","","Chun-Long Chen; Alicia M. Beatty","Guest Inclusion and Structural Dynamics in 2-D Hydrogen-Bonded Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","17222","17223","10.1021/ja806180z","","","0.71073","MoKα","","0.091","0.0405","","","0.0903","0.1165","","","","","","1.006","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108872","6.188","0.0012","10.503","0.002","14.439","0.003","93.123","0.004","101.632","0.004","103.734","0.003","887.7","0.3","233","2","233","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H38 Cl2 Cu N4 O13 -","- C32 H38 Cl2 Cu N4 O13 -","- C32 H38 Cl2 Cu N4 O13 -","1","0.5","","Chun-Long Chen; Alicia M. Beatty","Guest Inclusion and Structural Dynamics in 2-D Hydrogen-Bonded Metal-Organic Frameworks","Journal of the American Chemical Society","2008","130","","17222","17223","10.1021/ja806180z","","","0.71073","MoKα","","0.0837","0.0517","","","0.1341","0.1528","","","","","","1.023","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108873","19.5991","0.0009","17.4575","0.0009","21.7621","0.0012","90","","90","","90","","7445.9","0.7","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H25 B F20 O Si -","- C34 H25 B F20 O Si -","- C272 H200 B8 F160 O8 Si8 -","8","1","","Jian Yang; Peter S. White; Maurice Brookhart","Scope and Mechanism of the Iridium-Catalyzed Cleavage of Alkyl Ethers with Triethylsilane","Journal of the American Chemical Society","2008","130","","17509","17518","10.1021/ja806419h","","","0.71073","MoKα","","0.0687","0.0522","","","0.1414","0.1498","","","","","","1.082","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108874","17.1612","0.0011","13.5228","0.0009","19.0358","0.0011","90","","112.152","0.001","90","","4091.5","0.4","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H56 N4 U -","- C48 H56 N4 U -","- C192 H224 N16 U4 -","4","0.5","","Thibault Cantat; Christopher R. Graves; Kimberly C. Jantunen; Carol J. Burns; Brian L. Scott; Eric J. Schelter; David E. Morris; P. Jeffrey Hay; Jaqueline L. Kiplinger","Evidence for the Involvement of 5f Orbitals in the Bonding and Reactivity of Organometallic Actinide Compounds: Thorium(IV) and Uranium(IV) Bis(hydrazonato) Complexes","Journal of the American Chemical Society","2008","130","","17537","17551","10.1021/ja8067287","","","0.71073","MoKα","","0.1014","0.0739","","","0.1648","0.1778","","","","","","1.152","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108875","10.247","0.005","13.04","0.005","19.791","0.008","108.167","0.012","99.161","0.009","96.479","0.009","2443.1","1.8","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H64 N4 U -","- C60 H64 N4 U -","- C120 H128 N8 U2 -","2","1","","Thibault Cantat; Christopher R. Graves; Kimberly C. Jantunen; Carol J. Burns; Brian L. Scott; Eric J. Schelter; David E. Morris; P. Jeffrey Hay; Jaqueline L. Kiplinger","Evidence for the Involvement of 5f Orbitals in the Bonding and Reactivity of Organometallic Actinide Compounds: Thorium(IV) and Uranium(IV) Bis(hydrazonato) Complexes","Journal of the American Chemical Society","2008","130","","17537","17551","10.1021/ja8067287","","","0.71073","MoKα","","0.1867","0.1224","","","0.221","0.2477","","","","","","1.045","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108876","10.185","0.003","13.049","0.004","19.65","0.005","108.229","0.005","99.175","0.004","96.147","0.005","2414.2","1.2","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H64 N4 Th -","- C60 H64 N4 Th -","- C120 H128 N8 Th2 -","2","1","","Thibault Cantat; Christopher R. Graves; Kimberly C. Jantunen; Carol J. Burns; Brian L. Scott; Eric J. Schelter; David E. Morris; P. Jeffrey Hay; Jaqueline L. Kiplinger","Evidence for the Involvement of 5f Orbitals in the Bonding and Reactivity of Organometallic Actinide Compounds: Thorium(IV) and Uranium(IV) Bis(hydrazonato) Complexes","Journal of the American Chemical Society","2008","130","","17537","17551","10.1021/ja8067287","","","0.71073","MoKα","","0.0676","0.0604","","","0.1657","0.1714","","","","","","1.508","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108877","17.104","0.005","19.452","0.005","13.778","0.004","90","","101.422","0.004","90","","4493","2","203","2","203","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C51 H63 N4 Th -","- C51 H63 N4 Th -","- C204 H252 N16 Th4 -","4","1","","Thibault Cantat; Christopher R. Graves; Kimberly C. Jantunen; Carol J. Burns; Brian L. Scott; Eric J. Schelter; David E. Morris; P. Jeffrey Hay; Jaqueline L. Kiplinger","Evidence for the Involvement of 5f Orbitals in the Bonding and Reactivity of Organometallic Actinide Compounds: Thorium(IV) and Uranium(IV) Bis(hydrazonato) Complexes","Journal of the American Chemical Society","2008","130","","17537","17551","10.1021/ja8067287","","","0.71073","MoKα","","0.0461","0.0357","","","0.0907","0.0946","","","","","","1.262","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108878","39.276","0.011","10.45","0.003","16.202","0.004","90","","99.043","0.006","90","","6567","3","141","2","141","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H46 Hf N2 -","- C35 H46 Hf N2 -","- C280 H368 Hf8 N16 -","8","1","","Thibault Cantat; Christopher R. Graves; Kimberly C. Jantunen; Carol J. Burns; Brian L. Scott; Eric J. Schelter; David E. Morris; P. Jeffrey Hay; Jaqueline L. Kiplinger","Evidence for the Involvement of 5f Orbitals in the Bonding and Reactivity of Organometallic Actinide Compounds: Thorium(IV) and Uranium(IV) Bis(hydrazonato) Complexes","Journal of the American Chemical Society","2008","130","","17537","17551","10.1021/ja8067287","","","0.71073","MoKα","","0.106","0.0717","","","0.1111","0.1197","","","","","","1.171","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108879","14.8257","0.0016","14.8278","0.0016","16.7187","0.0018","90","","90","","90","","3675.3","0.7","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C35 H42 Fe N6 O3 S2 -","- C35 H42 Fe N6 O3 S2 -","- C140 H168 Fe4 N24 O12 S8 -","4","1","","Gregory J. Halder; Karena W. Chapman; Suzanne M. Neville; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Elucidating the Mechanism of a Two-Step Spin Transition in a Nanoporous Metal-Organic Framework","Journal of the American Chemical Society","2008","130","","17552","17562","10.1021/ja8068038","","","0.71073","MoKα","","0.0755","0.0734","","","0.1622","0.1641","","","","","","1.163","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108880","15.114","0.003","15.101","0.003","16.842","0.003","90","","90","","90","","3844","1.3","150","2","150","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C35 H42 Fe N6 O3 S2 -","- C35 H42 Fe N6 O3 S2 -","- C140 H168 Fe4 N24 O12 S8 -","4","1","","Gregory J. Halder; Karena W. Chapman; Suzanne M. Neville; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Elucidating the Mechanism of a Two-Step Spin Transition in a Nanoporous Metal-Organic Framework","Journal of the American Chemical Society","2008","130","","17552","17562","10.1021/ja8068038","","","0.71073","MoKα","","0.0985","0.0865","","","0.1712","0.1782","","","","","","1.151","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108881","14.8646","0.0018","14.9069","0.0018","16.747","0.002","90","","90","","90","","3710.9","0.8","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C35 H42 Fe N6 O3 S2 -","- C35 H42 Fe N6 O3 S2 -","- C140 H168 Fe4 N24 O12 S8 -","4","1","","Gregory J. Halder; Karena W. Chapman; Suzanne M. Neville; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Elucidating the Mechanism of a Two-Step Spin Transition in a Nanoporous Metal-Organic Framework","Journal of the American Chemical Society","2008","130","","17552","17562","10.1021/ja8068038","","","0.71073","MoKα","","0.1027","0.0777","","","0.17","0.1843","","","","","","1.145","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108882","14.739","0.004","14.739","0.004","16.662","0.009","90","","90","","90","","3620","2","25","2","25","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C35 H42 Fe N6 O3 S2 -","- C35 H42 Fe N6 O3 S2 -","- C140 H168 Fe4 N24 O12 S8 -","4","0.5","","Gregory J. Halder; Karena W. Chapman; Suzanne M. Neville; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Elucidating the Mechanism of a Two-Step Spin Transition in a Nanoporous Metal-Organic Framework","Journal of the American Chemical Society","2008","130","","17552","17562","10.1021/ja8068038","","","0.71073","MoKα","","0.1192","0.0809","","","0.2043","0.2378","","","","","","1.098","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108883","9.0431","0.0002","9.3052","0.0002","21.7992","0.0002","90","","90","","90","","1834.36","0.06","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","(+)-(S)-(E)-1-(2-(methylthio)phenyl)-2-styrylhexan-1-one","","- C21 H24 O S -","- C21 H24 O S -","- C84 H96 O4 S4 -","4","1","","James D. Osborne; Helen E. Randell-Sly; Gordon S. Currie; Andrew R. Cowley; Michael C. Willis","Catalytic Enantioselective Intermolecular Hydroacylation: Rhodium-Catalyzed Combination of β-S-Aldehydes and 1,3-Disubstituted Allenes","Journal of the American Chemical Society","2008","130","","17232","17233","10.1021/ja8069133","","","0.71073","MoKα","","0.0339","0.03","","0.0387","0.0348","0.0348","","","","","","1.0792","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108884","10.9542","0.0012","13.6868","0.0017","32.04","0.004","90","","90","","90","","4803.7","1","143","1","143","1","","","","","","","","4","I 2 2 2","I 2 2","23","","","","- C20 H20 N2 O9 -","- C20 H20 N2 O9 -","- C160 H160 N16 O72 -","8","1","","Xiaobo Wan; Madeleine M. Joullié","Enantioselective Total Syntheses of Trichodermamides A and B","Journal of the American Chemical Society","2008","130","","17236","17237","10.1021/ja807011b","","","0.71073","MoKα","","0.0593","0.0531","","","0.1357","0.1417","","","","","","1.09","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108885","25.485","0.004","25.485","0.004","24.7823","0.0018","90","","90","","90","","16096","4","150","2","120","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C36 H44 N4 O12 Ru2 -","- C36 H44 N4 O12 Ru2 -","- C576 H704 N64 O192 Ru32 -","16","1","","Doyel Kumbhakar; Biprajit Sarkar; Somnath Maji; Shaikh M. Mobin; Jan Fiedler; Francisco A. Urbanos; Reyes Jiménez-Aparicio; Wolfgang Kaim; Goutam Kumar Lahiri","Intramolecular Valence and Spin Interaction in meso and rac Diastereomers of a p-Quinonoid-Bridged Diruthenium Complex","Journal of the American Chemical