# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-16T15:37:40+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 = 124 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
"2000026","15.0562","0.001","16.2762","0.001","20.488","0.0013","88.98","0.002","74.256","0.002","78.297","0.002","4728.23","","","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C84 H156 P6 S8 W6 -","- C85 H155 P6 S8 W6 -","- C170 H310 P12 S16 W12 -","2","1","","Jin, Song; Adamchuk, Jennifer; Xiang, Bosong; DiSalvo, Francis J.","The Dean-Evans Relation in ^31^P NMR Spectroscopy and Its Application to the Chemistry of Octahedral Tungsten Sulfide Clusters","Journal of the American Chemical Society","2002","124","31","9229","9240","10.1021/ja0257873","","","","","","","0.0498","","","0.0498","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2000043","16.1816","0.0004","15.9178","0.0004","29.4907","0.0008","90","","91.4768","0.001","90","","7593.56","","","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C69 H98 N5 P S8 W6 -","- C77 H122 N5 P S8 W6 -","- C308 H488 N20 P4 S32 W24 -","4","1","","Jin, Song; Adamchuk, Jennifer; Xiang, Bosong; DiSalvo, Francis J.","The Dean-Evans Relation in ^31^P NMR Spectroscopy and Its Application to the Chemistry of Octahedral Tungsten Sulfide Clusters","Journal of the American Chemical Society","2002","124","31","9229","9240","10.1021/ja0257873","","","","","","","0.0571","","","0.0571","","","","","","","","","","","has coordinates","199666","2020-10-21","18:00:00",""
"2000044","15.8389","0.0012","19.4806","0.0014","20.0882","0.0015","90","","95.542","0.002","90","","6169.27","","","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H86 N2 P4 S8 W6 -","- C42 H86 N2 P4 S8 W6 -","- C168 H344 N8 P16 S32 W24 -","4","1","","Song Jin; Jennifer Adamchuk; Bosong Xiang; Francis J. DiSalvo","The Dean-Evans Relation in 31P NMR Spectroscopy and Its Application to the Chemistry of Octahedral Tungsten Sulfide Clusters","Journal of the American Chemical Society","2002","124","","9229","9240","","","","","","","","0.0388","","","0.0388","","","","","","","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2000045","12.024","0.003","21.356","0.005","25.107","0.005","112.39","0.02","92.58","0.02","90.68","0.03","5952.08","","","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H83 N2 P5 S8 W6 -","- C40 H83 N2 P5 S8 W6 -","- C160 H332 N8 P20 S32 W24 -","4","2","","Song Jin; Jennifer Adamchuk; Bosong Xiang; Francis J. DiSalvo","The Dean-Evans Relation in 31P NMR Spectroscopy and Its Application to the Chemistry of Octahedral Tungsten Sulfide Clusters","Journal of the American Chemical Society","2002","124","","9229","9240","10.1021/ja0257873","","","","","","","0.0712","","","0.0712","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:42",""
"4114562","9.499","0.003","12.856","0.004","14.846","0.004","72.274","0.004","76.17","0.005","68.932","0.004","1594.3","0.8","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H94 K2 O16 Si2 -","- C60 H94 K2 O16 Si2 -","- C60 H94 K2 O16 Si2 -","1","0.5","","Yuxia Liu; Thomas C. Stringfellow; David Ballweg; Ilia A. Guzei; Robert West","Structure and Chemistry of 1-Silafluorenyl Dianion, Its Derivatives, and an Organosilicon Diradical Dianion","Journal of the American Chemical Society","2002","124","","49","57","10.1021/ja011821m","","","0.71073","MoKα","","0.104","0.0703","","","0.1722","0.1946","","","","","","1.071","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4114563","7.4375","0.0006","12.154","0.001","12.7246","0.0011","90","","90","","90","","1150.24","0.17","133","2","133","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C12 H8 Cl2 Si -","- C12 H8 Cl2 Si -","- C48 H32 Cl8 Si4 -","4","0.5","","Yuxia Liu; Thomas C. Stringfellow; David Ballweg; Ilia A. Guzei; Robert West","Structure and Chemistry of 1-Silafluorenyl Dianion, Its Derivatives, and an Organosilicon Diradical Dianion","Journal of the American Chemical Society","2002","124","","49","57","10.1021/ja011821m","","","0.71073","MoKα","","0.0374","0.0292","","","0.0749","0.0777","","","","","","1.054","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114564","10.713","0.001","13.4592","0.0014","13.6979","0.0013","94.279","0.002","94.337","0.002","99.094","0.002","1937.1","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C42 H42 Si5 -","- C42 H42 Si5 -","- C84 H84 Si10 -","2","1","","Yuxia Liu; Thomas C. Stringfellow; David Ballweg; Ilia A. Guzei; Robert West","Structure and Chemistry of 1-Silafluorenyl Dianion, Its Derivatives, and an Organosilicon Diradical Dianion","Journal of the American Chemical Society","2002","124","","49","57","10.1021/ja011821m","","","0.71073","MoKα","","0.0666","0.0451","","","0.1219","0.1342","","","","","","1","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114565","10.5459","0.0009","15.9281","0.0012","17.8197","0.0015","95.02","0.002","98.726","0.002","96.053","0.002","2925.8","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H57.33 K2 O10 Si -","- C32 H48 K2 O10 Si -","- C96 H144 K6 O30 Si3 -","3","1.5","","Yuxia Liu; Thomas C. Stringfellow; David Ballweg; Ilia A. Guzei; Robert West","Structure and Chemistry of 1-Silafluorenyl Dianion, Its Derivatives, and an Organosilicon Diradical Dianion","Journal of the American Chemical Society","2002","124","","49","57","10.1021/ja011821m","","","0.71073","MoKα","","0.1203","0.063","","","0.169","0.1963","","","","","","1.026","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4114566","14.4065","0.0013","23.313","0.002","12.3328","0.0011","90","","112.597","0.002","90","","3824.1","0.6","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H48 K2 O4 Si2 -","- C39.944 H47.896 K2 O4 Si2 -","- C159.776 H191.584 K8 O16 Si8 -","4","1","","Yuxia Liu; Thomas C. Stringfellow; David Ballweg; Ilia A. Guzei; Robert West","Structure and Chemistry of 1-Silafluorenyl Dianion, Its Derivatives, and an Organosilicon Diradical Dianion","Journal of the American Chemical Society","2002","124","","49","57","10.1021/ja011821m","","","0.71073","MoKα","","0.1136","0.0577","","","0.1314","0.1557","","","","","","0.941","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4114567","9.4399","0.0013","7.1505","0.001","16.647","0.002","90","","91.365","0.003","90","","1123.4","0.3","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Si2 -","- C28 H24 Si2 -","- C56 H48 Si4 -","2","0.5","","Yuxia Liu; Thomas C. Stringfellow; David Ballweg; Ilia A. Guzei; Robert West","Structure and Chemistry of 1-Silafluorenyl Dianion, Its Derivatives, and an Organosilicon Diradical Dianion","Journal of the American Chemical Society","2002","124","","49","57","10.1021/ja011821m","","","0.71073","MoKα","","0.0805","0.0544","","","0.1444","0.1531","","","","","","1.014","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114568","12.9326","0.0003","14.321","0.0003","15.1443","0.0004","105.883","0.0013","99.3086","0.0013","106.945","0.0012","2490.13","0.11","150","","150","","","","","","","","","8","P -1","-P 1","2","","","","- C56 H54 B Cu F4 N3 O2.5 P2 -","- C56 H49 B Cu F5 N3 O3 P2 -","- C112 H98 B2 Cu2 F10 N6 O6 P4 -","2","1","","Douglas G. Cuttell; Shan-Ming Kuang; Phillip E. Fanwick; David R. McMillin; Richard A. Walton","Simple Cu(I) Complexes with Unprecedented Excited-State Lifetimes","Journal of the American Chemical Society","2002","124","","6","7","10.1021/ja012247h","","","0.71073","MO-Kα","","","0.061","","","","0.154","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114569","10.7133","0.0002","14.7971","0.0002","28.8529","0.0005","90","","98.159","0.0007","90","","4527.63","0.13","150","","150","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C51 H42 B Cl2 Cu F4 N2 O P2 -","- C51 H42 B Cl2 Cu F4 N2 O P2 -","- C204 H168 B4 Cl8 Cu4 F16 N8 O4 P8 -","4","1","","Douglas G. Cuttell; Shan-Ming Kuang; Phillip E. Fanwick; David R. McMillin; Richard A. Walton","Simple Cu(I) Complexes with Unprecedented Excited-State Lifetimes","Journal of the American Chemical Society","2002","124","","6","7","10.1021/ja012247h","","","0.71073","MO-Kα","","","0.062","","","","0.161","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114570","11.6779","0.0002","14.0495","0.0002","17.6505","0.0003","77.3452","0.0006","71.4646","0.0007","66.7766","0.0006","2508.57","0.07","149","","149","","","","","","","","","8","P -1","-P 1","2","","","","- C58 H55 B Cu F4 N3 O P2 -","- C58 H55 B Cu F4 N3 O P2 -","- C116 H110 B2 Cu2 F8 N6 O2 P4 -","2","1","","Douglas G. Cuttell; Shan-Ming Kuang; Phillip E. Fanwick; David R. McMillin; Richard A. Walton","Simple Cu(I) Complexes with Unprecedented Excited-State Lifetimes","Journal of the American Chemical Society","2002","124","","6","7","10.1021/ja012247h","","","0.71073","MO-Kα","","","0.049","","","","0.125","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114571","6.9808","0.001","11.2342","0.0016","20.146","0.003","90","","90.057","0.003","90","","1579.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 N O6 S -","- C15 H17 N O6 S -","- C60 H68 N4 O24 S4 -","4","1","","Yoshihiko Yamamoto; Hideyuki Takagishi; Kenji Itoh","Ruthenium-Catalyzed Cycloaddition of 1,6-Diynes with Isothiocyanates and Carbon Disulfide: First Transition-Metal Catalyzed [2 + 2 + 2] Cocyclotrimerization Involving CS Double Bond","Journal of the American Chemical Society","2002","124","","28","29","10.1021/ja016510q","","","0.71073","MoKα","","0.0592","0.0541","","","0.146","0.1556","","","","","","0.637","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114572","11.5683","0.0014","13.4244","0.0017","14.2656","0.0018","67.015","0.002","72.957","0.002","84.403","0.002","1949.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H21 N3 O30 V12 -","- C18 H21 N3 O30 V12 -","- C36 H42 N6 O60 V24 -","2","1","","Anima Bose; Pingang He; Charles Liu; Brett D. Ellman; Robert J. Twieg; Songping D. Huang","Strong Electron-Acceptor Methylviologen Dications Confined in a 2D Inorganic Host: Synthesis, Structural Characterization, Charge Transport and Electrochemical Properties of (MV)0.25V2O5","Journal of the American Chemical Society","2002","124","","4","5","10.1021/ja016865+","","","0.71073","MoKα","","0.2334","0.0877","","","0.1802","0.2446","","","","","","1.012","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114573","12.781","0.005","10.073","0.004","17.227","0.006","90","","90","","90","","2217.9","1.5","30","2","30","2","","","","","","","","5","P b c n","-P 2n 2ab","60","Fe(phen)2(NCS)2","","","- C13 H8 Fe0.5 N3 S -","- C13 H8 Fe0.5 N3 S -","- C104 H64 Fe4 N24 S8 -","8","1","","Mathieu Marchivie; Philippe Guionneau; Judith A. K. Howard; Guillaume Chastanet; Jean-François Létard; Andres E. Goeta; Daniel Chasseau","Structural Characterization of a Photoinduced Molecular Switch","Journal of the American Chemical Society","2002","124","","194","195","10.1021/ja016980k","","","0.71073","MoKα","","0.0723","0.0464","","","0.1002","0.1111","","","","","","1.066","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114574","13.121","0.003","9.954","0.003","17.163","0.004","90","","90","","90","","2241.6","1","30","2","30","2","","","","","","","","5","P b c n","-P 2n 2ab","60","Fe(phen)2(NCS)2","","","- C13 H8 Fe0.5 N3 S -","- C13 H8 Fe0.5 N3 S -","- C104 H64 Fe4 N24 S8 -","8","1","","Mathieu Marchivie; Philippe Guionneau; Judith A. K. Howard; Guillaume Chastanet; Jean-François Létard; Andres E. Goeta; Daniel Chasseau","Structural Characterization of a Photoinduced Molecular Switch","Journal of the American Chemical Society","2002","124","","194","195","10.1021/ja016980k","","","0.71073","MoKα","","0.0843","0.0602","","","0.1335","0.1461","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114575","8.703","0.002","7.154","0.002","9.315","0.002","90","","97.63","0.02","90","","574.8","0.2","293.2","","293.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 O12 Zn2 -","- C4 H12 O12 Zn -","- C8 H24 O24 Zn2 -","2","0.5","","Andrew S. Lipton; Mark D. Smith; Richard D. Adams; Paul D. Ellis","67Zn Solid-State and Single-Crystal NMR Spectroscopy and X-ray Crystal Structure of Zinc Formate Dihydrate","Journal of the American Chemical Society","2002","124","","410","414","10.1021/ja011701e","","","0.7107","MoKα","","0.027","0.027","","0.0572","","0.0572","","","1.264","","","1.264","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114576","21.607","0.003","21.607","0.003","21.607","0.003","90","","90","","90","","10087","2","295","2","295","2","","","","","","","","6","I m -3 m","-I 4 2 3","229","","","","- C40 H70 Br2 Cu2 N8 O20 -","- C22 Br2 Cu2 N2 O14.6667 -","- C132 Br12 Cu12 N12 O88 -","6","0.0625","","Mohamed Eddaoudi; Jaheon Kim; Michael O'Keeffe; Omar M. Yaghi","Cu2[o-Br-C6H3(CO2)2]2(H2O)2.