Society","2008","130","","17575","17583","10.1021/ja807043s","","","0.71073","MoKα","","0.1871","0.0589","","","0.0924","0.1256","","","","","","0.805","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108886","13.3882","0.0003","11.5698","0.0003","28.3154","0.0006","90","","92.939","0.002","90","","4380.25","0.18","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H48 Cl4 N4 O10 Ru2 -","- C38 H48 Cl4 N4 O10 Ru2 -","- C152 H192 Cl16 N16 O40 Ru8 -","4","1","","Doyel Kumbhakar; Biprajit Sarkar; Somnath Maji; Shaikh M. Mobin; Jan Fiedler; Francisco A. Urbanos; Reyes Jiménez-Aparicio; Wolfgang Kaim; Goutam Kumar Lahiri","Intramolecular Valence and Spin Interaction in meso and rac Diastereomers of a p-Quinonoid-Bridged Diruthenium Complex","Journal of the American Chemical Society","2008","130","","17575","17583","10.1021/ja807043s","","","0.71073","MoKα","","0.0494","0.0344","","","0.0727","0.0793","","","","","","1.05","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108887","18.184","0.002","12.2234","0.0014","18.256","0.002","90","","103.438","0.002","90","","3946.7","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","ferric tren(cam)2(1,2-hopo)","","","- C29 H39 Fe K2 N6 O14 -","- C29 H31 Fe K2 N6 O15.421 -","- C116 H124 Fe4 K8 N24 O61.684 -","4","1","","Trisha M. Hoette; Rebecca J. Abergel; Jide Xu; Roland K. Strong; Kenneth N. Raymond","The Role of Electrostatics in Siderophore Recognition by the Immunoprotein Siderocalin1","Journal of the American Chemical Society","2008","130","","17584","17592","10.1021/ja8074665","","","0.7749","synchrotron","","0.0861","0.0621","","","0.1642","0.1797","","","","","","1.048","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108888","17.0423","0.0014","10.1042","0.0008","20.684","0.0017","90","","93.869","0.001","90","","3553.6","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Fe(III) Tren-CAM-(1,2-HOPO)2, K salt","","","- C31 H38 Fe K N8 O11 -","- C30.998 H31.446 Fe K N7.999 O10.999 -","- C123.992 H125.784 Fe4 K4 N31.996 O43.996 -","4","1","","Trisha M. Hoette; Rebecca J. Abergel; Jide Xu; Roland K. Strong; Kenneth N. Raymond","The Role of Electrostatics in Siderophore Recognition by the Immunoprotein Siderocalin1","Journal of the American Chemical Society","2008","130","","17584","17592","10.1021/ja8074665","","","0.7749","synchrotron","","0.091","0.0696","","","0.1868","0.2036","","","","","","1.037","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108889","12.06","0.002","18.281","0.004","13.41","0.003","90","","108.09","0.03","90","","2810.3","1.1","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Fe(III) 1,2-HOPO Complex","","","- C25 H26 Cl2 Fe N7 O9 -","- C25 H22 Cl2 Fe N7 O9 -","- C100 H88 Cl8 Fe4 N28 O36 -","4","1","","Trisha M. Hoette; Rebecca J. Abergel; Jide Xu; Roland K. Strong; Kenneth N. Raymond","The Role of Electrostatics in Siderophore Recognition by the Immunoprotein Siderocalin1","Journal of the American Chemical Society","2008","130","","17584","17592","10.1021/ja8074665","","","0.71073","MoKα","","0.0576","0.0512","","","0.1146","0.1194","","","","","","1.004","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108890","12.7624","0.0002","12.7624","0.0002","17.6291","0.0005","90","","90","","120","","2486.71","0.09","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C24 H44 In N O10 -","- C24 H40 In N O8 -","- C72 H120 In3 N3 O24 -","3","0.5","","Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu","Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials","Journal of the American Chemical Society","2008","130","","17246","17247","10.1021/ja8075692","","","0.71073","MoKα","","0.0548","0.0495","","","0.1454","0.1514","","","","","","1.167","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108891","12.9913","0.0003","12.9913","0.0003","17.3911","0.0011","90","","90","","120","","2541.93","0.18","293","2","293","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C24 H44 In N O10 -","- C24 H40 In N O10 -","- C72 H120 In3 N3 O30 -","3","0.5","","Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu","Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials","Journal of the American Chemical Society","2008","130","","17246","17247","10.1021/ja8075692","","","0.71073","MoKα","","0.0974","0.0688","","","0.1985","0.2157","","","","","","1.073","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108892","12.8708","0.0001","12.8708","0.0001","17.2433","0.0004","90","","90","","120","","2473.79","0.06","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C25 H46 In N O11 -","- C25 H28 In N O10 -","- C75 H84 In3 N3 O30 -","3","0.5","","Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu","Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials","Journal of the American Chemical Society","2008","130","","17246","17247","10.1021/ja8075692","","","0.71073","MoKα","","0.0598","0.0513","","","0.1492","0.1542","","","","","","1.079","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108893","10.4498","0.0005","10.4498","0.0005","31.896","0.002","90","","90","","120","","3016.4","0.3","273","2","273","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C22 H16 Co N2 O4 -","- C22 H16 Co N2 O4 -","- C132 H96 Co6 N12 O24 -","6","1","","Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu","Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials","Journal of the American Chemical Society","2008","130","","17246","17247","10.1021/ja8075692","","","0.71073","MoKα","","0.0519","0.0457","","","0.1225","0.1261","","","","","","1.086","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108894","7.2182","0.0007","12.1753","0.0013","14.1824","0.0015","90","","90","","90","","1246.4","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C40 H72 Ni4 O24 -","- C40 H72 Ni4 O24 -","- C40 H72 Ni4 O24 -","1","0.25","","Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu","Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials","Journal of the American Chemical Society","2008","130","","17246","17247","10.1021/ja8075692","","","0.71073","MoKα","","0.0526","0.0454","","","0.121","0.1256","","","","","","1.038","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108895","7.943","","7.943","","12.8125","0.0002","90","","90","","90","","808.357","0.013","293","2","293","2","","","","","","","","4","P 43","P 4cw","78","","","","- C4 H10 Mg O8 -","- C4 H10 Mg O8 -","- C16 H40 Mg4 O32 -","4","1","","Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu","Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials","Journal of the American Chemical Society","2008","130","","17246","17247","10.1021/ja8075692","","","0.71073","MoKα","","0.0465","0.046","","","0.1261","0.1271","","","","","","1.023","","","","has coordinates","178834","2020-10-21","18:00:00",""
"4108896","21.661","0.003","22.721","0.004","17.128","0.003","90","","90","","90","","8430","2","100","2","100","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- C125 H101 -","- C125 H101 -","- C500 H404 -","4","0.5","","Robert D. Kennedy; Alexander L. Ayzner; Darcy D. Wanger; Christopher T Day; Merissa Halim; Saeed I. Khan; Sarah H. Tolbert; Benjamin J. Schwartz; Yves Rubin","Self-Assembling Fullerenes for Improved Bulk-Heterojunction Photovoltaic Devices","Journal of the American Chemical Society","2008","130","","17290","17292","10.1021/ja807627u","","","0.71073","MoKα","","0.1241","0.0758","","","0.1961","0.2391","","","","","","1.021","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108897","18.298","0.005","17.955","0.005","17.352","0.005","90","","90","","90","","5701","3","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C96 H35 Cl3 -","- C96 H35 Cl3 -","- C384 H140 Cl12 -","4","0.5","","Robert D. Kennedy; Alexander L. Ayzner; Darcy D. Wanger; Christopher T Day; Merissa Halim; Saeed I. Khan; Sarah H. Tolbert; Benjamin J. Schwartz; Yves Rubin","Self-Assembling Fullerenes for Improved Bulk-Heterojunction Photovoltaic Devices","Journal of the American Chemical Society","2008","130","","17290","17292","10.1021/ja807627u","","","0.71073","MoKα","","0.1135","0.0769","","","0.2001","0.2282","","","","","","1.057","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108898","16.469","0.003","18.464","0.003","38.87","0.007","90","","92.545","0.002","90","","11808","4","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C204 H86 -","- C204 H86 -","- C816 H344 -","4","1","","Robert D. Kennedy; Alexander L. Ayzner; Darcy D. Wanger; Christopher T Day; Merissa Halim; Saeed I. Khan; Sarah H. Tolbert; Benjamin J. Schwartz; Yves Rubin","Self-Assembling Fullerenes for Improved Bulk-Heterojunction Photovoltaic Devices","Journal of the American Chemical Society","2008","130","","17290","17292","10.1021/ja807627u","","","0.71073","MoKα","","0.1632","0.064","","","0.1243","0.1643","","","","","","0.969","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108899","16.5493","0.0016","18.5294","0.0018","38.904","0.004","90","","93.169","0.001","90","","11912","2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C101 H39 Cl2 -","- C101 H39 Cl2 -","- C808 H312 Cl16 -","8","2","","Robert D. Kennedy; Alexander L. Ayzner; Darcy D. Wanger; Christopher T Day; Merissa Halim; Saeed I. Khan; Sarah H. Tolbert; Benjamin J. Schwartz; Yves Rubin","Self-Assembling Fullerenes for Improved Bulk-Heterojunction Photovoltaic Devices","Journal of the American Chemical Society","2008","130","","17290","17292","10.1021/ja807627u","","","0.71073","MoKα","","0.1102","0.0794","","","0.214","0.2387","","","","","","1.032","","","","has coordinates,has disorder","178834","2020-10-21","18:00:00",""
"4108900","14.1988","0.0013","18.8417","0.0018","47.797","0.005","90","","93.598","0.001","90","","12762","2","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C212.5 H89.75 Cl3.75 -","- C212.5 H89.75 Cl3.75 -","- C850 H359 Cl15 -","4","1","","Robert D. Kennedy; Alexander L. Ayzner; Darcy D. Wanger; Christopher T Day; Merissa Halim; Saeed I. Khan; Sarah H. Tolbert; Benjamin J. Schwartz; Yves Rubin","Self-Assembling Fullerenes for Improved Bulk-Heterojunction Photovoltaic Devices","Journal of the American Chemical Society","2008","130","","17290","17292","10.1021/ja807627u","","","0.71073","MoKα","","0.1088","0.075","","","0.1916","0.2144","","","","","","1.021","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108901","18.311","0.005","17.969","0.004","17.344","0.005","90","","90","","90","","5707","3","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C96 H34 S2 -","- C96 H34 S2 -","- C384 H136 S8 -","4","0.5","","Robert D. Kennedy; Alexander L. Ayzner; Darcy D. Wanger; Christopher T Day; Merissa Halim; Saeed I. Khan; Sarah H. Tolbert; Benjamin J. Schwartz; Yves Rubin","Self-Assembling Fullerenes for Improved Bulk-Heterojunction Photovoltaic Devices","Journal of the American Chemical Society","2008","130","","17290","17292","10.1021/ja807627u","","","0.71073","MoKα","","0.0838","0.0629","","","0.1705","0.1892","","","","","","1.025","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108902","24.2381","0.0014","17.6005","0.001","19.7867","0.0012","90","","97.222","0.003","90","","8374.1","0.8","90","2","90","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Gd2(C2)@C92.NiOEP.2benzene","","","- C142 H56 Gd2 N4 Ni -","- C143 H56 Gd2 N4 Ni -","- C572 H224 Gd8 N16 Ni4 -","4","0.5","","Hua Yang; Chunxin Lu; Ziyang Liu; Hongxiao Jin; Yuliang Che; Marilyn M. Olmstead; Alan L. Balch","Detection of a Family of Gadolinium-Containing Endohedral Fullerenes and the Isolation and Crystallographic Characterization of One Member as a Metal-Carbide Encapsulated inside a Large Fullerene Cage","Journal of the American Chemical Society","2008","130","","17296","17300","10.1021/ja8078303","","","0.71073","MoKα","","0.1589","0.115","","","0.3151","0.3576","","","","","","1.049","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108903","7.2823","0.0005","8.0024","0.0006","24.632","0.0017","90","","90","","90","","1435.45","0.18","143","1","143","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H15 N O3 S -","- C17 H15 N O3 S -","- C68 H60 N4 O12 S4 -","4","1","","Michael Rommel; Takeo Fukuzumi; Jeffrey W. Bode","Cyclic Ketimines as Superior Electrophiles for NHC-Catalyzed Homoenolate Additions with Broad Scope and Low Catalyst Loadings","Journal of the American Chemical Society","2008","130","","17266","17267","10.1021/ja807937m","","","0.71073","MoKα","","0.048","0.0442","","","0.1184","0.1215","","","","","","1.122","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108904","16.6026","0.0013","17.9592","0.0013","12.9034","0.001","90","","108.505","0.002","90","","3648.5","0.5","143","1","143","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H17 N O3 S -","- C22 H17 N O3 S -","- C176 H136 N8 O24 S8 -","8","2","","Michael Rommel; Takeo Fukuzumi; Jeffrey W. Bode","Cyclic Ketimines as Superior Electrophiles for NHC-Catalyzed Homoenolate Additions with Broad Scope and Low Catalyst Loadings","Journal of the American Chemical Society","2008","130","","17266","17267","10.1021/ja807937m","","","0.71073","MoKα","","0.0562","0.0426","","","0.0992","0.1098","","","","","","1.067","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108905","23.8435","0.0011","29.5489","0.0014","27.5426","0.0013","90","","100.932","0.001","90","","19053","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C134.5 H193 Cs0.46 Ga6 O55 -","- C134.1 H128.75 Cs0.46 Ga6 O55.02 -","- C536.4 H515 Cs1.84 Ga24 O220.08 -","4","1","","Ping Jin; Scott J. Dalgarno; Charles Barnes; Simon J. Teat; Jerry L. Atwood","Ion Transport to the Interior of Metal-Organic Pyrogallol[4]arene Nanocapsules","Journal of the American Chemical Society","2008","130","","17262","17263","10.1021/ja807983t","","","0.7749","synchrotron","","0.1011","0.0834","","","0.237","0.245","","","","","","1.718","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108906","21.96","0.004","22.811","0.005","24.091","0.005","110.92","0.03","106.34","0.03","107.66","0.03","9657","6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C149.25 H217.75 Ag0.5 Ga6 N3.75 O59 -","- C150.25 H169 Ag0.5 Ga6 N3.75 O59 -","- C300.5 H338 Ag Ga12 N7.5 O118 -","2","1","","Ping Jin; Scott J. Dalgarno; Charles Barnes; Simon J. Teat; Jerry L. Atwood","Ion Transport to the Interior of Metal-Organic Pyrogallol[4]arene Nanocapsules","Journal of the American Chemical Society","2008","130","","17262","17263","10.1021/ja807983t","","","0.71073","MoKα","","0.1259","0.0845","","","0.251","0.2943","","","","","","1.04","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4108907","13.181","0.002","5.5982","0.001","23.583","0.004","90","","104.2","0.012","90","","1687","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Br O2 -","- C21 H15 Br O2 -","- C84 H60 Br4 O8 -","4","1","","Eun Ju Park; Seok Hwan Kim; Sukbok Chang","Copper-Catalyzed Reaction of α-Aryldiazoesters with Terminal Alkynes: A Formal [3 + 2] Cycloaddition Route Leading to Indene Derivatives","Journal of the American Chemical Society","2008","130","","17268","17269","10.1021/ja808080h","","","0.71073","MoKα","","0.1187","0.0694","","","0.1931","0.2363","","","","","","1.042","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108908","14.2828","0.0015","13.3695","0.0014","13.3018","0.0014","90","","94.94","0.001","90","","2530.6","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 Ni P2 -","- C26 H40 Ni P2 -","- C104 H160 Ni4 P8 -","4","1","","Samuel A. Johnson; Carla W. Huff; Ferheen Mustafa; Mark Saliba","Unexpected Intermediates and Products in the C-F Bond Activation of Tetrafluorobenzenes with a Bis(triethylphosphine)Nickel Synthon: Direct Evidence of a Rapid and Reversible C-H Bond Activation by Ni(0)","Journal of the American Chemical Society","2008","130","","17278","17280","10.1021/ja8081395","","","0.71073","MoKα","","0.0319","0.0278","","","0.071","0.0736","","","","","","1.05","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108909","13.4517","0.0019","22.128","0.003","14.872","0.002","90","","94.924","0.002","90","","4410.5","1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H64 F8 Ni2 P4 -","- C36.029 H62.045 F8 Ni2 P4 -","- C144.116 H248.18 F32 Ni8 P16 -","4","1","","Samuel A. Johnson; Carla W. Huff; Ferheen Mustafa; Mark Saliba","Unexpected Intermediates and Products in the C-F Bond Activation of Tetrafluorobenzenes with a Bis(triethylphosphine)Nickel Synthon: Direct Evidence of a Rapid and Reversible C-H Bond Activation by Ni(0)","Journal of the American Chemical Society","2008","130","","17278","17280","10.1021/ja8081395","","","0.71073","MoKα","","0.05","0.0432","","","0.1101","0.1154","","","","","","1.112","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108910","11.015","0.003","11.65","0.003","17.577","0.005","83.474","0.003","72.775","0.004","65.177","0.002","1955.2","0.9","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H62 O9 Si2 -","- C32 H62 O9 Si2 -","- C64 H124 O18 Si4 -","2","1","","David A. Nicewicz; Andrew D. Satterfield; Daniel C. Schmitt; Jeffrey S. Johnson","Self-Consistent Synthesis of the Squalene Synthase Inhibitor Zaragozic Acid C via Controlled Oligomerization","Journal of the American Chemical Society","2008","130","","17281","17283","10.1021/ja808347q","","","0.71073","MoKα","","0.0628","0.0485","","","0.1189","0.1307","","","","","","1.028","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108911","11.454","0.0003","37.1782","0.0011","12.5431","0.0004","90","","108.349","0.002","90","","5069.8","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H76 O12 Si3 -","- C43 H76 O12 Si3 -","- C172 H304 O48 Si12 -","4","1","","David A. Nicewicz; Andrew D. Satterfield; Daniel C. Schmitt; Jeffrey S. Johnson","Self-Consistent Synthesis of the Squalene Synthase Inhibitor Zaragozic Acid C via Controlled Oligomerization","Journal of the American Chemical Society","2008","130","","17281","17283","10.1021/ja808347q","","","0.71073","MoKα","","0.0545","0.041","","","0.0958","0.1032","","","","","","1.022","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108912","9.6923","0.0005","9.4608","0.0004","15.6706","0.0007","90","","93.158","0.002","90","","1434.76","0.12","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H35 N4 O7.5 -","- C29 H35 N4 O7.5 -","- C58 H70 N8 O15 -","2","1","","Panchami Prabhakaran; Sangram S. Kale; Vedavati G. Puranik; P. R. Rajamohanan; Olga Chetina; Judith A. K. Howard; Hans-Jörg Hofmann; Gangadhar J. Sanjayan","Sequence-Specific Unusual (1\ρightarrow2)-Type Helical Turns in α/β-Hybrid Peptides","Journal of the American Chemical Society","2008","130","","17743","17754","10.1021/ja804297f","","","0.71073","Mo-Kα","","0.0738","0.0429","","","0.0949","0.1058","","","","","","0.96","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108913","15.219","0.001","9.4069","0.0006","16.2675","0.0011","90","","101.44","0.001","90","","2282.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","peptide","","","- C23 H28 N4 O5 -","- C23 H28 N4 O5 -","- C92 H112 N16 O20 -","4","1","","Panchami Prabhakaran; Sangram S. Kale; Vedavati G. Puranik; P. R. Rajamohanan; Olga Chetina; Judith A. K. Howard; Hans-Jörg Hofmann; Gangadhar J. Sanjayan","Sequence-Specific Unusual (1\ρightarrow2)-Type Helical Turns in α/β-Hybrid Peptides","Journal of the American Chemical Society","2008","130","","17743","17754","10.1021/ja804297f","","","0.71073","MoKα","","0.0565","0.0433","","","0.1039","0.1128","","","","","","1.055","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108914","10.1637","0.0006","15.6505","0.0008","15.0116","0.0009","90","","90","","90","","2387.8","0.2","273","2","273","2","","","","","","","","4","P n a 21","P 2c -2n","33","peptide","","","- C24 H29 N3 O6 -","- C24 H29 N3 O6 -","- C96 H116 N12 O24 -","4","1","","Panchami Prabhakaran; Sangram S. Kale; Vedavati G. Puranik; P. R. Rajamohanan; Olga Chetina; Judith A. K. Howard; Hans-Jörg Hofmann; Gangadhar J. Sanjayan","Sequence-Specific Unusual (1\ρightarrow2)-Type Helical Turns in α/β-Hybrid Peptides","Journal of the American Chemical Society","2008","130","","17743","17754","10.1021/ja804297f","","","0.71073","MoKα","","0.0427","0.0354","","","0.0821","0.0863","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108915","10.8666","0.001","16.478","0.003","24.053","0.002","90","","90","","90","","4306.9","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","peptide","","","- C20 H28 N4 O5 -","- C20 H28 N4 O5 -","- C160 H224 N32 O40 -","8","1","","Panchami Prabhakaran; Sangram S. Kale; Vedavati G. Puranik; P. R. Rajamohanan; Olga Chetina; Judith A. K. Howard; Hans-Jörg Hofmann; Gangadhar J. Sanjayan","Sequence-Specific Unusual (1\ρightarrow2)-Type Helical Turns in α/β-Hybrid Peptides","Journal of the American Chemical Society","2008","130","","17743","17754","10.1021/ja804297f","","","0.71073","MoKα","","0.1348","0.0768","","","0.1355","0.1555","","","","","","1.108","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108916","11.0377","0.0004","18.4948","0.0008","25.2391","0.0007","90","","90","","90","","5152.3","0.3","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C101 