(DMF)8(H2O)2: A Framework Deliberately Designed To Have the NbO Structure Type","Journal of the American Chemical Society","2002","124","","376","377","10.1021/ja017154e","","","0.71073","MoKα","","0.1693","0.0788","","","0.2215","0.284","","","","","","0.95","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114577","9.3696","0.001","16.114","0.002","19.9855","0.0009","90","","92.9201","0.0009","90","","3013.5","0.5","180.2","","180.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H84 N4 P4 Si8 Zr2 -","- C48 H84 N4 P4 Si8 Zr2 -","- C96 H168 N8 P8 Si16 Zr4 -","2","0.5","","Michael D. Fryzuk; Christopher M. Kozak; Parisa Mehrkhodavandi; Lara Morello; Brian O. Patrick; Steven J. Rettig","Phosphorus Phenyl-Group Activation by Reduced Zirconium and Niobium Complexes Stabilized by the [P2N2] Macrocycle","Journal of the American Chemical Society","2002","124","","516","517","10.1021/ja012100q","","","0.7107","MoKα","","0.0801","0.05","","0.085","","0.043","","","2.685","","","2.69","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114578","10.186","0.0006","11.2073","0.0006","13.2219","0.0007","86.865","0.002","88.448","0.003","86.208","0.004","1503.4","0.14","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H84 N4 Nb2 P4 Si8 -","- C48 H78 N4 Nb2 P4 Si8 -","- C48 H78 N4 Nb2 P4 Si8 -","1","0.5","","Michael D. Fryzuk; Christopher M. Kozak; Parisa Mehrkhodavandi; Lara Morello; Brian O. Patrick; Steven J. Rettig","Phosphorus Phenyl-Group Activation by Reduced Zirconium and Niobium Complexes Stabilized by the [P2N2] Macrocycle","Journal of the American Chemical Society","2002","124","","516","517","10.1021/ja012100q","","","0.71069","MoKα","","0.0434","0.0347","","","0.0862","0.0932","","","","","","1.054","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4114579","23.112","0.003","35.397","0.002","12.425","0.002","90","","90","","90","","10165","2","293.2","","293.2","","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C21 H34 Co N10 O3.5 -","- C21 H33 Co N10 O3.5 -","- C336 H528 Co16 N160 O56 -","16","1","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0476","0.048","","0.039","","0.039","","","2.54","","","2.54","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114580","36.389","0.002","13.313","0.002","12.704","0.002","90","","104.98","0.01","90","","5945.3","1.4","293.2","","293.2","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C18 H26 Cl3 Co N10 O13 -","- C18 H24 Cl3 Co N10 O13 -","- C144 H192 Cl24 Co8 N80 O104 -","8","2","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0402","0.04","","0.045","","0.045","","","1.592","","","1.59","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114581","24.33","0.007","12.887","0.005","18.157","0.004","90","","91.86","0.02","90","","5690","3","296.2","","296.2","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C18 H30.5 Cl1.5 Co N10 O10 -","- C18 H22.5 Cl1.5 Co N10 O9.75 -","- C144 H180 Cl12 Co8 N80 O78 -","8","2","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0595","0.06","","0.062","","0.062","","","1.316","","","1.32","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114582","20.4455","0.0009","20.4455","","20.4455","","90","","90","","90","","8546.6","0.4","293.2","","293.2","","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C18 H26 Co N10 O2.5 -","- C18 H21 Co0.333 N9.333 O2.499 -","- C288 H336 Co5.328 N149.328 O39.984 -","16","0.333333","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0652","0.065","","0.037","","0.037","","","2.615","","","2.62","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114583","12.277","0.002","12.2772","","9.321","0.002","90","","90","","120","","1216.7","0.3","296.2","","296.2","","","","","","","","","6","P 3","P 3","143","","","","- C18 H30.5 Cl1.5 Co N10 O4 -","- C18 H22.5 Cl1.5 Co0.333 N9.333 O3.666 -","- C36 H45 Cl3 Co0.666 N18.666 O7.332 -","2","0.666667","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0549","0.055","","0.065","","0.065","","","1.141","","","1.14","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114584","13.195","0.004","13.873","0.005","33.93","0.004","90","","96.39","0.02","90","","6172","3","293.2","","293.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H31 Cl3 Co N10 O12.5 -","- C21 H30 Cl3 Co N10 O12.49 -","- C168 H240 Cl24 Co8 N80 O99.92 -","8","2","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0576","0.058","","0.036","","0.036","","","2.293","","","2.29","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114585","15.285","0.001","15.2855","","39.656","0.002","90","","90","","120","","8023.9","0.7","293.2","","293.2","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C21 H28.5 Cl1.5 Co N10 O6 -","- C21 H28.5 Cl1.5 Co0.333 N9.333 O6 -","- C252 H342 Cl18 Co3.996 N111.996 O72 -","12","0.666667","","Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima","Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups","Journal of the American Chemical Society","2002","124","","629","640","10.1021/ja0123960","","","0.7107","MoKα","","0.0411","0.041","","0.032","","0.032","","","1.951","","","1.95","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114586","31.5792","0.0015","15.1007","0.0005","14.4272","0.0007","90","","110.971","0.001","90","","6424.2","0.5","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H47 F6 N2 P Ru2 -","- C28 H47 F6 N2 P Ru2 -","- C224 H376 F48 N16 P8 Ru16 -","8","1","","Hideo Kondo; Kouki Matsubara; Hideo Nagashima","Novel Coordinatively Unsaturated Bimetallic Complexes, [(η5-C5Me5)Ru(μ2-iPrNC(Me)NiPr)Ru(η5-C5Me5)]+: A Bridging Amidinate Ligand Perpendicular to the Metal-Metal Axis Effectively Stabilizes the Highly Reactive Cationic Diruthenium Species","Journal of the American Chemical Society","2002","124","","534","535","10.1021/ja016899h","","","0.71069","MoKα","","0.0579","0.04","","","0.0949","0.1039","","","","","","1.036","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114587","14.177","0.0005","15.2535","0.0004","23.5483","0.0008","90","","92.711","0.001","90","","5086.6","0.3","183.2","","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H47 B F20 N2 Ru2 -","- C52 H47 B F20 N2 Ru2 -","- C208 H188 B4 F80 N8 Ru8 -","4","1","","Hideo Kondo; Kouki Matsubara; Hideo Nagashima","Novel Coordinatively Unsaturated Bimetallic Complexes, [(η5-C5Me5)Ru(μ2-iPrNC(Me)NiPr)Ru(η5-C5Me5)]+: A Bridging Amidinate Ligand Perpendicular to the Metal-Metal Axis Effectively Stabilizes the Highly Reactive Cationic Diruthenium Species","Journal of the American Chemical Society","2002","124","","534","535","10.1021/ja016899h","","","0.71069","MoKα","","0.0481","0.0377","","","0.107","0.1221","","","","","","1.173","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114588","10.6176","0.0002","15.9728","0.0003","19.0453","0.0004","90","","101.981","0.0008","90","","3159.59","0.11","223.2","","223.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H47 F3 N2 O3 Ru2 S -","- C29 H47 F3 N2 O3 Ru2 S -","- C116 H188 F12 N8 O12 Ru8 S4 -","4","1","","Hideo Kondo; Kouki Matsubara; Hideo Nagashima","Novel Coordinatively Unsaturated Bimetallic Complexes, [(η5-C5Me5)Ru(μ2-iPrNC(Me)NiPr)Ru(η5-C5Me5)]+: A Bridging Amidinate Ligand Perpendicular to the Metal-Metal Axis Effectively Stabilizes the Highly Reactive Cationic Diruthenium Species","Journal of the American Chemical Society","2002","124","","534","535","10.1021/ja016899h","","","0.71069","MoKα","","0.0445","0.0335","","","0.0886","0.0991","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114589","14.1154","0.0003","15.3888","0.0003","23.4856","0.0007","90","","93.466","0.0009","90","","5092.2","0.2","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H49 B F20 N2 Ru2 -","- C52 H49 B F20 N2 Ru2 -","- C208 H196 B4 F80 N8 Ru8 -","4","1","","Hideo Kondo; Kouki Matsubara; Hideo Nagashima","Novel Coordinatively Unsaturated Bimetallic Complexes, [(η5-C5Me5)Ru(μ2-iPrNC(Me)NiPr)Ru(η5-C5Me5)]+: A Bridging Amidinate Ligand Perpendicular to the Metal-Metal Axis Effectively Stabilizes the Highly Reactive Cationic Diruthenium Species","Journal of the American Chemical Society","2002","124","","534","535","10.1021/ja016899h","","","0.71069","MoKα","","0.0481","0.0417","","","0.1248","0.1316","","","","","","1.217","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114590","15.675","0.003","8.651","0.002","7.163","0.0014","90","","99.38","0.03","90","","958.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C44 H40 N8 O4 -","4","1","","Mayra B. Reyes; Emil B. Lobkovsky; Barry K. Carpenter","Interplay of Orbital Symmetry and Nonstatistical Dynamics in the Thermal Rearrangements of Bicyclo[n.1.0]polyenes","Journal of the American Chemical Society","2002","124","","641","651","10.1021/ja017083j","","","0.71073","MoKα","","0.0588","0.0505","","0.1357","0.1279","","","","1.032","1.08","1.08","","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114591","6.3516","0.0006","10.3942","0.001","10.7314","0.001","94.207","0.0017","96.93","0.0013","102.423","0.0016","683.23","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H18 N2 O2 -","- C15 H18 N2 O2 -","- C30 H36 N4 O4 -","2","1","","Mayra B. Reyes; Emil B. Lobkovsky; Barry K. Carpenter","Interplay of Orbital Symmetry and Nonstatistical Dynamics in the Thermal Rearrangements of Bicyclo[n.1.0]polyenes","Journal of the American Chemical Society","2002","124","","641","651","10.1021/ja017083j","","","0.71073","MoKα","","0.0697","0.0528","","0.1449","0.1322","","","","0.617","","","0.617","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114592","5.7518","0.0005","9.4285","0.0008","15.8745","0.0014","101.72","0.002","98.15","0.002","107.282","0.002","785.85","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H20 As F6 O4 S12 -","- C20 H20 As F6 O4 S12 -","- C20 H20 As F6 O4 S12 -","1","0.5","","Hiroyuki Nishikawa; Takanobu Morimoto; Takeshi Kodama; Isao Ikemoto; Koichi Kikuchi; Jun-ichi Yamada; Harukazu Yoshino; Keizo Murata","New Organic Superconductors Consisting of an Unprecedented π-Electron Donor","Journal of the American Chemical Society","2002","124","","730","731","10.1021/ja011114t","","","0.71073","MoKα","","0.0642","0.045","","","0.0987","0.1086","","","","","","0.812","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114593","5.7808","0.001","9.2199","0.0016","15.784","0.003","101.222","0.003","98.469","0.003","107.271","0.003","768.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H20 F6 O4 P S12 -","- C20 H20 F6 O4 P S12 -","- C20 H20 F6 O4 P S12 -","1","0.5","","Hiroyuki Nishikawa; Takanobu Morimoto; Takeshi Kodama; Isao Ikemoto; Koichi Kikuchi; Jun-ichi Yamada; Harukazu Yoshino; Keizo Murata","New Organic Superconductors Consisting of an Unprecedented π-Electron Donor","Journal of the American Chemical Society","2002","124","","730","731","10.1021/ja011114t","","","0.71073","MoKα","","0.0425","0.0379","","","0.112","0.1239","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114594","30.622","0.007","30.622","0.007","25.748","0.008","90","","90","","90","","24144","11","153","2","153","2","","","","","","","","7","I 4","I 4","79","5'-tert-butyldimethylsilyl-2',3'-isopropylidene guanosine-Cs/Na picrate G-quartet","","","- C357 H546 Cs0.92 N106.5 Na3.08 O108 Si16 -","- C89.255 H133.14 Cs0.2325 N26.63 Na0.7675 O27 Si4 -","- C714.04 H1065.12 Cs1.86 N213.04 Na6.14 O216 Si32 -","8","1","","Alan Wong; James C. Fettinger; Scott L. Forman; Jeffery T. Davis; Gang Wu","The Sodium Ions Inside a Lipophilic G-Quadruplex Channel as Probed by Solid-State 23Na NMR","Journal of the American Chemical Society","2002","124","","742","743","10.1021/ja0120330","","","0.71073","MoKα","","0.0819","0.062","","","0.1666","0.185","","","","","","1.023","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114595","12.1916","0.0009","15.2167","0.0011","24.6036","0.0017","90","","100.1","0.002","90","","4493.