H22 N Sc3 -","- C101 H22 N Sc3 -","- C404 H88 N4 Sc12 -","4","0.5","","Chunying Shu; Carla Slebodnick; Liaosa Xu; Hunter Champion; Tim Fuhrer; Ting Cai; Jonathan E. Reid; Wujun Fu; Kim Harich; Harry C. Dorn; Harry W. Gibson","Highly Regioselective Derivatization of Trimetallic Nitride Templated Endohedral Metallofullerenes via a Facile Photochemical Reaction","Journal of the American Chemical Society","2008","130","","17755","17760","10.1021/ja804909t","","x-ray","1.54178","CuKα","","0.1738","0.1281","","","0.3527","0.3839","","","","","","1.329","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108917","13.469","0.003","14.537","0.003","28.83","0.006","90","","90","","90","","5645","2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C47 H75 Ce N16 O12 -","- C47 H66 Ce N16 O12 -","- C188 H264 Ce4 N64 O48 -","4","1","","Janusz Gregoliński; Przemysław Starynowicz; KimNgan T. Hua; Jamie L. Lunkley; Gilles Muller; Jerzy Lisowski","Helical Lanthanide(III) Complexes with Chiral Nonaaza Macrocycle","Journal of the American Chemical Society","2008","130","","17761","17773","10.1021/ja805033j","","","0.71073","MoKα","","0.0678","0.0502","","","0.1145","0.1225","","","","","","1.077","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108918","14.982","0.004","14.982","0.004","38.92","0.02","90","","90","","120","","7566","5","100","2","100","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C42.75 H70.13 Lu N13.88 O12.75 -","- C42.75 H60 Lu N13.875 O12.75 -","- C256.5 H360 Lu6 N83.25 O76.5 -","6","1","","Janusz Gregoliński; Przemysław Starynowicz; KimNgan T. Hua; Jamie L. Lunkley; Gilles Muller; Jerzy Lisowski","Helical Lanthanide(III) Complexes with Chiral Nonaaza Macrocycle","Journal of the American Chemical Society","2008","130","","17761","17773","10.1021/ja805033j","","","0.71073","MoKα","","0.0647","0.0413","","","0.0715","0.0748","","","","","","0.991","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108919","13.486","0.008","14.542","0.008","28.702","0.017","90","","90","","90","","5629","6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C45 H73.33 N15 O12.67 Pr -","- C45 H63 N15 O12.65 Pr -","- C180 H252 N60 O50.6 Pr4 -","4","1","","Janusz Gregoliński; Przemysław Starynowicz; KimNgan T. Hua; Jamie L. Lunkley; Gilles Muller; Jerzy Lisowski","Helical Lanthanide(III) Complexes with Chiral Nonaaza Macrocycle","Journal of the American Chemical Society","2008","130","","17761","17773","10.1021/ja805033j","","","0.71073","MoKα","","0.0815","0.059","","","0.1333","0.1408","","","","","","1.037","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108920","7.1413","0.0002","7.1413","0.0002","22.1101","0.0011","90","","90","","90","","1127.57","0.07","150","","150","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","","","- H14 Na2 O11 S -","- H12 Na2 O11 S -","- H48 Na8 O44 S4 -","4","0.125","","Iain D. H. Oswald; Andrea Hamilton; Christopher Hall; William G. Marshall; Timothy J. Prior; Colin R. Pulham","In Situ Characterization of Elusive Salt Hydrates-The Crystal Structures of the Heptahydrate and Octahydrate of Sodium Sulfate","Journal of the American Chemical Society","2008","130","","17795","17800","10.1021/ja805429m","","","0.71073","MoKα","","0.0432","0.041","","0.119","0.1156","0.119","","","","","","1.0089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108921","7.8865","0.0014","8.096","0.008","8.2521","0.0013","85.73","0.03","86.239","0.015","88.59","0.03","524.2","0.5","293","","293","","","","","","","","","4","P -1","-P 1","2","","Sodium sulfate octahydrate","","- H16 Na2 O12 S -","- H16 Na2 O12 S -","- H32 Na4 O24 S2 -","2","1","","Iain D. H. Oswald; Andrea Hamilton; Christopher Hall; William G. Marshall; Timothy J. Prior; Colin R. Pulham","In Situ Characterization of Elusive Salt Hydrates-The Crystal Structures of the Heptahydrate and Octahydrate of Sodium Sulfate","Journal of the American Chemical Society","2008","130","","17795","17800","10.1021/ja805429m","","","0.7977","","","0.0803","0.0725","","0.2018","0.1914","0.2018","","","","","","0.9343","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108922","18.2094","0.0009","10.8327","0.0005","24.9242","0.0012","90","","97.916","0.002","90","","4869.6","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H51 B Cu N4 O2 -","- C62 H51 B Cu N4 O2 -","- C248 H204 B4 Cu4 N16 O8 -","4","1","","Bringmann, Gerhard; Götz, Daniel C. G.; Gulder, Tobias A. M.; Gehrke, Tim H.; Bruhn, Torsten; Kupfer, Thomas; Radacki, Krzysztof; Braunschweig, Holger; Heckmann, Alexander; Lambert, Christoph","Axially Chiral β,β'-Bisporphyrins: Synthesis and Configurational Stability Tuned by the Central Metals","Journal of the American Chemical Society","2008","130","52","17812","17825","10.1021/ja8055886","","","0.71073","MoKα","","0.0905","0.0605","","","0.1451","0.1588","","","","","","1.072","","","","has coordinates","218554","2020-10-21","18:00:00",""
"4108923","13.0576","0.0011","14.7944","0.0011","18.9761","0.0015","96.118","0.004","90.411","0.004","106.267","0.004","3496.4","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Bisporphirin","Bis(5,10,15,20-tetraphenyl-porphirin)","","- C94.45 H72.9 Cl0.9 N8 -","- C94.45 H72.9 Cl0.9 N8 -","- C188.9 H145.8 Cl1.8 N16 -","2","1","","Bringmann, Gerhard; Götz, Daniel C. G.; Gulder, Tobias A. M.; Gehrke, Tim H.; Bruhn, Torsten; Kupfer, Thomas; Radacki, Krzysztof; Braunschweig, Holger; Heckmann, Alexander; Lambert, Christoph","Axially Chiral β,β'-Bisporphyrins: Synthesis and Configurational Stability Tuned by the Central Metals","Journal of the American Chemical Society","2008","130","52","17812","17825","10.1021/ja8055886","","","0.71073","MoKα","","0.1017","0.0657","","","0.1578","0.1819","","","","","","1.019","","","","has coordinates,has disorder","218554","2020-10-21","18:00:00",""
"4108924","25.63","0.01","14.784","0.005","17.845","0.007","90","","104.92","0.03","90","","6534","4","223.2","","223.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C76 H56 Cl4 N4 O4 Ti2 -","- C76 H56 Cl4 N4 O4 Ti2 -","- C304 H224 Cl16 N16 O16 Ti8 -","4","1","","Hiroshi Terao; Seiichi Ishii; Makoto Mitani; Hidetsugu Tanaka; Terunori Fujita","Ethylene/Polar Monomer Copolymerization Behavior of Bis(phenoxy-imine)Ti Complexes: Formation of Polar Monomer Copolymers","Journal of the American Chemical Society","2008","130","","17636","17637","10.1021/ja8060479","","","0.7107","MoKα","","0.0399","0.0399","","","0.1116","0.1116","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108925","9.577","0.005","10.375","0.005","10.732","0.005","72.994","0.01","64.54","0.01","63.238","0.009","853.2","0.7","190","","190","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1523","0.0963","","","0.1768","0.1973","","","","","","0.998","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108926","9.592","0.008","10.367","0.009","10.719","0.01","73.593","0.019","64.801","0.016","63.501","0.016","857.5","1.3","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1273","0.0657","","","0.1404","0.1756","","","","","","0.921","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108927","9.59","0.004","10.4","0.004","10.662","0.004","73.683","0.008","64.414","0.008","63.524","0.007","853.4","0.6","130","","130","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.0976","0.0724","","","0.1758","0.1899","","","","","","1.01","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108928","9.572","0.004","10.344","0.004","10.624","0.004","73.647","0.008","64.336","0.009","63.412","0.007","842.8","0.6","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1119","0.0778","","","0.184","0.2074","","","","","","1.057","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108929","9.526","0.004","10.303","0.004","10.582","0.004","73.816","0.009","64.365","0.007","63.509","0.007","833.3","0.6","70","","70","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1758","0.1127","","","0.2591","0.2988","","","","","","1.003","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108930","9.563","0.002","10.323","0.002","10.508","0.002","74.815","0.004","64.134","0.004","63.786","0.004","834.3","0.3","40","","40","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.0827","0.051","","","0.0999","0.1272","","","","","","1.009","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108931","9.5572","0.0019","10.297","0.002","10.488","0.002","74.913","0.004","64.108","0.004","63.757","0.004","829.9","0.3","20","","20","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","- C32 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1062","0.0639","","","0.1214","0.1498","","","","","","1.034","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108932","18.892","0.009","9.621","0.005","12.451","0.006","90","","129.508","0.009","90","","1746.1","1.5","150","","150","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C33 H26 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","- C66 H46 N4 O28 Rh4 -","2","0.25","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1289","0.0768","","","0.1783","0.217","","","","","","0.93","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108933","18.881","0.006","9.61","0.003","12.479","0.004","90","","129.747","0.005","90","","1740.9","1","130","","130","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C33 H26 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","- C66 H46 N4 O28 Rh4 -","2","0.25","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1402","0.089","","","0.2274","0.2649","","","","","","0.981","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108934","9.603","0.007","10.58","0.008","10.753","0.009","71.45","0.016","63.831","0.014","63.018","0.015","864.2","1.2","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1561","0.0845","","","0.1835","0.2315","","","","","","0.981","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108935","9.599","0.003","10.531","0.003","10.748","0.004","71.525","0.007","63.5","0.005","62.985","0.006","857.3","0.5","70","","70","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1378","0.0883","","","0.2135","0.246","","","","","","1.095","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108936","9.597","0.005","10.532","0.005","10.624","0.005","72.586","0.009","63.552","0.009","63.392","0.01","852.9","0.7","40","","40","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1491","0.0871","","","0.1898","0.2322","","","","","","0.976","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108937","18.778","0.008","9.615","0.005","12.478","0.006","90","","130.316","0.007","90","","1717.8","1.4","20","","20","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C33 H26 N2 O14 Rh2 -","- C33 H23 N2 O14 Rh2 -","- C66 H46 N4 O28 Rh4 -","2","0.25","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1341","0.0872","","","0.2104","0.2435","","","","","","1.059","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108938","10.1826","0.0013","10.3892","0.0012","15.711","0.0018","79.419","0.002","81.34","0.002","86.149","0.002","1613.8","0.3","10","","10","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 N2 O8 Rh2 -","- C33 H25 N2 O8 Rh2 -","- C66 H50 N4 O16 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nakata; Takamasa Akatsuka; Chihiro Kachi-Terajima; Ryosuke Miyake","Structural and Magnetic Study of O2 Molecules Arranged along a Channel in a Flexible Single-Crystal Host Family","Journal of the American Chemical Society","2008","130","","17882","17892","10.1021/ja806257m","","","0.71073","MoKα","","0.1077","0.0668","","","0.1403","0.1631","","","","","","1.046","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108939","8.7457","0.0007","9.5756","0.0007","31.598","0.002","90","","90","","90","","2646.2","0.3","173","2","173","2","","","","","","","chemical synthesis","5","P 21 21 21","P 2ac 2ab","19","drsenone","(4a<i>S</i>,8a<i>S</i>,9<i>S</i>)-3-(Benzyloxy)-4a-(<i>tert</i>- butyldimethylsilyloxy)-9-(dimethylamino)-8a,9- dihydronaphtho[2,3-<i>d</i>]isoxazole-4,5(4a<i>H</i>,8<i>H</i>)-dione","","- C26 H34 N2 O5 Si -","- C26 H34 N2 O5 Si -","- C104 H136 N8 O20 Si4 -","4","1","","Cuixiang Sun; Qiu Wang; Jason D. Brubaker; Peter M. Wright; Christian D. Lerner; Kevin Noson; Mark Charest; Dionicio R. Siegel; Yi-Ming Wang; Andrew G. Myers","A Robust Platform for the Synthesis of New Tetracycline Antibiotics","Journal of the American Chemical Society","2008","130","","17913","17927","10.1021/ja806629e","","","0.71073","MoKα","","0.0851","0.0531","","","0.0961","0.1077","","","","","","1.005","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108940","13.116","0.003","11.381","0.002","15.075","0.003","90","","97.42","0.005","90","","2231.4","0.8","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C43 H62 N2 O8 Si2 -","- C43 H62 N2 O8 Si2 -","- C86 H124 N4 O16 Si4 -","2","1","","Cuixiang Sun; Qiu Wang; Jason D. Brubaker; Peter M. Wright; Christian D. Lerner; Kevin Noson; Mark Charest; Dionicio R. Siegel; Yi-Ming Wang; Andrew G. Myers","A Robust Platform for the Synthesis of New Tetracycline Antibiotics","Journal of the American Chemical Society","2008","130","","17913","17927","10.1021/ja806629e","","","0.71073","MoKα","","0.1216","0.052","","","0.1028","0.124","","","","","","0.757","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108941","13.5529","0.0012","14.8008","0.0017","14.8937","0.0016","67.953","0.006","64.84","0.008","83.832","0.009","2501.6","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","5-benzyl-3-methyl-4-(triphenylphosphine)gold-furan-2(5H)-one","5-benzyl-3-methyl-4-(triphenylphosphine)gold-furan-2(5H)-one","","- C30 H26 Au O2 P -","- C30 H26 Au O2 P -","- C120 H104 Au4 O8 P4 -","4","2","","Le-Ping Liu; Bo Xu; Mark S. Mashuta; Gerald B. Hammond","Synthesis and Structural Characterization of Stable Organogold(I) Compounds. Evidence for the Mechanism of Gold-Catalyzed Cyclizations","Journal of the American Chemical Society","2008","130","","17642","17643","10.1021/ja806685j","","","0.71073","MoKα","","0.0397","0.0352","","","0.0819","0.0846","","","","","","1.071","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108942","7.4638","0.0015","12.957","0.003","10.29","0.002","90","","100.64","0.03","90","","978","0.4","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H21 Cl N2 S -","- C21 H21 Cl N2 S -","- C42 H42 Cl2 N4 S2 -","2","1","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","0.71073","MoKα","","0.0573","0.0481","","","0.1173","0.1231","","","","","","1.057","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4108943","11.4597","0.0016","11.4597","0.0016","12.611","0.003","90","","90","","120","","1434.3","0.4","296","2","296","2","","","","","","","","5","P 32","P 32","145","","","","- C20 H22 Cl N O2 -","- C20 H22 Cl N O2 -","- C60 H66 Cl3 N3 O6 -","3","1","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","0.71073","MoKα","","0.1203","0.049","","","0.0949","0.114","","","","","","0.984","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108944","9.669","0.0019","13.587","0.003","19.429","0.004","90","","90","","90","","2552.4","0.9","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H35 Cl N2 O5 -","- C25 H35 Cl N2 O5 -","- C100 H140 Cl4 N8 O20 -","4","1","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","0.71073","MoKα","","0.1034","0.0668","","","0.1641","0.187","","","","","","1.018","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108945","10.1296","0.0002","10.1296","0.0002","28.6766","0.001","90","","90","","120","","2548.25","0.11","100","2","100","2","","","","","","","","5","P 31 2 1","P 31 2""","152","3-1B","","","- C40 H46 Cl2 N2 O3 -","- C40 H46 Cl2 N2 O3 -","- C120 H138 Cl6 N6 O9 -","3","0.5","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","1.54178","CuKα","","0.0344","0.0301","","","0.0647","0.0668","","","","","","1.021","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4108946","17.552","0.004","8.9917","0.0018","15.525","0.003","90","","120.61","0.03","90","","2108.8","1","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C23 H25 Cl N O -","- C23 H25 Cl N O -","- C92 H100 Cl4 N4 O4 -","4","1","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","0.71073","MoKα","","0.0906","0.0516","","","0.1124","0.1303","","","","","","1.009","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108947","8.8284","0.0008","10.9857","0.001","9.6627","0.0009","90","","108.057","0.001","90","","890.99","0.14","208","2","208","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H23 N O4 -","- C20 H23 N O4 -","- C40 H46 N2 O8 -","2","1","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","0.71073","MoKα","","0.0437","0.0377","","","0.0877","0.0934","","","","","","1.037","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108948","10.397","0.001","10.6917","0.001","13.8862","0.0013","81.785","0.002","78.731","0.002","88.759","0.002","1498.3","0.2","296","2","296","2","","","","","","","","4","P 1","P 1","1","","","","- C18 H20 N O -","- C18 H20 N O -","- C72 H80 N4 O4 -","4","4","","Jeremy M. Richter; Yoshihiro Ishihara; Takeshi Masuda; Brandon W. Whitefield; Tomás Llamas; Antti Pohjakallio; Phil S. Baran","Enantiospecific Total Synthesis of the Hapalindoles, Fischerindoles, and Welwitindolinones via a Redox Economic Approach","Journal of the American Chemical Society","2008","130","","17938","17954","10.1021/ja806981k","","","0.71073","MoKα","","0.0794","0.0535","","","0.1123","0.1263","","","","","","1.007","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108949","8.386","0.002","36.605","0.007","8.415","0.002","90","","115.806","0.01","90","","2325.5","0.9","110.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O4 Rh2 S2 -","- C88 H136 O16 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.0788","","","","0.2424","","","","","","1.593","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108950","8.355","0.002","36.658","0.008","8.399","0.002","90","","115.26","0.01","90","","2326.5","1","110.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O4.01 Rh2 S2 -","- C88 H136 O16.04 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.0527","","","","0.1025","","","","","","0.959","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108951","8.336","0.002","36.721","0.008","8.429","0.002","90","","115.52","0.01","90","","2328.4","1","110.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O4.02 Rh2 S2 -","- C88 H136 O16.08 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.0391","","","","0.0774","","","","","","0.822","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108952","8.3917","0.0004","36.597","0.001","8.4326","0.0003","90","","115.989","0.001","90","","2327.86","0.15","110.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O4 Rh2 S2 -","- C88 H136 O16 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.0649","","","","0.146","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108953","8.3731","0.0004","36.612","0.002","8.4212","0.0004","90","","115.578","0.002","90","","2328.6","0.2","110.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O3.99 Rh2 S2 -","- C88 H136 O15.96 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.097","","","","0.2347","","","","","","1.157","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108954","8.3595","0.0004","36.647","0.002","8.4252","0.0004","90","","115.441","0.002","90","","2330.8","0.2","110.