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H78 Ir2 N6 P2 -","- C40 H78 Ir2 N6 P2 -","- C160 H312 Ir8 N24 P8 -","4","1","","Yaofeng Yuan; M. Victoria Jiménez; Eduardo Sola; Fernando J. Lahoz; Luis A. Oro","Sequential C-H Activation and Dinuclear Insertion of Ethylene Promoted by a Diiridium Complex","Journal of the American Chemical Society","2002","124","","752","753","10.1021/ja016753i","","","0.71073","MoKα","","0.095","0.0497","","","0.0724","0.0892","","","","","","0.813","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114596","13.8023","0.0012","13.8562","0.0012","13.9187","0.0011","80.516","0.002","71.532","0.002","63.524","0.001","2259.2","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H78 Ir2 N6 P2 -","- C40 H78 Ir2 N6 P2 -","- C80 H156 Ir4 N12 P4 -","2","1","","Yaofeng Yuan; M. Victoria Jiménez; Eduardo Sola; Fernando J. Lahoz; Luis A. Oro","Sequential C-H Activation and Dinuclear Insertion of Ethylene Promoted by a Diiridium Complex","Journal of the American Chemical Society","2002","124","","752","753","10.1021/ja016753i","","","0.71073","MoKα","","0.1014","0.0546","","","0.0751","0.0868","","","","","","0.703","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114597","12.3141","0.0009","12.4948","0.0008","18.1104","0.0012","98.255","0.001","97.966","0.001","115.247","0.001","2431.3","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H90 Ir2 N6 P2 -","- C45 H64 Ir2 N6 P2 -","- C90 H128 Ir4 N12 P4 -","2","1","","Yaofeng Yuan; M. Victoria Jiménez; Eduardo Sola; Fernando J. Lahoz; Luis A. Oro","Sequential C-H Activation and Dinuclear Insertion of Ethylene Promoted by a Diiridium Complex","Journal of the American Chemical Society","2002","124","","752","753","10.1021/ja016753i","","","0.71073","MoKα","","0.0967","0.0598","","","0.1176","0.1282","","","","","","0.937","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4114598","7.7279","0.0017","10.967","0.002","11.194","0.002","73.729","0.004","85.332","0.004","69.856","0.004","854.9","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H9 Fe2 N O6 S2 -","- C14 H8 Fe2 N O6 S2 -","- C28 H16 Fe4 N2 O12 S4 -","2","1","","Hongxiang Li; Thomas B. Rauchfuss","Iron Carbonyl Sulfides, Formaldehyde, and Amines Condense To Give the Proposed Azadithiolate Cofactor of the Fe-Only Hydrogenases","Journal of the American Chemical Society","2002","124","","726","727","10.1021/ja016964n","","","0.71073","MoKα","","0.0264","0.0239","","","0.0665","0.068","","","","","","1.071","","","","has coordinates","178916","2020-10-21","18:00:00",""
"4114599","11.9966","0.0006","14.2977","0.0006","18.1645","0.0008","90","","90","","90","","3115.6","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H45 Fe2 N5 O4 S2 -","- C24 H41 Fe2 N5 O4 S2 -","- C96 H164 Fe8 N20 O16 S8 -","4","1","","Hongxiang Li; Thomas B. Rauchfuss","Iron Carbonyl Sulfides, Formaldehyde, and Amines Condense To Give the Proposed Azadithiolate Cofactor of the Fe-Only Hydrogenases","Journal of the American Chemical Society","2002","124","","726","727","10.1021/ja016964n","","","0.71073","MoKα","","0.0434","0.0296","","","0.0622","0.0641","","","","","","1.136","","","","has coordinates,has disorder","178916","2020-10-21","18:00:00",""
"4114600","15.1649","0.0013","16.8922","0.0016","14.3956","0.001","114.609","0.001","109.742","0.005","71.321","0.002","3085.4","0.5","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H76 N5 Na3 O20 P2 -","- C53 H76 N5 Na3 O20 P2 -","- C106 H152 N10 Na6 O40 P4 -","2","1","","Akira Onoda; Yusuke Yamada; Taka-aki Okamura; Mototsugu Doi; Hitoshi Yamamoto; Norikazu Ueyama","Synthesis of Zigzag-Chain and Cyclic-Octanuclear Calcium Complexes and Hexanuclear Bulky Aryl-Phosphate Sodium Complexes with Ortho-Amide Groups: Structural Transformation Involving a Network of Inter- and Intramolecular Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","1052","1059","10.1021/ja011457r","","","0.71069","MoKα","","0.1144","0.0715","","","0.1956","0.2111","","","","","","1.242","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114601","11.91","0.003","14.612","0.003","8.142","0.001","100.79","0.02","108.64","0.01","78.99","0.02","1305.7","0.5","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H32 N3 O6 P -","- C26 H32 N3 O6 P -","- C52 H64 N6 O12 P2 -","2","1","","Akira Onoda; Yusuke Yamada; Taka-aki Okamura; Mototsugu Doi; Hitoshi Yamamoto; Norikazu Ueyama","Synthesis of Zigzag-Chain and Cyclic-Octanuclear Calcium Complexes and Hexanuclear Bulky Aryl-Phosphate Sodium Complexes with Ortho-Amide Groups: Structural Transformation Involving a Network of Inter- and Intramolecular Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","1052","1059","10.1021/ja011457r","","","0.7107","MoKα","","","0.0615","","","","0.0666","","","","","","1.834","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114602","18.678","0.006","31.752","0.011","9.38","0.006","90","","90","","90","","5563","4","296","","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H36 N3 O6 P -","- C28 H36 N3 O6 P -","- C224 H288 N24 O48 P8 -","8","1","","Akira Onoda; Yusuke Yamada; Taka-aki Okamura; Mototsugu Doi; Hitoshi Yamamoto; Norikazu Ueyama","Synthesis of Zigzag-Chain and Cyclic-Octanuclear Calcium Complexes and Hexanuclear Bulky Aryl-Phosphate Sodium Complexes with Ortho-Amide Groups: Structural Transformation Involving a Network of Inter- and Intramolecular Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","1052","1059","10.1021/ja011457r","","","0.71069","MoKα","","0.3211","0.0533","","","0.1633","0.2483","","","","","","0.929","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114603","16.96","0.005","8.257","0.007","18.754","0.007","90","","101.95","0.03","90","","2569","3","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H29 Ca N2 O11 P -","- C22 H20 Ca N2 O11 P -","- C88 H80 Ca4 N8 O44 P4 -","4","1","","Akira Onoda; Yusuke Yamada; Taka-aki Okamura; Mototsugu Doi; Hitoshi Yamamoto; Norikazu Ueyama","Synthesis of Zigzag-Chain and Cyclic-Octanuclear Calcium Complexes and Hexanuclear Bulky Aryl-Phosphate Sodium Complexes with Ortho-Amide Groups: Structural Transformation Involving a Network of Inter- and Intramolecular Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","1052","1059","10.1021/ja011457r","","","0.71069","MoKα","","0.1702","0.0519","","","0.136","0.1808","","","","","","0.975","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114604","29.8134","0.0005","29.8134","0.0005","16.9925","0.0003","90","","90","","90","","15103.6","0.4","296","","296","","","","","","","","","6","P 4/n :2","-P 4a","85","","[Ca8(O3POC6H3(NHCOPh)2)8(H2O)12(dmf)8]-8(DMF)-11(H2O)","","- C208 H278 Ca8 N32 O87 P8 -","- C201.412 H224.628 Ca8 N29.804 O84.804 P8 -","- C402.824 H449.256 Ca16 N59.608 O169.608 P16 -","2","0.25","","Akira Onoda; Yusuke Yamada; Taka-aki Okamura; Mototsugu Doi; Hitoshi Yamamoto; Norikazu Ueyama","Synthesis of Zigzag-Chain and Cyclic-Octanuclear Calcium Complexes and Hexanuclear Bulky Aryl-Phosphate Sodium Complexes with Ortho-Amide Groups: Structural Transformation Involving a Network of Inter- and Intramolecular Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","1052","1059","10.1021/ja011457r","","","0.71069","MoKα","","0.2491","0.1052","","","0.286","0.3395","","","","","","0.803","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114605","19.894","0.001","18.365","0.001","13.15","0.001","90","0.001","118.127","0.001","90","0.001","4237","0.5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23.5 H22 N4 Pt -","- C23.5 H22 N4 Pt -","- C188 H176 N32 Pt8 -","8","1","","Carrie E. Buss; Kent R. Mann","Synthesis and Characterization of Pt(CN-p-(C2H5)C6H4)2(CN)2, a Crystalline Vapoluminescent Compound That Detects Vapor-Phase Aromatic Hydrocarbons","Journal of the American Chemical Society","2002","124","","1031","1039","10.1021/ja011986v","","","0.71073","MoKα","","0.0715","0.0328","","","0.0687","0.0792","","","","","","1.046","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4114606","20.0943","0.0009","18.2433","0.0008","13.1405","0.0005","90","","117.813","0.001","90","","4260.6","0.3","173","2","173","2","","","","","","","Prof. Mann / C. Buss","4","C 1 2/c 1","-C 2yc","15","97212e","","","- C20 H18 N4 Pt -","- C20 H18 N4 Pt -","- C160 H144 N32 Pt8 -","8","1","","Carrie E. Buss; Kent R. Mann","Synthesis and Characterization of Pt(CN-p-(C2H5)C6H4)2(CN)2, a Crystalline Vapoluminescent Compound That Detects Vapor-Phase Aromatic Hydrocarbons","Journal of the American Chemical Society","2002","124","","1031","1039","10.1021/ja011986v","","","0.71073","MoKα","","0.1055","0.042","","0.1023","0.0848","","","","0.932","1.211","1.211","","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4114607","25.06","0.005","15.001","0.002","21.9786","0.0019","90","","105.06","0.015","90","","7979","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","molybdenum borophosphate","","","- C12 H27 B Mo6 N8 O33 P4 -","- C12 B Mo6 N8 O33 P4 -","- C96 B8 Mo48 N64 O264 P32 -","8","1","","Eddy Dumas; Catherine Debiemme-Chouvy; Slavi C. Sevov","A Reduced Polyoxomolybdenum Borophosphate Anion Related to the Wells-Dawson Clusters","Journal of the American Chemical Society","2002","124","","908","909","10.1021/ja012352r","","","0.71073","MoKα","","0.0612","0.049","","","0.1339","0.1441","","","","","","1.04","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114608","17.272","0.004","23.772","0.005","25.077","0.005","87.54","0.02","84.13","0.02","76.96","0.02","9976","4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","catena-[trans,cis,cis-RuCl2(CO)2(Zn.4'-cis-DpyP)]2 (mu-4,4'bipy) solvated cis-DpyP =(5,10-bis(4'pyridyl)-15-20-diphenylporphyrin)","","- C155.5 H102.5 Cl22.5 N21 O6 Ru3 Zn3 -","- C153.5 H88.5 Cl16.5 N21 O6 Ru3 Zn3 -","- C307 H177 Cl33 N42 O12 Ru6 Zn6 -","2","1","","Elisabetta Iengo; Ennio Zangrando; Romina Minatel; Enzo Alessio","Metallacycles of Porphyrins as Building Blocks in the Construction of Higher Order Assemblies through Axial Coordination of Bridging Ligands: Solution- and Solid-State Characterization of Molecular Sandwiches and Molecular Wires","Journal of the American Chemical Society","2002","124","","1003","1013","10.1021/ja016162s","","","1","synchrotron","","0.1183","0.0865","","","0.2465","0.2693","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114609","11.923","0.004","21.89","0.004","27.183","0.006","69.06","0.02","84.87","0.02","89","0.02","6599","3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","bis([trans,cis,cis-RuCl2(CO)2(Zn.4'-cis-DpyP)]2) (mu-4'-trans-DpyP)2 solvated cis-DpyP =(5,10-bis(4'pyridyl)-15-20-diphenylporphyrin) trans-DpyP =(5,15-bis(4'pyridyl)-10-20-diphenylporphyrin)","","- C149.5 H125 Cl7 N18 O4 Ru2 Zn2 -","- C136 H94 Cl4 N18 O4 Ru2 Zn2 -","- C272 H188 Cl8 N36 O8 Ru4 Zn4 -","2","1","","Elisabetta Iengo; Ennio Zangrando; Romina Minatel; Enzo Alessio","Metallacycles of Porphyrins as Building Blocks in the Construction of Higher Order Assemblies through Axial Coordination of Bridging Ligands: Solution- and Solid-State Characterization of Molecular Sandwiches and Molecular Wires","Journal of the American Chemical Society","2002","124","","1003","1013","10.1021/ja016162s","","","1","synchrotron","","0.1395","0.0972","","","0.2555","0.2912","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114610","10.4675","0.0006","31.094","0.002","11.3851","0.0006","90","","111.721","0.001","90","","3442.5","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H54 Mo N3 P3 Si2 -","- C27 H54 Mo N3 P3 Si2 -","- C108 H216 Mo4 N12 P12 Si8 -","4","1","","Thomas M. Cameron; Carlos G. Ortiz; Ion Ghiviriga; Khalil A. Abboud; James M. Boncella","The Synthesis and Reactivity of a Molybdenum (IV) Stretched-Dihydrogen Complex","Journal of the American Chemical Society","2002","124","","922","923","10.1021/ja0169365","","","0.71073","MoKα","","0.0329","0.0256","","","0.0625","0.0638","","","","","","1.049","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114611","7.836","0.003","8.431","0.004","11.178","0.005","103.877","0.005","104.159","0.005","109.276","0.006","633.1","0.5","173.2","","","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H36 -","- C32 H36 -","- C32 H36 -","1","0.5","","Drexel H. Camacho; Shinichi Saito; Yoshinori Yamamoto","Synthesis of (E)-1,2-Divinyl-1,2-diethynylethene (DVDEE) via the Palladium-Catalyzed Reaction of Conjugated Diynes. A New Building Block for Molecular Scaffolding","Journal of the American Chemical Society","2002","124","","924","925","10.1021/ja017626p","","","0.7107","MoKα","","","0.0448","","","","0.0463","","","","","","1.317","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114612","10.446","0.002","13.75","0.002","14.169","0.004","116.59","0.03","105.55","0.03","93.46","0.03","1714.4","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","H3TP±tpy","","","- C40.5 H27 B F4 N4 O -","- C40.5 H27 B F4 N4 O -","- C81 H54 B2 F8 N8 O2 -","2","1","","Philippe Lainé; Fethi Bedioui; Philippe Ochsenbein; Valérie Marvaud; Michel Bonin; Edmond Amouyal","A New Class of Functionalized Terpyridyl Ligands as Building Blocks for Photosensitized Supramolecular Architectures. Synthesis, Structural, and Electronic Characterizations","Journal of the American Chemical