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O4 Rh2 S2 -","- C88 H136 O16 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.082","","","","0.2268","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108955","8.3631","0.0004","36.664","0.002","8.4047","0.0004","90","","115.262","0.001","90","","2330.6","0.2","110.2","","","","","","","","photo irradiation for 190h at 110K and keep in the dark for 12h at 293K","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O4 Rh2 S2 -","- C88 H136 O16 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.0809","","","","0.2261","","","","","","1.102","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108956","7.147","0.0008","8.8352","0.001","27.978","0.003","90","","90","","90","","1766.7","0.3","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 N O3 S -","- C19 H25 N O3 S -","- C76 H100 N4 O12 S4 -","4","1","","Hiroki Mandai; Kyoko Mandai; Marc L. Snapper; Amir H. Hoveyda","Three-Component Ag-Catalyzed Enantioselective Vinylogous Mannich and Aza-Diels-Alder Reactions with Alkyl-Substituted Aldehydes","Journal of the American Chemical Society","2008","130","","17961","17969","10.1021/ja807243t","","","0.71073","MoKα","","0.0372","0.0358","","","0.0891","0.0903","","","","","","1.067","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108957","8.6986","0.0012","10.158","0.0014","19.095","0.003","90","","90","","90","","1687.2","0.4","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H21 N O3 S -","- C18 H21 N O3 S -","- C72 H84 N4 O12 S4 -","4","1","","Hiroki Mandai; Kyoko Mandai; Marc L. Snapper; Amir H. Hoveyda","Three-Component Ag-Catalyzed Enantioselective Vinylogous Mannich and Aza-Diels-Alder Reactions with Alkyl-Substituted Aldehydes","Journal of the American Chemical Society","2008","130","","17961","17969","10.1021/ja807243t","","","0.71073","MoKα","","0.0351","0.0328","","","0.0778","0.0793","","","","","","1.054","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108958","10.7977","0.0004","11.3149","0.0005","11.9339","0.0005","90","","116.223","0.001","90","","1307.96","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 F N O2 -","- C13 H17 F N O2 -","- C52 H68 F4 N4 O8 -","4","1","","Kanwal J. Singh; Alexander C. Hoepker; David B. Collum","Autocatalysis in Lithium Diisopropylamide-Mediated Ortholithiations","Journal of the American Chemical Society","2008","130","","18008","18017","10.1021/ja807331k","","","0.71073","MoKα","","0.0612","0.0415","","","0.1163","0.1267","","","","","","1.058","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108959","8.7968","0.0004","14.4109","0.0006","10.9609","0.0005","90","","90","","90","","1389.51","0.11","100","2","100","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C12 H28 N2 Pd -","- C12 H28 N2 Pd -","- C48 H112 N8 Pd4 -","4","0.5","","John E. Bercaw; George S. Chen; Jay A. Labinger; Bo-Lin Lin","Hydrogen Tunneling in Protonolysis of Platinum(II) and Palladium(II) Methyl Complexes: Mechanistic Implications","Journal of the American Chemical Society","2008","130","","17654","17655","10.1021/ja807427d","","","0.71073","MoKα","","0.0553","0.0415","","","0.0743","0.0769","","","","","","1.379","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108960","6.9339","0.0003","39.6898","0.0005","7.2585","0.0002","90","","90","","90","","1997.58","0.11","293","2","293","2","","","","","","","synthesis as described","3","P n m a","-P 2ac 2n","62","","E,E-2,7-bis((2-phenyl)-ethenyl)-Benzo[2,1-b:3,4-b']dithiophene","","- C26 H18 S2 -","- C26 H18 S2 -","- C104 H72 S8 -","4","0.5","","Yahia Didane; Georg H. Mehl; Atsufumi Kumagai; Noriyuki Yoshimoto; Christine Videlot-Ackermann; Hugues Brisset","A ""Kite"" Shaped Styryl End-Capped Benzo[2,1-b:3,4-b']dithiophene with High Electrical Performances in Organic Thin Film Transistors","Journal of the American Chemical Society","2008","130","","17681","17683","10.1021/ja807504k","","x-ray","0.71073","MoKα","","0.1034","0.0483","","","0.0984","0.1288","","","","","","1.037","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108961","11.6797","0.0011","32.209","0.003","33.262","0.003","90","","90","","90","","12513","2","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C130 H153 Co4 N8 O9 -","- C130 H153 Co4 N8 O9 -","- C520 H612 Co16 N32 O36 -","4","1","","Wataru Hirahata; Renee M. Thomas; Emil B. Lobkovsky; Geoffrey W. Coates","Enantioselective Polymerization of Epoxides: A Highly Active and Selective Catalyst for the Preparation of Stereoregular Polyethers and Enantiopure Epoxides","Journal of the American Chemical Society","2008","130","","17658","17659","10.1021/ja807709j","","","0.71073","MoKα","","0.0963","0.0496","","","0.092","0.0995","","","","","","0.903","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108962","13.413","0.0016","13.413","0.0016","17.257","0.003","90","","90","","90","","3104.7","0.8","100","2","100","2","","","","","","","","8","P 4 n c","P 4 -2n","104","","","","- C4 H30 I K2 N2 O24 P8 Pt2 -","- C4 H6 I K2 N2 O24 P8 Pt2 -","- C16 H24 I4 K8 N8 O96 P32 Pt8 -","4","0.5","","Hiroaki Iguchi; Shinya Takaishi; Takashi Kajiwara; Hitoshi Miyasaka; Masahiro Yamashita; Hiroyuki Matsuzaki; Hiroshi Okamoto","Mixed Charge-Ordering State of MMX-Type Quasi-One-Dimensional Iodide-Bridged Platinum Complexes with Binary Countercations","Journal of the American Chemical Society","2008","130","","17668","17669","10.1021/ja807901p","","","0.71073","MoKα","","0.0305","0.0233","","","0.056","0.0577","","","","","","0.983","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108963","14.5404","0.0006","15.7053","0.0008","22.1506","0.0014","90","","90","","90","","5058.3","0.5","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H31 Fe O2 P Si -","- C26 H31 Fe O2 P Si -","- C208 H248 Fe8 O16 P8 Si8 -","8","1","","Masaaki Okazaki; Takahiko Yoshitomi; Junpei Naito; Akira Sato; Takashi Komuro; Hiromi Tobita","Recombination of an Fe-Si-P Linkage to an Fe-P-Si Linkage through an Isolable Intermediate Phosphasilaferracyclopropane","Journal of the American Chemical Society","2008","130","","17674","17675","10.1021/ja808443v","","x-ray","0.71069","MoKα","","0.0949","0.0721","","","0.1569","0.1672","","","","","","1.201","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108964","14.7697","0.0004","15.3225","0.0005","11.5537","0.0004","90","","98.5242","0.0007","90","","2585.82","0.14","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H43 Fe O P Si -","- C25 H43 Fe O P Si -","- C100 H172 Fe4 O4 P4 Si4 -","4","1","","Masaaki Okazaki; Takahiko Yoshitomi; Junpei Naito; Akira Sato; Takashi Komuro; Hiromi Tobita","Recombination of an Fe-Si-P Linkage to an Fe-P-Si Linkage through an Isolable Intermediate Phosphasilaferracyclopropane","Journal of the American Chemical Society","2008","130","","17674","17675","10.1021/ja808443v","","x-ray","0.71069","MoKα","","0.0392","0.0321","","","0.0852","0.0932","","","","","","1.244","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108965","8.3642","0.0004","36.67","0.002","8.4039","0.0004","90","","115.267","0.002","90","","2331","0.2","110.2","","","","","","","","photo irradiation for 190h at 110K and keep in the dark for 84h at 293K","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 O4 Rh2 S2 -","- C22 H34 O3.98 Rh2 S2 -","- C88 H136 O15.92 Rh8 S8 -","4","1","","Hidetaka Nakai; Takashi Nonaka; Yousuke Miyano; Motohiro Mizuno; Yoshiki Ozawa; Koshiro Toriumi; Nobuaki Koga; Takanori Nishioka; Masahiro Irie; Kiyoshi Isobe","Photochromism of an Organorhodium Dithionite Complex in the Crystalline-State: Molecular Motion of Pentamethylcyclopentadienyl Ligands Coupled to Atom Rearrangement in a Dithionite Ligand","Journal of the American Chemical Society","2008","130","","17836","17845","10.1021/ja807150a","","","0.7107","MoKα","","","0.0755","","","","0.2092","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111360","11.6465","0.0005","15.8356","0.0006","17.1436","0.0007","90","","97.426","0.001","90","","3135.3","0.2","130","2","130","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C22 H52 Co I N O P2 Si2 -","- C22 H52 Co I N O P2 Si2 -","- C88 H208 Co4 I4 N4 O4 P8 Si8 -","4","1","","Michael J. Ingleson; Maren Pink; Hongjun Fan; Kenneth G. Caulton","Redox Chemistry of the Triplet Complex (PNP)CoI","Journal of the American Chemical Society","2008","130","","4262","4276","10.1021/ja074378+","","","0.71073","MoKα","","0.0686","0.0584","","","0.1459","0.1548","","","","","","1.031","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111361","20.64","0.002","10.7583","0.0013","26.665","0.003","90","","111.952","0.003","90","","5491.7","1.1","130","2","130","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H93 Co N O2 P2 Si2 -","- C51 H93 Co N O2 P2 Si2 -","- C204 H372 Co4 N4 O8 P8 Si8 -","4","1","","Michael J. Ingleson; Maren Pink; Hongjun Fan; Kenneth G. Caulton","Redox Chemistry of the Triplet Complex (PNP)CoI","Journal of the American Chemical Society","2008","130","","4262","4276","10.1021/ja074378+","","","0.71073","MoKα","","0.0634","0.0405","","","0.0991","0.1201","","","","","","1.071","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111362","11.6773","0.0015","17.266","0.002","17.258","0.002","90","","106.482","0.004","90","","3336.6","0.7","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H57 Co N2 P2 Si2 -","- C28 H57 Co N2 P2 Si2 -","- C112 H228 Co4 N8 P8 Si8 -","4","1","","Michael J. Ingleson; Maren Pink; Hongjun Fan; Kenneth G. Caulton","Redox Chemistry of the Triplet Complex (PNP)CoI","Journal of the American Chemical Society","2008","130","","4262","4276","10.1021/ja074378+","","","0.71073","MoKα","","0.0538","0.0352","","","0.083","0.0931","","","","","","1.014","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111363","20.5728","0.0015","15.9323","0.0012","22.9015","0.0017","90","","90.072","0.002","90","","7506.5","1","130","2","130","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H60 Co F6 N2 O P3 Si2 -","- C26 H60 Co F6 N2 O P3 Si2 -","- C208 H480 Co8 F48 N16 O8 P24 Si16 -","8","2","","Michael J. Ingleson; Maren Pink; Hongjun Fan; Kenneth G. Caulton","Redox Chemistry of the Triplet Complex (PNP)CoI","Journal of the American Chemical Society","2008","130","","4262","4276","10.1021/ja074378+","","","0.71073","MoKα","","0.0929","0.0586","","","0.1436","0.1742","","","","","","1.044","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111364","6.4403","0.0012","6.8554","0.0012","12.826","0.002","74.611","0.003","78.455","0.003","67.987","0.003","502.95","0.15","150","1","150","1","","","","","","","","3","P -1","-P 1","2","","","","- C12 H16 O2 -","- C12 H16 O2 -","- C24 H32 O4 -","2","1","","Jun Yang; Mahender B. Dewal; Salvatore Profeta; Mark D. Smith; Youyong Li; Linda S. Shimizu","Origins of Selectivity for the [2+2] Cycloaddition of α,β-unsaturated Ketones within a Porous Self-assembled Organic Framework","Journal of the American Chemical Society","2008","130","","612","621","10.1021/ja076001+","","","0.71073","MoKα","","0.0502","0.0452","","","0.1183","0.1213","","","","","","1.151","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111365","7.0223","0.0007","6.4259","0.0007","10.9846","0.0011","90","","99.693","0.002","90","","488.6","0.09","150","1","150","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 O2 -","- C12 H16 O2 -","- C24 H32 O4 -","2","0.5","","Jun Yang; Mahender B. Dewal; Salvatore Profeta; Mark D. Smith; Youyong Li; Linda S. Shimizu","Origins of Selectivity for the [2+2] Cycloaddition of α,β-unsaturated Ketones within a Porous Self-assembled Organic Framework","Journal of the American Chemical Society","2008","130","","612","621","10.1021/ja076001+","","","0.71073","MoKα","","0.0431","0.04","","","0.1037","0.1068","","","","","","1.062","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111366","8.9389","0.0002","17.1939","0.0002","20.8647","0.0004","90","","95.749","0.0009","90","","3190.66","0.1","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H38 Fe P2 Si -","- C38 H38 Fe P2 Si -","- C152 H152 Fe4 P8 Si4 -","4","1","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.0698","0.0401","","","0.0939","0.1085","","","","","","1.035","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111367","8.4191","0.0006","14.3419","0.0013","16.2224","0.0011","90","","94.61","0.005","90","","1952.5","0.3","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 Fe P2 Si -","- C18 H30 Fe P2 Si -","- C72 H120 Fe4 P8 Si4 -","4","1","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.1442","0.0884","","","0.2261","0.2716","","","","","","1.056","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111368","7.9539","0.0004","13.9194","0.0009","16.1807","0.0008","90","","102.218","0.004","90","","1750.85","0.17","150","1","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Fe P2 -","- C18 H28 Fe P2 -","- C72 H112 Fe4 P8 -","4","1","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.1114","0.0668","","","0.1506","0.1702","","","","","","1.076","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111369","8.1075","0.0003","13.7698","0.0005","16.3172","0.0004","90","","100.619","0.002","90","","1790.43","0.1","150","1","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 P2 Ru -","- C18 H28 P2 Ru -","- C72 H112 P8 Ru4 -","4","1","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.0472","0.0367","","","0.0935","0.1005","","","","","","1.077","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111370","27.5842","0.0004","11.3235","0.0004","14.7297","0.0009","90","","104.284","0.0018","90","","4458.6","0.3","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H36 P2 Ru -","- C22 H36 P2 Ru -","- C176 H288 P16 Ru8 -","8","2","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.1046","0.0522","","","0.115","0.1366","","","","","","1.032","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111371","9.1373","0.0001","13.9938","0.0002","15.1999","0.0002","90","","90","","90","","1943.54","0.04","150","1","150","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H30 P2 Ru -","- C18 H30 P2 Ru -","- C72 H120 P8 Ru4 -","4","1","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.0256","0.0234","","","0.0546","0.0561","","","","","","1.124","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111372","18.0961","0.0019","18.915","0.002","26.033","0.003","80.349","0.001","70.276","0.001","63.317","0.001","7493.3","1.4","80","2","80","2","","","","","","","","5","P -1","-P 1","2","","","","- C122 H149.5 N42 O53.25 Pd6 -","- C122.016 H116.01 N42 O53.25 Pd6 -","- C244.032 H232.02 N84 O106.5 Pd12 -","2","1","","Yoshihiro Yamauchi; Michito Yoshizawa; Makoto Fujita","Engineering Stacks of Aromatic Rings by the Interpenetration of Self-Assembled Coordination Cages","Journal of the American Chemical Society","2008","130","","5832","5833","10.1021/ja077783+","","","0.71073","MoKα","","0.0742","0.0463","","","0.1079","0.1232","","","","","","1.039","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111373","22.152","0.003","22.625","0.003","25.961","0.003","106.748","0.002","110.284","0.002","101.93","0.002","10985","2","80","2","80","2","","","","","","","","5","P -1","-P 1","2","","","","- C132 H283 N35.5 O51.5 Pd6 -","- C132 H165 N35.5 O51.5 Pd6 -","- C264 H330 N71 O103 Pd12 -","2","1","","Yoshihiro Yamauchi; Michito Yoshizawa; Makoto Fujita","Engineering Stacks of Aromatic Rings by the Interpenetration of Self-Assembled Coordination Cages","Journal of the American Chemical Society","2008","130","","5832","5833","10.1021/ja077783+","","","0.71073","MoK\/Ya","","0.2435","0.1167","","","0.3181","0.3655","","","","","","0.961","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4111374","38.9359","0.0006","24.277","0.0006","20.2369","0.0005","90","","112.917","0.0013","90","","17619","0.7","150","1","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C47 H65 B Fe O0.5 P3 -","- C47 H65 B Fe O0.5 P3 -","- C752 H1040 B16 Fe16 O8 P48 -","16","2","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.1304","0.0749","","","0.1933","0.2302","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111375","10.6044","0.0008","7.4583","0.0005","16.4746","0.0014","90","","95.097","0.004","90","","1297.84","0.17","150","1","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 Fe -","- C17 H18 Fe -","- C68 H72 Fe4 -","4","1","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.1501","0.0579","","","0.1159","0.149","","","","","","0.976","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111376","7.7045","0.0002","32.9298","0.0008","15.2583","0.0004","90","","90.97","0.0014","90","","3870.59","0.17","150","1","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Ru -","- C16 H20 Ru -","- C192 H240 Ru12 -","12","3","","David E. Herbert; Makoto Tanabe; Sara C. Bourke; Alan J. Lough; Ian Manners","Strain-Controlled, Photochemically, or Thermally Promoted Haptotropic Shifts of Cyclopentadienyl Ligands in Group 8 Metallocenophanes","Journal of the American Chemical Society","2008","130","","4166","4176","10.1021/ja077334+","","","0.71073","MoKα","","0.1026","0.0521","","","0.113","0.1319","","","","","","1.014","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4121938","8.852","0.005","9.106","0.005","9.389","0.005","90","","113.263","0.009","90","","695.3","0.7","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H18 Cl N O -","- C15 H18 Cl N O -","- C30 H36 Cl2 N2 O2 -","2","1","","Curran, Dennis P.; Guthrie, David B.; Geib, Steven J.","How do analogous alpha-chloroenamides and alpha-iodoenamides give different product distributions in 5-endo radical cyclizations?","Journal of the American Chemical Society","2008","130","26","8437","8445","10.1021/ja8012962","","x-ray","0.71073","MoKα","","0.0643","0.0511","","","0.1313","0.1386","","","","","","0.999","","","","has coordinates","179021","2020-10-21","18:00:00",""
"4123999","11.0342","","11.0342","","11.8797","","90","","90","","90","","1446.4","","","","","","","","","","","","","4","P 1","P 1","1","","H2 Si Ti2 O7 (H2 O)2","","- H6 O9 Si Ti2 -","- H6 O9 Si Ti2 -","- H48 O72 Si8 Ti16 -","8","8","","Celestian, A.J.; Kubicki, J.D.; Parise, J.B.; Clearfield, A.; Hanson, J.","The mechanism responsible for extraordinary Cs ion selectivity in crystalline silicotitanate","Journal of the American Chemical Society","2008","130","","11689","11694","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124000","11.0342","","11.0342","","11.8797","","90","","90","","90","","1446.4","","","","","","","","","","","","","5","P 1","P 1","1","","Cs1 H Si Ti2 O7 (H2 O)","","- Cs H3 O8 Si Ti2 -","- Cs H3 O8 Si Ti2 -","- Cs8 H24 O64 Si8 Ti16 -","8","8","","Celestian, A.J.; Kubicki, J.D.; Hanson, J.; Parise, J.B.; Clearfield, A.","The mechanism responsible for extraordinary Cs ion selectivity in crystalline silicotitanate","Journal of the American Chemical Society","2008","130","","11689","11694","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124013","4.2221","","4.2221","","4.9691","","90","","90","","120","","76.712","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Sr Ga Ge D","","- D Ga Ge Sr -","- D Ga Ge Sr -","- D Ga Ge Sr -","1","0.166667","","Evans, M.J.; Garcia-Garcia, F.J.; Holland, G.P.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124014","4.2776","","4.2776","","5.1948","","90","","90","","120","","82.319","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ba (Ga Si) D","","- Ba D Ga Si -","- Ba D Ga Si -","- Ba D Ga Si -","1","0.166667","","Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124015","4.3344","","4.3344","","5.1895","","90","","90","","120","","84.433","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ba Ga Ge D","","- Ba D Ga Ge -","- Ba D Ga Ge -","- Ba D Ga Ge -","1","0.166667","","Evans, M.J.; Garcia-Garcia, F.J.; Holland, G.P.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124016","4.559","","4.559","","5.298","","90","","90","","120","","95.363","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ba Ga Sn D","","- Ba D Ga Sn -","- Ba D Ga Sn -","- Ba D Ga Sn -","1","0.166667","","Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124017","4.0911","","4.0911","","4.7628","","90","","90","","120","","69.036","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ca Ga Si H","","- Ca Ga H Si -","- Ca Ga H Si -","- Ca Ga H Si -","1","0.166667","","Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124018","4.1509","","4.1509","","4.7995","","90","","90","","120","","71.616","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","","","- Ca Ga Ge H -","- Ca Ga Ge H -","- Ca Ga Ge H -","1","0.166667","","Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124019","4.3852","","4.3852","","4.9679","","90","","90","","120","","82.734","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ca Ga Sn H","","- Ca Ga H Sn -","- Ca Ga H Sn -","- Ca Ga H Sn -","1","0.166667","","Evans, M.J.; Holland, G.P.; Haeussermann, U.; Garcia-Garcia, F.J.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124020","4.1881","","4.1881","","5.0025","","90","","90","","120","","75.989","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Sr Ga Si H","","- Ga H Si Sr -","- Ga H Si Sr -","- Ga H Si Sr -","1","0.166667","","Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124021","4.2502","","4.2502","","5.0207","","90","","90","","120","","78.544","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Sr Ga Ge H","","- Ga Ge H Sr -","- Ga Ge H Sr -","- Ga Ge H Sr -","1","0.166667","","Evans, M.J.; Haeussermann, U.; Holland, G.P.; Garcia-Garcia, F.J.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124022","4.4829","","4.4829","","5.1912","","90","","90","","120","","90.348","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Sr Ga Sn H","","- Ga H Sn Sr -","- Ga H Sn Sr -","- Ga H Sn Sr -","1","0.166667","","Evans, M.J.; Haeussermann, U.; Garcia-Garcia, F.J.; Holland, G.P.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124023","4.3015","","4.3015","","5.2703","","90","","90","","120","","84.451","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ba Ga Si H","","- Ba Ga H Si -","- Ba Ga H Si -","- Ba Ga H Si -","1","0.166667","","Evans, M.J.; Holland, G.P.; Haeussermann, U.; Garcia-Garcia, F.J.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124024","4.3758","","4.3758","","5.2687","","90","","90","","120","","87.367","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","","","- Ba Ga Ge H -","- Ba Ga Ge H -","- Ba Ga Ge H -","1","0.166667","","Evans, M.J.; Holland, G.P.; Garcia-Garcia, F.J.; Haeussermann, U.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124025","4.5914","","4.5914","","5.4257","","90","","90","","120","","99.055","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Ba Ga Sn H","","- Ba Ga H Sn -","- Ba Ga H Sn -","- Ba Ga H Sn -","1","0.166667","","Evans, M.J.; Holland, G.P.; Haeussermann, U.; Garcia-Garcia, F.J.","Polyanionic gallium hydrides from Al B2-type precursors Ae Ga E (Ae = Ca, Sr, Ba; E = Si, Ge, Sn)","Journal of the American Chemical Society","2008","130","","12139","12147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124085","6.7172","","6.7172","","7.5196","","90","","90","","120","","293.834","","","","","","","","","","","","","4","P -3 1 m","-P 3 2","162","","Ag3 (Fe (C N)6)","","- C6 Ag3 Fe N6 -","- C6 Ag3 Fe N6 -","- C6 Ag3 Fe N6 -","1","0.0833333","","Goodwin, A.L.; Keen, D.A.; Dove, M.T.; Tucker, M.G.; Peters, L.; Evans, J.S.O.","Argentophilicity-dependent colossal thermal expansion in extended Prussian blue analogues","Journal of the American Chemical Society","2008","130","","9660","9661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124086","6.41294","","6.41294","","5.71973","","90","","90","","120","","203.714","","","","","","","","","","","","","4","P -3 1 m","-P 3 2","162","","D3 (Co (C N)6)","","- C6 Co D3 N6 -","- C6 Co D3 N6 -","- C6 Co D3 N6 -","1","0.0833333","","Goodwin, A.L.; Dove, M.T.; Tucker, M.G.; Keen, D.A.; Evans, J.S.O.; Peters, L.","Argentophilicity-dependent colossal thermal expansion in extended Prussian blue analogues","Journal of the American Chemical Society","2008","130","","9660","9661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124094","10.0668","","10.0668","","9.6466","","90","","90","","90","","977.591","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)9.936","","- Ga5.76 H19.872 K5.76 O41.936 Si10.24 -","- Ga5.76 K5.76 O41.936 Si10.24 -","- Ga5.76 K5.76 O41.936 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124095","10.0517","","10.0517","","9.6148","","90","","90","","90","","971.447","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)9.664","","- Ga5.76 H19.328 K5.76 O41.664 Si10.24 -","- Ga5.76 K5.76 O41.664 Si10.24 -","- Ga5.76 K5.76 O41.664 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Vogt, T.; Kao Chichang","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124096","10.0548","","10.0548","","9.5433","","90","","90","","90","","964.818","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)11.584","","- Ga5.76 H23.168 K5.76 O43.584 Si10.24 -","- Ga5.76 K5.76 O43.584 Si10.24 -","- Ga5.76 K5.76 O43.584 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124097","10.0835","","10.0835","","9.4084","","90","","90","","90","","956.618","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)11.904","","- Ga5.76 H23.808 K5.76 O43.904 Si10.24 -","- Ga5.76 K5.76 O43.904 Si10.24 -","- Ga5.76 K5.76 O43.904 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124098","10.0741","","10.0741","","9.3033","","90","","90","","90","","944.169","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)11.920","","- Ga5.76 H23.84 K5.76 O43.92 Si10.24 -","- Ga5.76 K5.76 O43.92 Si10.24 -","- Ga5.76 K5.76 O43.92 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124099","10.0621","","10.0621","","9.2185","","90","","90","","90","","933.335","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","K5.76 Ga5.76 Si10.24 O32 (H2 O)12.368","","- Ga5.76 H24.736 K5.76 O44.368 Si10.24 -","- Ga5.76 K5.76 O44.368 Si10.24 -","- Ga5.76 K5.76 O44.368 Si10.24 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Kao Chichang; Vogt, T.","Pressure-induced hydration and order-disorder transition in a synthetic potassium gallosilicate zeolite with gismondine topology","Journal of the American Chemical Society","2008","130","","2842","2850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124104","4.3392","","4.3483","","21.8438","","90","","95.679","","90","","410.129","","","","","","","","","","","","","2","P 1","P 1","1","","","","- Sm2 Te4.9 -","- Sm2 Te4.902 -","- Sm4 Te9.804 -","2","2","","Malliakas, C.D.; Iavarone, M.; Fedor, J.; Kanatzidis, M.G.","Coexistence and coupling of two distinct charge density waves in Sm2 Te5","Journal of the American Chemical Society","2008","130","","3310","3312","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124111","3.99107","","3.99107","","3.47481","","90","","90","","90","","55.349","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","Sr Fe O2","","- Fe O2 Sr -","- Fe O2 Sr -","- Fe O2 Sr -","1","0.0625","","Tassel, C.; Watanabe, T.; Tsujimoto, Y.; Takano, M.; Kitada, A.; Sumida, Y.; Hayashi, N.; Yoshimura, K.; Yamamoto, T.; Kageyama, H.","Stability of the infinite layer structure with iron square planar coordination","Journal of the American Chemical Society","2008","130","","3764","3765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124112","3.95638","","3.95638","","3.42098","","90","","90","","90","","53.548","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Sr0.8 Ca0.2 Fe O2","","- Ca0.2 Fe O2 Sr0.8 -","- Ca0.2 Fe O2 Sr0.8 -","- Ca0.2 Fe O2 Sr0.8 -","1","0.0625","","Tassel, C.; Watanabe, T.; Hayashi, N.; Tsujimoto, Y.; Kitada, A.; Kageyama, H.; Yoshimura, K.; Yamamoto, T.; Sumida, Y.; Takano, M.","Stability of the infinite layer structure with iron square planar coordination","Journal of the American Chemical Society","2008","130","","3764","3765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124113","3.9578","","3.9578","","3.38003","","90","","90","","90","","52.945","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Sr0.6 Ca0.4 Fe O2","","- Ca0.4 Fe O2 Sr0.6 -","- Ca0.4 Fe O2 Sr0.6 -","- Ca0.4 Fe O2 Sr0.6 -","1","0.0625","","Tassel, C.; Watanabe, T.; Tsujimoto, Y.; Hayashi, N.; Kitada, A.; Sumida, Y.; Yamamoto, T.; Takano, M.; Kageyama, H.; Yoshimura, K.","Stability of the infinite layer structure with iron square planar coordination","Journal of the American Chemical Society","2008","130","","3764","3765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124114","3.9028","","3.9028","","3.29132","","90","","90","","90","","50.133","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Sr0.2 Ca0.8 Fe O2","","- Ca0.8 Fe O2 Sr0.2 -","- Ca0.8 Fe O2 Sr0.2 -","- Ca0.8 Fe O2 Sr0.2 -","1","0.0625","","Tassel, C.; Sumida, Y.; Tsujimoto, Y.; Watanabe, T.; Kitada, A.; Hayashi, N.; Kageyama, H.; Yoshimura, K.; Yamamoto, T.; Takano, M.","Stability of the infinite layer structure with iron square planar coordination","Journal of the American Chemical Society","2008","130","","3764","3765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124115","3.89079","","3.89079","","3.35433","","90","","90","","90","","50.779","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Ca Fe O2 -","- Ca Fe O2 -","- Ca Fe O2 -","1","0.0625","","Tassel, C.; Watanabe, T.; Sumida, Y.; Hayashi, N.; Takano, M.; Tsujimoto, Y.; Kitada, A.; Yamamoto, T.; Kageyama, H.; Yoshimura, K.","Stability of the infinite layer structure with iron square planar coordination","Journal of the American Chemical Society","2008","130","","3764","3765","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124119","6.97192","","12.02685","","6.96194","","90","","120.02","","90","","505.449","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Be F2 -","- Be F2 -","- Be16 F32 -","16","2","","Zwijnenburg, M.A.; Bell, R.G.; Cora, F.","Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2","Journal of the American Chemical Society","2008","130","","11082","11087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124120","8.529749","","8.529749","","8.529749","","90","","90","","90","","620.596","","","","","","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","","","- Be F2 -","- Be F2 -","- Be12 F24 -","12","0.5","","Zwijnenburg, M.A.; Cora, F.; Bell, R.G.","Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2","Journal of the American Chemical Society","2008","130","","11082","11087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124121","13.1285","","13.1285","","14.42939","","90","","90","","120","","2153.82","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Be F2 -","- Be F2 -","- Be36 F72 -","36","1","","Zwijnenburg, M.A.; Cora, F.; Bell, R.G.","Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2","Journal of the American Chemical Society","2008","130","","11082","11087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124122","19.79146","","19.79146","","19.79146","","90","","90","","90","","7752.35","","","","","","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Be Cl2 -","- Be Cl2 -","- Be48 Cl96 -","48","1","","Zwijnenburg, M.A.; Cora, F.; Bell, R.G.","Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2","Journal of the American Chemical Society","2008","130","","11082","11087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124123","11.51593","","11.51593","","8.400845","","90","","90","","120","","964.832","","","","","","","","","","","","","2","P 32","P 32","145","","","","- Be Cl2 -","- Be Cl2 -","- Be9 Cl18 -","9","3","","Zwijnenburg, M.A.; Cora, F.; Bell, R.G.","Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2","Journal of the American Chemical Society","2008","130","","11082","11087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124124","9.845269","","9.845269","","9.845269","","90","","90","","90","","954.295","","","","","","","","","","","","","2","P -4 3 n","P -4n 2 3","218","","","","- Be Cl2 -","- Be Cl2 -","- Be12 Cl24 -","12","0.5","","Zwijnenburg, M.A.; Cora, F.; Bell, R.G.","Isomorphism of anhydrous tetrahedral halides and silicon chalcogenides: energy landscape of crystalline Be F2, Be Cl3, Si O2, and Si S2","Journal of the American Chemical Society","2008","130","","11082","11087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4125324","19.2665","0.001","4.8848","0.0002","30.5146","0.0021","90","","92.5","0.1","90","","2869.1","0.4","","","","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C23 H41 Cu N5 O10 -","- C25 H46.58 Cu N5.86 O9.25 -","- C100 H186.32 Cu4 N23.44 O37 -","4","1","","Mantion, Alexandre; Massüger, Lars; Rabu, Pierre; Palivan, Cornelia; McCusker, Lynne B.; Taubert, Andreas","Metal‒Peptide Frameworks (MPFs): “Bioinspired” Metal Organic Frameworks","Journal of the American Chemical Society","2008","130","8","2517","2526","10.1021/ja0762588","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","189122","2020-10-21","18:00:00",""