Society","2002","124","","1364","1377","10.1021/ja011069p","","","1.54178","CuKα","","0.096","0.0601","","0.2337","0.2005","","","","1.744","1.842","1.842","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114613","14.366","0.003","14.57","0.003","14.677","0.003","82.82","0.03","75.68","0.03","82.19","0.03","2935.6","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","P0A/Ru","","","- C54.6 H38 F18 N7.8 O0.5 P3 Ru -","- C54.6 H38 F18 N7.8 O0.5 P3 Ru -","- C109.2 H76 F36 N15.6 O P6 Ru2 -","2","1","","Philippe Lainé; Fethi Bedioui; Philippe Ochsenbein; Valérie Marvaud; Michel Bonin; Edmond Amouyal","A New Class of Functionalized Terpyridyl Ligands as Building Blocks for Photosensitized Supramolecular Architectures. Synthesis, Structural, and Electronic Characterizations","Journal of the American Chemical Society","2002","124","","1364","1377","10.1021/ja011069p","","","0.71073","MoKα","","0.0914","0.0617","","0.1503","0.1384","","","","1.165","1.322","1.322","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114614","16.355","0.003","16.69","0.003","60.729","0.012","90","","90","","90","","16577","5","95","1","95","1","","","","","","","","6","P c a b","-P 2bc 2ac","61","P1A2/Ru","","","- C88 H62 F24 N8 P4 Ru -","- C88 H62 F24 N8 P4 Ru -","- C704 H496 F192 N64 P32 Ru8 -","8","1","","Philippe Lainé; Fethi Bedioui; Philippe Ochsenbein; Valérie Marvaud; Michel Bonin; Edmond Amouyal","A New Class of Functionalized Terpyridyl Ligands as Building Blocks for Photosensitized Supramolecular Architectures. Synthesis, Structural, and Electronic Characterizations","Journal of the American Chemical Society","2002","124","","1364","1377","10.1021/ja011069p","","","0.71073","MoKα","","0.2085","0.1307","","0.3489","0.2765","","","","1.653","2.003","2.003","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114615","14.138","0.0006","17.2261","0.0008","10.4985","0.0006","90","","90","","90","","2556.8","0.2","213","2","213","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C12 H23 B11 Br6 -","- C12 H23 B11 Br6 -","- C48 H92 B44 Br24 -","4","0.5","","Daniel Stasko; Christopher A. Reed","Optimizing the Least Nucleophilic Anion. A New, Strong Methyl+ Reagent","Journal of the American Chemical Society","2002","124","","1148","1149","10.1021/ja0118800","","","0.71073","MoKα","","0.0704","0.0512","","","0.1214","0.1258","","","","","","1.058","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114616","8.669","0.0007","12.993","0.0009","20.867","0.0007","89.037","0.004","79.917","0.004","81.937","0.003","2291.1","0.3","120","","120","","","","","","","","","5","P -1","-P 1","2","","3-Chloro-1,2,3-tris(tri-tert-butylsilyl)cyclotrigermene","","- C36 H81 Cl Ge3 Si3 -","- C36 H81 Cl Ge3 Si3 -","- C72 H162 Cl2 Ge6 Si6 -","2","1","","Akira Sekiguchi; Yutaka Ishida; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","The First Halogen-Substituted Cyclotrigermenes: A Unique Halogen Walk over the Three-Membered Ring Skeleton and Facial Stereoselectivity in the Diels-Alder Reaction","Journal of the American Chemical Society","2002","124","","1158","1159","10.1021/ja012216m","","","0.7107","MoKα","","0.0902","0.0692","","","0.1828","0.1992","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114617","13.486","0.001","13.66","0.0016","14.986","0.0019","74.53","0.005","82.005","0.006","60.497","0.005","2315.6","0.5","120","","120","","","","","","","","","5","P -1","-P 1","2","","3-Bromo-1,2,3-tris(tri-t-butylsilyl)cyclotrigermene","","- C36 H81 Br Ge3 Si3 -","- C36 H81 Br Ge3 Si3 -","- C72 H162 Br2 Ge6 Si6 -","2","1","","Akira Sekiguchi; Yutaka Ishida; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","The First Halogen-Substituted Cyclotrigermenes: A Unique Halogen Walk over the Three-Membered Ring Skeleton and Facial Stereoselectivity in the Diels-Alder Reaction","Journal of the American Chemical Society","2002","124","","1158","1159","10.1021/ja012216m","","","0.7107","MoKα","","0.1139","0.0607","","","0.1168","0.1386","","","","","","1.02","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114618","13.468","0.001","13.628","0.001","15.066","0.0009","74.952","0.004","81.617","0.004","60.994","0.003","2334.8","0.3","120","","120","","","","","","","","","5","P -1","-P 1","2","","3-Iode-1,2,3-tris(tri-tert-butylsilyl)cyclotrigermene","","- C36 H81 Ge3 I Si3 -","- C36 H81 Ge3 I Si3 -","- C72 H162 Ge6 I2 Si6 -","2","1","","Akira Sekiguchi; Yutaka Ishida; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","The First Halogen-Substituted Cyclotrigermenes: A Unique Halogen Walk over the Three-Membered Ring Skeleton and Facial Stereoselectivity in the Diels-Alder Reaction","Journal of the American Chemical Society","2002","124","","1158","1159","10.1021/ja012216m","","","0.7107","MoKα","","0.0639","0.0419","","","0.0992","0.1087","","","","","","1.009","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114619","13.509","0.0004","31.036","0.001","13.269","0.0005","90","","116.324","0.002","90","","4986.3","0.3","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Z-7-Chloro-3,4-dimethyl-1,6,7-tris(tri-tert-butylsilyl)- 1,6,7-trigermabicyclo[4.1.0]hept-3-ene","","- C42 H91 Cl Ge3 Si3 -","- C42 H91 Cl Ge3 Si3 -","- C168 H364 Cl4 Ge12 Si12 -","4","1","","Akira Sekiguchi; Yutaka Ishida; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","The First Halogen-Substituted Cyclotrigermenes: A Unique Halogen Walk over the Three-Membered Ring Skeleton and Facial Stereoselectivity in the Diels-Alder Reaction","Journal of the American Chemical Society","2002","124","","1158","1159","10.1021/ja012216m","","","0.7107","MoKα","","0.0571","0.0388","","","0.0876","0.0955","","","","","","1.029","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114620","13.511","0.0005","31.017","0.001","13.371","0.0005","90","","116.379","0.002","90","","5019.9","0.3","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-Bromo-3,4-dimethyl-1,6,7-tris(tri-tert-butylsilyl)- 1,6,7-trigermabicyclo[4.1.0]hept-3-ene","","- C42 H91 Br Ge3 Si3 -","- C42 H91 Br Ge3 Si3 -","- C168 H364 Br4 Ge12 Si12 -","4","1","","Akira Sekiguchi; Yutaka Ishida; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","The First Halogen-Substituted Cyclotrigermenes: A Unique Halogen Walk over the Three-Membered Ring Skeleton and Facial Stereoselectivity in the Diels-Alder Reaction","Journal of the American Chemical Society","2002","124","","1158","1159","10.1021/ja012216m","","","0.7107","MoKα","","0.0457","0.0376","","","0.097","0.1015","","","","","","1.046","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114621","13.531","0.0009","31.353","0.001","13.455","0.0009","90","","116.705","0.003","90","","5099.2","0.5","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-Iodo-3,4-dimethyl-1,6,7-tris(tri-tert-butylsilyl)- 1,6,7-trigermabicyclo[4.1.0]hept-3-ene","","- C42 H91 Ge3 I Si3 -","- C42 H91 Ge3 I Si3 -","- C168 H364 Ge12 I4 Si12 -","4","1","","Akira Sekiguchi; Yutaka Ishida; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","The First Halogen-Substituted Cyclotrigermenes: A Unique Halogen Walk over the Three-Membered Ring Skeleton and Facial Stereoselectivity in the Diels-Alder Reaction","Journal of the American Chemical Society","2002","124","","1158","1159","10.1021/ja012216m","","","0.7107","MoKα","","0.0973","0.0644","","","0.1561","0.1779","","","","","","1.023","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114622","30.589","0.005","11.6164","0.0019","30.605","0.005","90","","107.867","0.003","90","","10351","3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","01060a","","","- C37 H78 K2 Mn N11 O8 -","- C37.007 H78 K2 Mn N11.0005 O8.0025 -","- C296.056 H624 K16 Mn8 N88.004 O64.02 -","8","2","","Rajeev Gupta; Cora E. MacBeth; Victor G. Young; A. S. Borovik","Isolation of Monomeric MnIII/II-OH and MnIII-O Complexes from Water: Evaluation of O-H Bond Dissociation Energies","Journal of the American Chemical Society","2002","124","","1136","1137","10.1021/ja016741x","","","0.71073","MoKα","","0.0891","0.0701","","","0.1629","0.1718","","","","","","1.063","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114623","10.0439","0.0006","10.7647","0.0007","35.262","0.002","90","","90","","90","","3812.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H25 N O -","- C24 H25 N O -","- C192 H200 N8 O8 -","8","2","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.1214","0.0592","","","0.1123","0.1366","","","","","","1.03","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114624","10.0281","0.0004","11.4783","0.0005","16.8217","0.0007","90","","95.653","0.01","90","","1926.85","0.14","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H25 N O -","- C24 H25 N O -","- C96 H100 N4 O4 -","4","2","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0558","0.0414","","","0.0925","0.0983","","","","","","1.036","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114625","10.23","0.0003","9.0097","0.0003","12.3888","0.0003","90","","108.482","0.001","90","","1082.97","0.06","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H29 N O3 -","- C26 H29 N O3 -","- C52 H58 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0445","0.0327","","","0.0714","0.0746","","","","","","1.003","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114626","17.988","0.002","7.0987","0.0008","17.823","0.002","90","","109.749","0.008","90","","2142","0.4","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C24 H23 Cl2 N O -","- C24 H23 Cl2 N O -","- C96 H92 Cl8 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0573","0.0517","","","0.1257","0.1278","","","","","","1.031","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114627","9.4192","0.0001","10.1201","0.0001","11.8636","0.0003","90","","106.668","0.002","90","","1083.36","0.03","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H29 N O3 -","- C26 H29 N O3 -","- C52 H58 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0452","0.0424","","","0.1127","0.1144","","","","","","1.086","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114628","5.2543","0.0004","10.236","0.0008","11.3852","0.0009","71.562","0.001","87.505","0.001","80.018","0.001","572.06","0.08","213","2","213","2","","","","","","","","5","P 1","P 1","1","","","","- C26 H29 Hg N O3 -","- C26 H29 Hg N O3 -","- C26 H29 Hg N O3 -","1","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0316","0.0315","","","0.0751","0.0752","","","","","","1.053","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114629","9.4494","0.0009","9.702","0.001","13.061","0.001","90","","110.371","0.002","90","","1122.52","0.18","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H34 N O3 -","- C26 H34 N O3 -","- C52 H68 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0463","0.0426","","","0.1096","0.1137","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114630","10.555","0.002","10.119","0.002","26.478","0.004","90","","99.201","0.002","90","","2791.6","0.9","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H23 N O S -","- C22 H23 N O S -","- C132 H138 N6 O6 S6 -","6","3","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0991","0.0918","","","0.2415","0.2466","","","","","","1.073","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114631","10.0585","0.0005","10.4847","0.0005","34.977","0.002","90","","90","","90","","3688.7","0.3","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H23 N O S -","- C22 H23 N O S -","- C176 H184 N8 O8 S8 -","8","2","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0895","0.0544","","","0.0919","0.103","","","","","","1.059","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114632","10.0869","0.0006","10.8633","0.0006","35.817","0.002","90","","90","","90","","3924.7","0.4","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 F N O -","- C24 H24 F N O -","- C192 H192 F8 N8 O8 -","8","2","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0731","0.045","","","0.0937","0.1062","","","","","","1","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114633","8.4524","0.0007","8.0786","0.0007","13.8705","0.0012","90","","98.816","0.002","90","","935.94","0.14","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H27 N O3 -","- C21 H27 N O3 -","- C42 H54 N2 O6 -","2","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0412","0.0403","","","0.1094","0.1107","","","","","","1.021","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114634","8.3269","0.0004","8.4131","0.0004","29.128","0.002","90","","90","","90","","2040.6","0.2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H27 N O3 -","- C25 H27 N O3 -","- C100 H108 N4 O12 -","4","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0658","0.0465","","","0.0931","0.102","","","","","","1.015","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114635","5.2688","0.0003","21.7645","0.0012","9.7497","0.0006","90","","93.748","0.001","90","","1115.63","0.11","213","2","213","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H24 Cl N O S -","- C26 H24 Cl N O S -","- C52 H48 Cl2 N2 O2 S2 -","2","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0369","0.0318","","","0.0796","0.0823","","","","","","1.034","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114636","10.3574","0.0006","10.6801","0.0006","19.388","0.001","90","","90","","90","","2144.7","0.2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H26 N O -","- C28 H26 N O -","- C112 H104 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0712","0.0483","","","0.1169","0.1296","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114637","8.4546","0.0007","22.244","0.002","32.612","0.002","90","","90","","90","","6133.1","0.8","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H30.67 N O3 -","- C23 H30.6667 N O3 -","- C276 H368 N12 O36 -","12","3","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.1093","0.0735","","","0.1948","0.2281","","","","","","1","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114638","9.9023","0.0009","10.6217","0.0009","18.945","0.001","90","","90","","90","","1992.6","0.3","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H23 N O -","- C26 H23 N O -","- C104 H92 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0661","0.0413","","","0.0823","0.094","","","","","","1.055","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114639","17.8106","0.0017","11.6626","0.0012","15.5911","0.0015","90","","111.956","0.002","90","","3003.7","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H40 Br4 Li4 O4 -","- C16 H40 Br4 Li4 O4 -","- C64 H160 Br16 Li16 O16 -","4","0.5","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0912","0.0423","","","0.0983","0.1097","","","","","","1.031","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114640","7.698","0.003","15.236","0.006","17.271","0.007","90","","90","","90","","2025.7","1.4","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H27 N O -","- C25 H27 N O -","- C100 H108 N4 O4 -","4","1","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0645","0.0418","","","0.0899","0.101","","","","","","1.017","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114641","9.5252","0.0004","11.3143","0.0005","13.6606","0.0007","84.852","0.001","86.093","0.001","71.928","0.001","1392.68","0.11","213","2","213","2","","","","","","","","4","P 1","P 1","1","","","","- C33 H35 N O4 -","- C33 H35 N O4 -","- C66 H70 N2 O8 -","2","2","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0329","0.0319","","","0.0885","0.0897","","","","","","1.008","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114642","10.1078","0.001","11.1252","0.001","17.0275","0.0016","90","","101.302","0.002","90","","1877.6","0.3","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H20 Br N O -","- C22 H20 Br N O -","- C88 H80 Br4 N4 O4 -","4","2","","David R. Spring; Shyam Krishnan; Helen E. Blackwell; Stuart L. Schreiber","Diversity-Oriented Synthesis of Biaryl-Containing Medium Rings Using a One Bead/One Stock Solution Platform","Journal of the American Chemical Society","2002","124","","1354","1363","10.1021/ja017248o","","","0.71073","MoKα","","0.0984","0.0458","","","0.0625","0.0692","","","","","","1.002","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114643","12.4805","0.001","18.1277","0.0014","18.8005","0.0015","90","","91.808","0.002","90","","4251.4","0.6","173","2","1713","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C39 H36 Co2 F12 N10 O5 P2 -","- C39 H36 Co2 F12 N10 O5 P2 -","- C156 H144 Co8 F48 N40 O20 P8 -","4","1","","Anna L. Gavrilova; C. Jin Qin; Roger D. Sommer; Arnold L. Rheingold; B. Bosnich","Bimetallic Reactivity. One-Site Addition Two-Metal Oxidation Reaction of Dioxygen with a Bimetallic Dicobalt(II) Complex Bearing Five- and Six-Coordinate Sites","Journal of the American Chemical Society","2002","124","","1714","1722","10.1021/ja012386z","","","0.71073","MoKα","","0.1934","0.0764","","","0.1517","0.1973","","","","","","1.005","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114644","10.4971","0.0011","11.383","0.0013","19.466","0.002","91.013","0.002","101.484","0.002","110.07","0.002","2131.6","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H39 Co2 F6 N12 O7 P -","- C41 H39 Co2 F6 N12 O7 P -","- C82 H78 Co4 F12 N24 O14 P2 -","2","1","","Anna L. Gavrilova; C. Jin Qin; Roger D. Sommer; Arnold L. Rheingold; B. Bosnich","Bimetallic Reactivity. One-Site Addition Two-Metal Oxidation Reaction of Dioxygen with a Bimetallic Dicobalt(II) Complex Bearing Five- and Six-Coordinate Sites","Journal of the American Chemical Society","2002","124","","1714","1722","10.1021/ja012386z","","","0.71073","MoKα","","0.1113","0.0574","","","0.107","0.1279","","","","","","1.034","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114645","11.7787","0.0004","21.2005","0.0008","17.3676","0.0007","90","","94.669","0.002","90","","4322.5","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H65 Cl2 N2 P Ru -","- C46 H65 Cl2 N2 P Ru -","- C184 H260 Cl8 N8 P4 Ru4 -","4","1","","Robert G. Carlson; Melanie A. Gile; Joseph A. Heppert; Mark H. Mason; Douglas R. Powell; David Vander Velde; Joseph M. Vilain","The Metathesis-Facilitated Synthesis of Terminal Ruthenium Carbide Complexes: A Unique Carbon Atom Transfer Reaction","Journal of the American Chemical Society","2002","124","","1580","1581","10.1021/ja017088g","","","0.71073","MoKα","","0.0384","0.0327","","","0.085","0.0882","","","","","","1.052","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114646","33.671","0.004","14.449","0.002","18.512","0.001","90","","109.014","0.004","90","","8514.9","1.6","109.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H61 O14.5 Si8 -","- C24 H61 O14.5 Si8 -","- C192 H488 O116 Si64 -","8","1","","Masafumi Unno; Akiko Suto; Hideyuki Matsumoto","Pentacyclic Laddersiloxane","Journal of the American Chemical Society","2002","124","","1574","1575","10.1021/ja0173876","","","0.7107","MoKα","","","0.0691","","","","0.1801","","","","","","1.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114647","14.6572","0.0005","21.73","0.001","12.7694","0.0005","90.327","0.001","102.541","0.003","97.133","0.003","3937.1","0.3","288.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C60 H104 O16 Si12 -","- C60 H104 O16 Si12 -","- C120 H208 O32 Si24 -","2","1","","Masafumi Unno; Akiko Suto; Hideyuki Matsumoto","Pentacyclic Laddersiloxane","Journal of the American Chemical Society","2002","124","","1574","1575","10.1021/ja0173876","","","0.7107","MoKα","","","0.0568","","","","0.1603","","","","","","1.778","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114648","7.7991","0.0003","7.3372","0.0003","19.2695","0.0008","90","","90","","90","","1102.67","0.08","193","2","193","2","","","","","","","original synthesis","4","P b c a","-P 2ac 2ab","61","","","","- I K Mo O6 -","- I K Mo O6 -","- I8 K8 Mo8 O48 -","8","1","","Richard E. Sykora; Kang Min Ok; P. Shiv Halasyamani; Thomas E. Albrecht-Schmitt","Structural Modulation of Molybdenyl Iodate Architectures by Alkali Metal Cations in AMoO3(IO3) (A = K, Rb, Cs): A Facile Route to New Polar Materials with Large SHG Responses","Journal of the American Chemical Society","2002","124","","1951","1957","10.1021/ja012190z","","","0.71073","MoKα","","0.0222","0.0216","","0.0525","0.0521","","","","1.166","1.168","1.168","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114649","7.7277","0.0006","10.2137","0.0008","7.3442","0.0006","90","","90","","90","","579.67","0.08","193","2","193","2","","","","","","","original synthesis","4","P n a 21","P 2c -2n","33","","","","- I Mo O6 Rb -","- I Mo O6 Rb -","- I4 Mo4 O24 Rb4 -","4","1","","Richard E. Sykora; Kang Min Ok; P. Shiv Halasyamani; Thomas E. Albrecht-Schmitt","Structural Modulation of Molybdenyl Iodate Architectures by Alkali Metal Cations in AMoO3(IO3) (A = K, Rb, Cs): A Facile Route to New Polar Materials with Large SHG Responses","Journal of the American Chemical Society","2002","124","","1951","1957","10.1021/ja012190z","","","0.71073","MoKα","","0.0207","0.0194","","0.0421","0.0413","","","","0.946","0.947","0.947","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114650","7.8633","0.0005","10.392","0.0006","7.3869","0.0005","90","","90","","90","","603.62","0.07","193","2","193","2","","","","","","","original synthesis","4","P n a 21","P 2c -2n","33","","","","- Cs I Mo O6 -","- Cs I Mo O6 -","- Cs4 I4 Mo4 O24 -","4","1","","Richard E. Sykora; Kang Min Ok; P. Shiv Halasyamani; Thomas E. Albrecht-Schmitt","Structural Modulation of Molybdenyl Iodate Architectures by Alkali Metal Cations in AMoO3(IO3) (A = K, Rb, Cs): A Facile Route to New Polar Materials with Large SHG Responses","Journal of the American Chemical Society","2002","124","","1951","1957","10.1021/ja012190z","","","0.71073","MoKα","","0.0214","0.0209","","0.0517","0.0515","","","","1.117","1.124","1.124","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114651","8.5567","0.0007","9.7163","0.0008","13.419","0.0011","90","","101.622","0.001","90","","1092.78","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 F6 Mg O11 S2 -","- C12 H20 F6 Mg O11 S2 -","- C24 H40 F12 Mg2 O22 S4 -","2","0.5","","Elizabeth R. Sanchez; Mary C. Gessel; Thomas L. Groy; M. Tyler Caudle","Interaction of Biotin with Mg-O Bonds: Bifunctional Binding and Recognition of Biotin and Related Ligands by the Mg(15-crown-5)2+ Unit","Journal of the American Chemical Society","2002","124","","1933","1940","10.1021/ja016641r","","","0.71073","MoKα","","0.0691","0.0551","","","0.1603","0.1709","","","","","","1.071","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114652","11.3401","0.0005","8.7376","0.0004","24.6423","0.0012","90","","90.944","0.001","90","","2441.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H20 N2 O5 -","- C31 H20 N2 O5 -","- C124 H80 N8 O20 -","4","1","","Radoslaw S. Laufer; Gary I. Dmitrienko","Diazo Group Electrophilicity in Kinamycins and Lomaiviticin A: Potential Insights into the Molecular Mechanism of Antibacterial and Antitumor Activity","Journal of the American Chemical Society","2002","124","","1854","1855","10.1021/ja0167809","","","0.71073","MoKα","","0.1048","0.047","","","0.0859","0.1009","","","","","","0.789","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114653","26.7074","0.0001","26.7074","0.0001","23.3649","0.0002","90","","90","","120","","14433","0.15","188","2","188","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C162 H378 N102 O159 Pt3 -","- C162 H180 N99 O150 Pt3 -","- C324 H360 N198 O300 Pt6 -","2","0.166667","","Ki-Min Park; Soo-Young Kim; Jungseok Heo; Dongmok Whang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","Designed Self-Assembly of Molecular Necklaces","Journal of the American Chemical Society","2002","124","","2140","2147","10.1021/ja011654q","","","0.71073","MoKα","","0.1174","0.0957","","0.277","0.2523","","","","1.066","1.121","1.121","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114654","15.756","0.0001","26.462","0.0002","43.2486","0.0005","90","","94.425","0.001","90","","17978.1","0.3","188","2","188","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C224 H462 N132 O171 Pt4 -","- C224 H270 N132 O174 Pt4 -","- C448 H540 N264 O348 Pt8 -","2","1","","Ki-Min Park; Soo-Young Kim; Jungseok Heo; Dongmok Whang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","Designed Self-Assembly of Molecular Necklaces","Journal of the American Chemical Society","2002","124","","2140","2147","10.1021/ja011654q","","","0.71073","MoKα","","0.1159","0.0801","","","0.1733","0.2062","","","","","","1.162","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114655","15.692","0.006","22.449","0.009","46.706","0.018","77.657","0.017","83.39","0.03","88.67","0.05","15966","11","188","2","188","2","","","","","","","","5","P -1","-P 1","2","","","","- C201 H380 N126 O154 Pt3 -","- C201 H193 N122 O141.96 Pt3 -","- C402 H386 N244 O283.92 Pt6 -","2","1","","Ki-Min Park; Soo-Young Kim; Jungseok Heo; Dongmok Whang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","Designed Self-Assembly of Molecular Necklaces","Journal of the American Chemical Society","2002","124","","2140","2147","10.1021/ja011654q","","","0.71073","MoKα","","0.3266","0.2252","","","0.4277","0.5035","","","","","","1.118","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114656","20.9026","0.0007","26.5756","0.0009","27.7713","0.001","90","","90","","90","","15426.9","0.9","193","2","193","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","Calix[4]arene 1,3-alt tetramethylamide-HCl","","","- C40 H50 Cl N4 O11 -","- C40 H50 Cl N4 O11 -","- C640 H800 Cl16 N64 O176 -","16","0.5","","Vladimir Sidorov; Frank W. Kotch; Galya Abdrakhmanova; Robert Mizani; James C. Fettinger; Jeffery T. Davis","Ion Channel Formation from a Calix[4]arene Amide That Binds HCl","Journal of the American Chemical Society","2002","124","","2267","2278","10.1021/ja012338e","","","0.71073","MoKα","","0.0851","0.0617","","","0.1785","0.1958","","","","","","1.06","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114657","10.1237","0.0003","22.74","0.0007","17.7902","0.0006","90","","97.07","0.001","90","","4064.4","0.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Calix[4]arene 1,3-alt tetramethylamide-HCl","","","- C41 H48 Cl3 N4 O9 -","- C41 H48 Cl3 N4 O9 -","- C164 H192 Cl12 N16 O36 -","4","1","","Vladimir Sidorov; Frank W. Kotch; Galya Abdrakhmanova; Robert Mizani; James C. Fettinger; Jeffery T. Davis","Ion Channel Formation from a Calix[4]arene Amide That Binds HCl","Journal of the American Chemical Society","2002","124","","2267","2278","10.1021/ja012338e","","","0.71073","MoKα","","0.057","0.0431","","","0.1117","0.1196","","","","","","1.092","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114658","15.4419","0.0006","15.4419","0.0006","6.3764","0.0002","90","","90","","90","","1520.47","0.1","90","2","90","2","","","","","","","","7","P 42/m n m","-P 4n 2n","136","[Au{C(NHCH3)2}2]PF6.0.5acetone","","","- C7.5 H19 Au F6 N4 O0.5 P -","- C7.5 H16 Au F6 N4 O0.5 P -","- C30 H64 Au4 F24 N16 O2 P4 -","4","0.25","","Rochelle L. White-Morris; Marilyn M. Olmstead; Feilong Jiang; Dino S. Tinti; Alan L. Balch","Remarkable Variations in the Luminescence of Frozen Solutions of [Au{C(NHMe)2}2](PF6).0.5(Acetone). Structural and Spectroscopic Studies of the Effects of Anions and Solvents on Gold(I) Carbene Complexes","Journal of the American Chemical Society","2002","124","","2327","2336","10.1021/ja012397s","","","0.71073","MoKα","","0.0241","0.0162","","","0.0371","0.0411","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114659","11.9132","0.0007","14.6089","0.0009","6.8923","0.0004","90","","94.588","0.001","90","","1195.68","0.12","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Au{C(NHMe)2}2].BF4","","","- C6 H16 Au B F4 N4 -","- C6 H16 Au B F4 N4 -","- C24 H64 Au4 B4 F16 N16 -","4","0.5","","Rochelle L. White-Morris; Marilyn M. Olmstead; Feilong Jiang; Dino S. Tinti; Alan L. Balch","Remarkable Variations in the Luminescence of Frozen Solutions of [Au{C(NHMe)2}2](PF6).0.5(Acetone). Structural and Spectroscopic Studies of the Effects of Anions and Solvents on Gold(I) Carbene Complexes","Journal of the American Chemical Society","2002","124","","2327","2336","10.1021/ja012397s","","","0.71073","MoKα","","0.0162","0.0153","","","0.0358","0.0361","","","","","","1.148","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114660","12.2551","0.0006","7.2162","0.0004","8.5987","0.0004","90","","98.428","0.001","90","","752.22","0.07","90","2","90","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","[Au{C(NMe2)(NHMe)}2](PF6)","","","- C8 H20 Au F6 N4 P -","- C8 H20 Au F6 N4 P -","- C16 H40 Au2 F12 N8 P2 -","2","0.25","","Rochelle L. White-Morris; Marilyn M. Olmstead; Feilong Jiang; Dino S. Tinti; Alan L. Balch","Remarkable Variations in the Luminescence of Frozen Solutions of [Au{C(NHMe)2}2](PF6).0.5(Acetone). Structural and Spectroscopic Studies of the Effects of Anions and Solvents on Gold(I) Carbene Complexes","Journal of the American Chemical Society","2002","124","","2327","2336","10.1021/ja012397s","","","0.71073","MoKα","","0.0143","0.0143","","","0.035","0.035","","","","","","1.07","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114661","10.6037","0.0002","11.9623","0.0003","15.2316","0.0001","96.627","0.001","107.77","0.001","94.86","0.001","1812.82","0.06","293","2","293","2","","","","","","","synthetic","5","P -1","-P 1","2","","","","- C59 H122 Mo2 N18 O4 -","- C59 H102 Mo2 N18 O4 -","- C59 H102 Mo2 N18 O4 -","1","0.5","","Laurance G. Beauvais; Jeffrey R. Long","Cyanide-Limited Complexation of Molybdenum(III): Synthesis of Octahedral [Mo(CN)6]3- and Cyano-Bridged [Mo2(CN)11]5-","Journal of the American Chemical Society","2002","124","","2110","2111","10.1021/ja0175901","","","0.71073","MoKα","","0.0768","0.0604","","0.184","0.1642","","","","1.034","1.085","1.085","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114662","13.5285","0.0003","13.5285","0.0003","35.853","0.0002","90","","90","","120","","5682.71","0.18","293","2","293","2","","","","","","","synthetic","6","R -3 c :H","-R 3 2""c","167","lithium molybdenum hexacyanide","","","- C24 H42 Li3 Mo N12 O6 -","- C24 H42 Li3 Mo N12 O6 -","- C144 H252 Li18 Mo6 N72 O36 -","6","0.166667","","Laurance G. Beauvais; Jeffrey R. Long","Cyanide-Limited Complexation of Molybdenum(III): Synthesis of Octahedral [Mo(CN)6]3- and Cyano-Bridged [Mo2(CN)11]5-","Journal of the American Chemical Society","2002","124","","2110","2111","10.1021/ja0175901","","","0.71073","MoKα","","0.0522","0.0426","","0.1301","0.1231","","","","1.112","1.157","1.157","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114663","7.4788","0.001","18.612","0.003","16.626","0.002","90","","98.998","0.003","90","","2285.8","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 N2 O4 -","- C28 H30 N2 O4 -","- C112 H120 N8 O16 -","4","1","","Jerry L. Atwood; Leonard J. Barbour; Agoston Jerga","Supramolecular Stabilization of N2H7+","Journal of the American Chemical Society","2002","124","","2122","2123","10.1021/ja017722q","","","0.71073","MoKα","","0.0809","0.0476","","","0.1035","0.1154","","","","","","1.024","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114664","16.7396","0.0014","9.5039","0.0008","23.1323","0.0019","90","","105.072","0.002","90","","3553.6","0.5","173","2","173","2","","","","","","","Nermeen Abolella","4","P 1 21/n 1","-P 2yn","14","01357","","","- C37 H56 Cu N3 -","- C37 H56 Cu N3 -","- C148 H224 Cu4 N12 -","4","1","","Douglas J. E. Spencer; Nermeen W. Aboelella; Anne M. Reynolds; Patrick L. Holland; William B. Tolman","β-Diketiminate Ligand Backbone Structural Effects on Cu(I)/O2 Reactivity: Unique Copper-Superoxo and Bis(μ-oxo) Complexes","Journal of the American Chemical Society","2002","124","","2108","2109","10.1021/ja017820b","","","0.71073","MoKα","","0.0833","0.0482","","","0.0967","0.1079","","","","","","1.02","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4114665","31.3411","0.0013","18.1396","0.0007","22.9236","0.0009","90","","126.494","0.001","90","","10477","0.7","173","2","173","2","","","","","","","Patrick Holland","4","C 1 2/c 1","-C 2yc","15","00079","L(iPr)Cu(NCMe)","","- C31 H44 Cu N3 -","- C31 H44 Cu N3 -","- C372 H528 Cu12 N36 -","12","1.5","","Douglas J. E. Spencer; Nermeen W. Aboelella; Anne M. Reynolds; Patrick L. Holland; William B. Tolman","β-Diketiminate Ligand Backbone Structural Effects on Cu(I)/O2 Reactivity: Unique Copper-Superoxo and Bis(μ-oxo) Complexes","Journal of the American Chemical Society","2002","124","","2108","2109","10.1021/ja017820b","","","0.71073","MoKα","","0.0618","0.0373","","","0.0844","0.0915","","","","","","0.98","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114666","9.927","0.003","20.216","0.005","16.489","0.005","90","","96.031","0.004","90","","3290.8","1.6","173","2","173","2","","","","","","","Doug Spencer","4","C 1 c 1","C -2yc","9","01077","[Ph(H2LiPr)Cu(MeCN)]","","- C35 H44 Cu N3 -","- C35 H38 Cu N3 -","- C140 H152 Cu4 N12 -","4","1","","Douglas J. E. Spencer; Nermeen W. Aboelella; Anne M. Reynolds; Patrick L. Holland; William B. Tolman","β-Diketiminate Ligand Backbone Structural Effects on Cu(I)/O2 Reactivity: Unique Copper-Superoxo and Bis(μ-oxo) Complexes","Journal of the American Chemical Society","2002","124","","2108","2109","10.1021/ja017820b","","","0.71073","MoKα","","0.0407","0.0393","","","0.105","0.1062","","","","","","1.025","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4114667","15.031","0.002","10.218","0.001","24.906","0.003","90","","100.99","0.01","90","","3755.1","0.8","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C29 H65 F3 N4 O3 P2 S Si -","- C29 H65 F3 N4 O3 P2 S Si -","- C116 H260 F12 N16 O12 P8 S4 Si4 -","4","1","","Tsuyoshi Kato; Heinz Gornitzka; Antoine Baceiredo; Wolfgang W. Schoeller; Guy Bertrand","Synthesis and Rearrangement of Diphosphorus Analogues of Amidinium Salts","Journal of the American Chemical Society","2002","124","","2506","2512","10.1021/ja010347h","","","0.71073","MoKα","","0.0645","0.0484","","","0.1222","0.1328","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114668","9.9435","0.0004","21.9177","0.0008","18.3228","0.0007","90","","90.278","0.001","90","","3993.2","0.3","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H61 Cl4 Ga N4 P2 Si2 -","- C26 H61 Cl4 Ga N4 P2 Si2 -","- C104 H244 Cl16 Ga4 N16 P8 Si8 -","4","1","","Tsuyoshi Kato; Heinz Gornitzka; Antoine Baceiredo; Wolfgang W. Schoeller; Guy Bertrand","Synthesis and Rearrangement of Diphosphorus Analogues of Amidinium Salts","Journal of the American Chemical Society","2002","124","","2506","2512","10.1021/ja010347h","","","0.71073","MoKα","","0.0604","0.0469","","","0.1103","0.1192","","","","","","1.109","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114669","11.08","0.002","11.08","0.002","16.0239","0.0007","90","","90","","90","","1967.2","0.5","298","","","","","","","","","","","7","P 4/n c c :2","-P 4a 2ac","130","","","","- C20 H20 Cu F6 N4 O2 Si -","- C20 H16 Cu F6 N4 O2 Si -","- C80 H64 Cu4 F24 N16 O8 Si4 -","4","0.25","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.0544","","","","0.072","","","","","","2.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114670","11.113","0.004","11.113","0.004","8.263","0.006","90","","90","","90","","1020.5","0.9","298","","","","","","","","","","","7","P 4/m m m","-P 4 2","123","","","","- C20 H32 Cu F6 Ge N4 O8 -","- C20 H16 Cu F6 Ge N4 O8 -","- C20 H16 Cu F6 Ge N4 O8 -","1","0.0625","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.0758","","","","0.0757","","","","","","2.635","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114671","11.146","0.004","11.146","0.004","15.941","0.007","90","","90","","90","","1980.4","1.3","298","","","","","","","","","","","7","P 4/n c c :2","-P 4a 2ac","130","","","","- C20 H20 Cu F6 Ge N4 O2 -","- C20 H16 Cu F6 Ge N4 O2 -","- C80 H64 Cu4 F24 Ge4 N16 O8 -","4","0.25","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.0773","","","","0.0953","","","","","","2.664","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114672","45.47","0.01","20.523","0.008","8.229","0.003","90","","90","","90","","7679","4","223","","","","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C29 H38 Cu F12 N5 O5 P2 -","- C29 H30 Cu F12 N5 O5 P2 -","- C232 H240 Cu8 F96 N40 O40 P16 -","8","","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.1002","","","","0.1259","","","","","","3.373","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114673","44.87","0.01","20.292","0.005","8.17","0.002","90","","90","","90","","7439","3","223","","","","","","","","","","","8","A b a 2","A 2 -2ab","41","","","","- C29 H38 Cl Cu F6 N5 O9 P -","- C29 H30 Cl Cu F6 N5 O9 P -","- C232 H240 Cl8 Cu8 F48 N40 O72 P8 -","8","","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.0971","","","","0.1226","","","","","","3.333","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114674","22.184","0.002","15.313","0.001","11.1085","0.0008","90","","93.704","0.003","90","","3765.7","0.5","298","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C40 H36 Cu2 F18 N9 O5 P3 -","- C40 H32 Cu2 F18 N9 O5 P3 -","- C80 H64 Cu4 F36 N18 O10 P6 -","2","0.25","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.0642","","","","0.1267","","","","","","3.385","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114675","11.1611","0.0006","13.1786","0.0007","22.1972","0.0002","90","","92.569","0.003","90","","3261.7","0.2","223","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 Cu F12 N7 P2 -","- C26 H25 Cu F12 N7 P2 -","- C104 H100 Cu4 F48 N28 P8 -","4","1","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.0689","","","","0.0742","","","","","","3.339","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114676","11.0449","0.0006","11.0449","0.0006","8.055","0.001","90","","90","","90","","982.63","0.14","173","","","","","","","","","","","7","P 4/m m m","-P 4 2","123","","","","- C20 H26 Cu F6 N4 O5 Si -","- C20 H16 Cu F6 N4 O5 Si -","- C20 H16 Cu F6 N4 O5 Si -","1","0.0625","","Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita","Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers","Journal of the American Chemical Society","2002","124","","2568","2583","10.1021/ja0113192","","","0.7107","MoKα","","","0.1287","","","","0.1357","","","","","","3.891","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114677","6.3902","0.0002","8.5992","0.0001","11.0202","0.0004","85.291","0.002","86.502","0.002","89.568","0.001","602.4","0.03","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H15 Cl2 Cr O -","- C10 H15 Cl2 Cr O -","- C20 H30 Cl4 Cr2 O2 -","2","1","","James S. Hess; Somying Leelasubcharoen; Arnold L. Rheingold; Douglas J. Doren; Klaus H. Theopold","Spin Surface Crossing in Chromium-Mediated Olefin Epoxidation with O2","Journal of the American Chemical Society","2002","124","","2454","2455","10.1021/ja0167553","","","0.71073","MoKα","","0.0924","0.0666","","","0.1859","0.2086","","","","","","1.4","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114678","28.027","0.0019","11.0543","0.0007","38.51","0.003","90","","104.785","0.001","90","","11536.1","1.4","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C106 H154 Mo2 N6 Na2 O5 P2 -","- C106 H154 Mo2 N6 Na2 O5 P2 -","- C424 H616 Mo8 N24 Na8 O20 P8 -","4","0.5","","Theodor Agapie; Paula L. Diaconescu; Christopher C. Cummins","Methine (CH) Transfer via a Chlorine Atom Abstraction/Benzene-Elimination Strategy: Molybdenum Methylidyne Synthesis and Elaboration to a Phosphaisocyanide Complex","Journal of the American Chemical Society","2002","124","","2412","2413","10.1021/ja017278r","","","0.71073","MoKα","","0.0732","0.0664","","","0.1574","0.1604","","","","","","1.304","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114679","7.621","0.002","9.817","0.002","14.663","0.004","90","","91.74","0.03","90","","1096.5","0.5","20","","20","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C17 H35 Br O S Si -","- C34 H70 Br2 O2 S2 Si2 -","- C34 H70 Br2 O2 S2 Si2 -","","","","Song Ye; Zheng-Zheng Huang; Chun-An Xia; Yong Tang; Li-Xin Dai","A Novel Chiral Sulfonium Yilde: Highly Enantioselective Synthesis of Vinylcyclopropanes","Journal of the American Chemical Society","2002","124","","2432","2433","10.1021/ja0172969","","","0.7107","MoKalpha","","","0.062","","","0.069","","","","","2.44","2.44","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114680","7.4776","0.0017","9.396","0.002","22.56","0.005","90","","90","","90","","1585.1","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 Br N Si -","- C15 H18 Br N Si -","- C60 H72 Br4 N4 Si4 -","4","1","","Song Ye; Zheng-Zheng Huang; Chun-An Xia; Yong Tang; Li-Xin Dai","A Novel Chiral Sulfonium Yilde: Highly Enantioselective Synthesis of Vinylcyclopropanes","Journal of the American Chemical Society","2002","124","","2432","2433","10.1021/ja0172969","","","0.71073","MoKα","","0.1153","0.0426","","","0.0815","0.0958","","","","","","0.739","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114681","14.043","0.005","13.819","0.005","14.067","0.005","90","0.005","109.169","0.005","90","0.005","2578.5","1.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 O14 -","- C24 H32 O14 -","- C96 H128 O56 -","4","1","","Faiz Ahmed Khan; Jyotirmayee Dash","Synthesis of a Novel, Highly Symmetric Bis-Oxa-Bridged Compound","Journal of the American Chemical Society","2002","124","","2424","2425","10.1021/ja017371f","","","0.71069","MoKα","","0.2385","0.0674","","","0.1463","0.2015","","","","","","0.739","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114682","6.3322","0.0006","28.667","0.003","4.3637","0.0004","90","","90","","90","","792.12","0.13","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","cesium lead bismuth telluride (0.85/0.85/3.15/6)","","- Bi3.15 Cs0.85 Pb0.85 Te6 -","- Bi2 Cs0.42 Te3 -","- Bi8 Cs1.68 Te12 -","4","0.25","","Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis","CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures","Journal of the American Chemical Society","2002","124","","2410","2411","10.1021/ja017602i","","","0.71073","MoKα","","0.0475","0.0391","","","0.1049","0.1095","","","","","","1.153","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114683","4.3456","0.0006","32.476","0.005","12.5075","0.0018","90","","90","","90","","1765.2","0.4","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","cesium lead bismuth telluride (0.91/1.91/3.09/7)","","- Bi3.09 Cs0.91 Pb1.91 Te7 -","- Bi2.5 Cs0.455 Te3.5 -","- Bi20 Cs3.64 Te28 -","8","0.5","","Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis","CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures","Journal of the American Chemical Society","2002","124","","2410","2411","10.1021/ja017602i","","","0.71073","MoKα","","0.0489","0.041","","","0.1131","0.1179","","","","","","1.062","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114684","6.2613","0.0007","28.479","0.003","4.3207","0.0005","90","","90","","90","","770.45","0.15","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","cesium tin bismuth telluride (0.84/0.84/3.16/6)","","- Bi3.16 Cs0.84 Sn0.84 Te6 -","- Bi1.58 Cs0.42 Sn0.42 Te3 -","- Bi6.32 Cs1.68 Sn1.68 Te12 -","4","0.25","","Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis","CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures","Journal of the American Chemical Society","2002","124","","2410","2411","10.1021/ja017602i","","","0.71073","MoKα","","0.0557","0.0467","","","0.1358","0.1412","","","","","","1.213","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114685","4.3881","0.0006","33.139","0.004","12.6075","0.0016","90","","90","","90","","1833.3","0.4","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","","cesium tin bismuth telluride (0.88/1.88/3.12/7)","","- Bi3.12 Cs0.88 Sn1.88 Te7 -","- Bi1.558 Cs0.44 Sn0.942 Te3.5 -","- Bi12.464 Cs3.52 Sn7.536 Te28 -","8","0.5","","Kuei-Fang Hsu; Duck-Young Chung; Sangeeta Lal; Antje Mrotzek; Theodora Kyratsi; Tim Hogan; Mercouri G. Kanatzidis","CsMBi3Te6 and CsM2Bi3Te7 (M = Pb, Sn): New Thermoelectric Compounds with Low-Dimensional Structures","Journal of the American Chemical Society","2002","124","","2410","2411","10.1021/ja017602i","","","0.71073","MoKα","","0.0487","0.0353","","","0.0872","0.0922","","","","","","1.018","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114686","13.5216","0.0009","13.6028","0.0009","24.4984","0.0017","79.7","0.001","77.003","0.001","65.881","0.001","3988.1","0.5","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","(K-2,2,2-crypt)2[Ge9(BiPh2)2].en","","- C62 H100 Bi2 Ge9 K2 N6 O12 -","- C62 H100 Bi2 Ge9 K2 N6 O12 -","- C124 H200 Bi4 Ge18 K4 N12 O24 -","2","1","","Angel Ugrinov; Slavi C. Sevov","[Ph2Bi-(Ge9)-BiPh2]2-: A Deltahedral Zintl Ion Functionalized by Exo-Bonded Ligands","Journal of the American Chemical Society","2002","124","","2442","2443","10.1021/ja017813n","","","0.71073","MoKα","","0.0564","0.0457","","","0.1133","0.1175","","","","","","1.026","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114687","13.7111","0.0005","16.1389","0.0005","18.5093","0.0004","85.343","0.001","82.559","0.001","65.539","0.001","3695","0.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","[(Me3TACN)2Fe2(m-O2CArTol)2(MeCN)2](OTf)2","","","- C67 H84 Cl2 F6 Fe2 N8 O10 S2 -","- C67 H84 Cl2 F6 Fe2 N8 O10 S2 -","- C134 H168 Cl4 F12 Fe4 N16 O20 S4 -","2","1","","Edit Y. Tshuva; Dongwhan Lee; Weiming Bu; Stephen J. Lippard","Catalytic Oxidation by a Carboxylate-Bridged Non-Heme Diiron Complex","Journal of the American Chemical Society","2002","124","","2416","2417","10.1021/ja017890i","","","0.71073","MoKα","","0.1813","0.0775","","","0.1882","0.2288","","","","","","0.977","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114688","13.336","0.002","14.489","0.002","18.441","0.003","101.747","0.004","96.001","0.003","99.667","0.003","3403.4","0.9","273","2","273","2","","","","","","","","8","P -1","-P 1","2","[(Me3TACN)2Fe2(mO)(mO2CArTol)2](OTf)2 CH2Cl2","","","- C63 H77 Cl2 F6 Fe2 N6 O11 S2 -","- C63 H77 Cl2 F6 Fe2 N6 O11 S2 -","- C126 H154 Cl4 F12 Fe4 N12 O22 S4 -","2","1","","Edit Y. Tshuva; Dongwhan Lee; Weiming Bu; Stephen J. Lippard","Catalytic Oxidation by a Carboxylate-Bridged Non-Heme Diiron Complex","Journal of the American Chemical Society","2002","124","","2416","2417","10.1021/ja017890i","","","0.71073","MoKα","","0.3696","0.0966","","","0.1997","0.2984","","","","","","0.833","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114689","16.353","0.002","18.707","0.003","18.231","0.003","90","","90","","90","","5577.1","1.5","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","00348","","","- C40 H52 F12 Fe2 N8 O12 S4 -","- C40 H52 F12 Fe2 N8 O12 S4 -","- C160 H208 F48 Fe8 N32 O48 S16 -","4","1","","Kui Chen; Miquel Costas; Jinheung Kim; Adrianne K. Tipton; Lawrence Que","Olefin Cis-Dihydroxylation versus Epoxidation by Non-Heme Iron Catalysts: Two Faces of an FeIII-OOH Coin","Journal of the American Chemical Society","2002","124","","3026","3035","10.1021/ja0120025","","","0.71073","MoKα","","0.0755","0.0465","","","0.0857","0.0927","","","","","","0.974","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4114690","17.232","0.002","9.54","0.001","18.263","0.002","90","","117.312","0.002","90","","2667.6","0.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","00309","","","- C20 H26 F6 Fe N4 O6 S2 -","- C20 H26 F6 Fe N4 O6 S2 -","- C80 H104 F24 Fe4 N16 O24 S8 -","4","0.5","","Kui Chen; Miquel Costas; Jinheung Kim; Adrianne K. Tipton; Lawrence Que","Olefin Cis-Dihydroxylation versus Epoxidation by Non-Heme Iron Catalysts: Two Faces of an FeIII-OOH Coin","Journal of the American Chemical Society","2002","124","","3026","3035","10.1021/ja0120025","","","0.71073","MoKα","","0.0597","0.0369","","","0.0919","0.0991","","","","","","1.029","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4114691","12.171","0.003","8.4733","0.0018","18.946","0.004","90","","103.854","0.003","90","","1897","0.7","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Cl F6 N2 P Ru -","- C16 H22 Cl F6 N2 P Ru -","- C64 H88 Cl4 F24 N8 P4 Ru4 -","4","1","","Haimei Chen; John A. Parkinson; Simon Parsons; Robert A. Coxall; Robert O. Gould; Peter J. Sadler","Organometallic Ruthenium(II) Diamine Anticancer Complexes: Arene-Nucleobase Stacking and Stereospecific Hydrogen-Bonding in Guanine Adducts","Journal of the American Chemical Society","2002","124","","3064","3082","10.1021/ja017482e","","","0.71073","MoKα","","0.025","0.023","","","0.0616","0.0625","","","","","","1.062","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114692","11.122","0.0018","12.576","0.002","25.593","0.004","90","","90","","90","","3579.7","1","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C16 H20 Cl F6 N2 P Ru -","- C16 H20 Cl F6 N2 P Ru -","- C128 H160 Cl8 F48 N16 P8 Ru8 -","8","1","","Haimei Chen; John A. Parkinson; Simon Parsons; Robert A. Coxall; Robert O. Gould; Peter J. Sadler","Organometallic Ruthenium(II) Diamine Anticancer Complexes: Arene-Nucleobase Stacking and Stereospecific Hydrogen-Bonding in Guanine Adducts","Journal of the American Chemical Society","2002","124","","3064","3082","10.1021/ja017482e","","","0.71073","MoKα","","0.0516","0.0444","","","0.1021","0.1055","","","","","","1.038","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114693","13.2927","0.0014","15.9583","0.0017","15.0878","0.0016","90","","108.613","0.002","90","","3033.2","0.6","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H31 F12 N7 O2 P2 Ru -","- C22 H31 F12 N7 O2 P2 Ru -","- C88 H124 F48 N28 O8 P8 Ru4 -","4","1","","Haimei Chen; John A. Parkinson; Simon Parsons; Robert A. Coxall; Robert O. Gould; Peter J. Sadler","Organometallic Ruthenium(II) Diamine Anticancer Complexes: Arene-Nucleobase Stacking and Stereospecific Hydrogen-Bonding in Guanine Adducts","Journal of the American Chemical Society","2002","124","","3064","3082","10.1021/ja017482e","","","0.71073","MoKα","","0.0958","0.0896","","","0.2164","0.2203","","","","","","1.222","","","","has coordinates,has disorder","178917","2020-10-21","18:00:00",""
"4114694","8.85","0.003","11.543","0.004","17.556","0.005","103.254","0.004","92.885","0.004","90.983","0.004","1742.7","1","150","","150","","","","","","","","?","7","P 1","P 1","1","","","","- C24 H38.5 F12 N7 O8.75 P2 Ru -","- C24 H38.5 F12 N7 O8.75 P2 Ru -","- C48 H77 F24 N14 O17.5 P4 Ru2 -","2","2","","Haimei Chen; John A. Parkinson; Simon Parsons; Robert A. Coxall; Robert O. Gould; Peter J. Sadler","Organometallic Ruthenium(II) Diamine Anticancer Complexes: Arene-Nucleobase Stacking and Stereospecific Hydrogen-Bonding in Guanine Adducts","Journal of the American Chemical Society","2002","124","","3064","3082","10.1021/ja017482e","","","0.71073","MoKα","","","0.0665","","","","0.0695","","","","","","0.981","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114695","16.6279","0.0011","9.0528","0.0006","21.5446","0.0015","90","","99.677","0.001","90","","3196.9","0.4","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H35 F12 N7 O2 P2 Ru -","- C24 H35 F12 N7 O2 P2 Ru -","- C96 H140 F48 N28 O8 P8 Ru4 -","4","1","","Haimei Chen; John A. Parkinson; Simon Parsons; Robert A. Coxall; Robert O. Gould; Peter J. Sadler","Organometallic Ruthenium(II) Diamine Anticancer Complexes: Arene-Nucleobase Stacking and Stereospecific Hydrogen-Bonding in Guanine Adducts","Journal of the American Chemical Society","2002","124","","3064","3082","10.1021/ja017482e","","","0.71073","MoKα","","0.0695","0.0593","","","0.1336","0.1391","","","","","","1.132","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114696","10.6486","0.0017","12.317","0.002","13.006","0.002","73.957","0.002","79.483","0.002","84.977","0.002","1610.6","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H37 F12 N7 O3 P2 Ru -","- C25 H37 F12 N7 O3 P2 Ru -","- C50 H74 F24 N14 O6 P4 Ru2 -","2","1","","Haimei Chen; John A. Parkinson; Simon Parsons; Robert A. Coxall; Robert O. Gould; Peter J. Sadler","Organometallic Ruthenium(II) Diamine Anticancer Complexes: Arene-Nucleobase Stacking and Stereospecific Hydrogen-Bonding in Guanine Adducts","Journal of the American Chemical Society","2002","124","","3064","3082","10.1021/ja017482e","","","0.71073","MoKα","","0.0315","0.0291","","","0.0753","0.0768","","","","","","1.035","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114697","15.499","0.003","19.415","0.004","33.223","0.007","85.07","0.03","83.43","0.03","73.24","0.03","9495","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Rh6(CO)9(dppm)2(mu3-eta2,eta2,eta2-C60) (1)","Hexarhodiumnonacarbonyldi(bis(diphenylphosphino)methane)fullereneC60","","- C119 H44 O9 P4 Rh6 -","- C119 H44 O9 P4 Rh6 -","- C476 H176 O36 P16 Rh24 -","4","2","","Kwangyeol Lee; Hyunjoon Song; Bongsoo Kim; Joon T. Park; Sangwoo Park; Moon-Gun Choi","The First Fullerene-Metal Sandwich Complex: An Unusually Strong Electronic Communication between Two C60 Cages","Journal of the American Chemical Society","2002","124","","2872","2873","10.1021/ja017496k","","","0.71073","MoKα","","0.2764","0.1036","","","0.2154","0.2965","","","","","","0.941","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114698","17.59","0.03","23.98","0.05","31.9","0.06","90","","96.75","0.04","90","","13362","4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Rh6(CO)5(dppm)2(CNCH2C6H5)(mu3-eta2,eta2,eta2-C60)2 (2)","Hexarhodiumpentacarbonyldi(bis(diphenylphosphino)methane) benzylisocyanidedifullereneC60","","- C194.75 H57 Cl3 N O5 P4 Rh6 S5.5 -","- C194.75 H57 Cl3 N O5 P4 Rh6 S5.5 -","- C779 H228 Cl12 N4 O20 P16 Rh24 S22 -","4","1","","Kwangyeol Lee; Hyunjoon Song; Bongsoo Kim; Joon T. Park; Sangwoo Park; Moon-Gun Choi","The First Fullerene-Metal Sandwich Complex: An Unusually Strong Electronic Communication between Two C60 Cages","Journal of the American Chemical Society","2002","124","","2872","2873","10.1021/ja017496k","","","0.71073","MoKα","","0.1654","0.0848","","","0.229","0.2614","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114699","7.395","0.001","10.65","0","16.25","0","90","","99.52","0","90","","1262.17","0.17","273.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-Acetyl-3a-hydroxy-4-phenyl-3, 3a, 6, 6a-tetrahydro-2H-pentalen-1-one","","- C16 H16 O3 -","- C16 H16 O3 -","- C64 H64 O12 -","4","1","","Paul A. Wender; Gabriel G. Gamber; Robert D. Hubbard; Lei Zhang","Three-Component Cycloadditions: The First Transition Metal-Catalyzed [5+2+1] Cycloaddition Reactions","Journal of the American Chemical Society","2002","124","","2876","2877","10.1021/ja0176301","","","0.7107","MoKα","","","0.045","","","","0.101","","","","","","0.911","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114700","9.498","0.001","22.5","0","23.48","0","90","","90","","90","","5017.8","0.5","273.1","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3a-Hydroxy-6-oxo-3-phenyl-1,3a,4,5,6,6a-hexahydropentalene -2-carboxylic acid amide","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C240 H240 N16 O48 -","16","2","","Paul A. Wender; Gabriel G. Gamber; Robert D. Hubbard; Lei Zhang","Three-Component Cycloadditions: The First Transition Metal-Catalyzed [5+2+1] Cycloaddition Reactions","Journal of the American Chemical Society","2002","124","","2876","2877","10.1021/ja0176301","","","0.7107","MoKα","","","0.038","","","","0.097","","","","","","0.624","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114701","8.47","0","11.582","0.001","16.209","0.001","90","","103.09","0","90","","1548.78","0.16","273.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3a-Hydroxy-6-oxo-3-(trimethylsilyl)-1,3a,4,5,6,6a-tetrahydropentalene -2-carboxylic acid ethyl ester","","- C14 H22 O4 Si -","- C14 H22 O4 Si -","- C56 H88 O16 Si4 -","4","1","","Paul A. Wender; Gabriel G. Gamber; Robert D. Hubbard; Lei Zhang","Three-Component Cycloadditions: The First Transition Metal-Catalyzed [5+2+1] Cycloaddition Reactions","Journal of the American Chemical Society","2002","124","","2876","2877","10.1021/ja0176301","","","0.7107","MoKα","","","0.047","","","","0.113","","","","","","1.416","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114702","9.15","0","17.44","0","9.66","0","90","","92.31","0","90","","1540.25","","273.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3, 6-Dioxoo-2-(trimethylsilyl)-cyclooct-1-enecarboxylic acid ethyl ester","","- C14 H22 O4 Si -","- C14 H22 O4 Si -","- C56 H88 O16 Si4 -","4","1","","Paul A. Wender; Gabriel G. Gamber; Robert D. Hubbard; Lei Zhang","Three-Component Cycloadditions: The First Transition Metal-Catalyzed [5+2+1] Cycloaddition Reactions","Journal of the American Chemical Society","2002","124","","2876","2877","10.1021/ja0176301","","","0.7107","MoKα","","","0.045","","","","0.111","","","","","","0.847","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114703","13.2805","0.0007","10.3291","0.0005","22.9583","0.0012","90","","92.136","0.001","90","","3147.1","0.3","213","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tetrakis(anisylformamidinato)-bis(oxo)dimolybdenum(IV)","trans-bis-η^2^-(N,N'-di-(p-anisylformamidinato) -bis-μ~2~-oxobis(μ~2~-N,N'-di- (p-anisylformamidinato)dimolybdenum(IV)","","- C62 H64 Cl4 Mo2 N8 O10 -","- C62 H64 Cl4 Mo2 N8 O10 -","- C124 H128 Cl8 Mo4 N16 O20 -","2","0.5","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; J. Garrett Slaton","A Pseudo-Jahn-Teller Distortion in an Mo2(μ2-O)2 Ring Having the Shortest MoIV-MoIV Double Bond","Journal of the American Chemical Society","2002","124","","2878","2879","10.1021/ja025713r","","","0.71073","MoKα","","0.0621","0.0453","","","0.1138","0.1256","","","","","","1.052","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114704","10.9617","0.0006","11.7084","0.0007","15.7064","0.0009","90.159","0.001","109.177","0.001","98.745","0.001","1878.82","0.19","213","2","293","2","","","","","","","","5","P -1","-P 1","2","bis-acetato-bis-xylylformamidinato-bis-oxodimolybdenum(IV)","trans-di-η^2^-acetato-di-μ~2~-oxobis (μ~2~-N,N'-di-(2,6-xylylformamidinato) dimolybdenum(IV)","","- C38 H45 Mo2 N4 O6 -","- C38 H45 Mo2 N4 O6 -","- C76 H90 Mo4 N8 O12 -","2","1","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; J. Garrett Slaton","A Pseudo-Jahn-Teller Distortion in an Mo2(μ2-O)2 Ring Having the Shortest MoIV-MoIV Double Bond","Journal of the American Chemical Society","2002","124","","2878","2879","10.1021/ja025713r","","","0.71073","MoKα","","0.0342","0.0279","","","0.0681","0.0717","","","","","","1.049","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114705","16.8232","0.0014","14.517","0.0012","20.3207","0.0017","90","0.002","110.245","0.001","90","0.002","4656.2","0.7","213","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","bis-acetato-bis-xylylformamidinato-bis- oxodimolybdenum(IV) chloroform solvate","trans-di-η^2^-acetato-di-μ~2~-oxobis (μ~2~-N,N'-di-(2,6-xylylformamidinato) dimolybdenum(IV) chloroform solvate'","","- C39.93 H45.93 Cl5.8 Mo2 N4 O6 -","- C39.932 H45.932 Cl5.796 Mo2 N4 O6 -","- C159.728 H183.728 Cl23.184 Mo8 N16 O24 -","4","0.5","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; J. Garrett Slaton","A Pseudo-Jahn-Teller Distortion in an Mo2(μ2-O)2 Ring Having the Shortest MoIV-MoIV Double Bond","Journal of the American Chemical Society","2002","124","","2878","2879","10.1021/ja025713r","","","0.71073","MoKα","","0.0618","0.0458","","","0.116","0.1271","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114706","25.2041","0.0008","25.2041","0.0008","25.2041","0.0008","90","","90","","90","","16010.8","0.9","293","2","293","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","Ba16Na204Sn309.95","","","- Ba16 Na204 Sn309.95 -","- Ba16 Na204 Sn310.096 -","- Ba16 Na204 Sn310.096 -","1","0.0104167","","Svilen Bobev; Slavi C. Sevov","Naked Clusters of 56 Tin Atoms in the Solid State","Journal of the American Chemical Society","2002","124","","3359","3365","10.1021/ja012549j","","","0.71073","MoKα","","0.0362","0.0354","","","0.1014","0.1024","","","","","","1.062","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114707","25.1998","0.0006","25.1998","0.0006","25.1998","0.0006","90","","90","","90","","16002.6","0.7","293","2","293","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","Ba16Na204Sn309.48","","","- Ba16 Na204 Sn309.48 -","- Ba16 Na204 Sn309.648 -","- Ba16 Na204 Sn309.648 -","1","0.0104167","","Svilen Bobev; Slavi C. Sevov","Naked Clusters of 56 Tin Atoms in the Solid State","Journal of the American Chemical Society","2002","124","","3359","3365","10.1021/ja012549j","","","0.71073","Mokα","","0.0442","0.0363","","","0.0858","0.0894","","","","","","1.07","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114708","25.0534","0.0009","25.0534","0.0009","25.0534","0.0009","90","","90","","90","","15725.3","1","100","10","293","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","Ba16Na204Sn322.38","","","- Ba16 Na204 Sn322.38 -","- Ba16 Na204 Sn322.352 -","- Ba16 Na204 Sn322.352 -","1","0.0104167","","Svilen Bobev; Slavi C. Sevov","Naked Clusters of 56 Tin Atoms in the Solid State","Journal of the American Chemical Society","2002","124","","3359","3365","10.1021/ja012549j","","","0.71073","MoKα","","0.0454","0.0412","","","0.1211","0.1422","","","","","","1.187","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114709","25.2029","0.0006","25.2029","0.0006","25.2029","0.0006","90","","90","","90","","16008.5","0.7","293","2","293","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","Ba16Na204Sn309.50","","","- Ba16 Na204 Sn309.5 -","- Ba16 Na204 Sn309.344 -","- Ba16 Na204 Sn309.344 -","1","0.0104167","","Svilen Bobev; Slavi C. Sevov","Naked Clusters of 56 Tin Atoms in the Solid State","Journal of the American Chemical Society","2002","124","","3359","3365","10.1021/ja012549j","","","0.71073","Mokα","","0.0498","0.0404","","","0.1034","0.1091","","","","","","1.081","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114710","23.072","0.002","11.8337","0.0011","25.771","0.002","90","","111.509","0.002","90","","6546.2","1","293","2","213","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Ni3(C10H8N3)4(PF6)3 (CH2Cl2)5","","","- C45 H42 Cl10 F18 N12 Ni3 P3 -","- C45 H32 Cl10 F18 N12 Ni3 P3 -","- C180 H128 Cl40 F72 N48 Ni12 P12 -","4","1","","John F. Berry; F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo","A Trinickel Dipyridylamido Complex with Metal-Metal Bonding Interaction: Prelude to Polynickel Molecular Wires and Devices?","Journal of the American Chemical Society","2002","124","","3212","3213","10.1021/ja025543i","","","0.71073","MoKα","","0.073","0.0612","","","0.1503","0.1589","","","","","","1.062","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114711","26.493","0.002","26.493","0.002","37.545","0.006","90","","90","","120","","22822","4","170","2","170","2","","","","","","","","9","P -3 1 c","-P 3 2c","163","star-shaped tricluster T1","","","- C108 H237 F36 N6 O9.5 P15 Re18 Sb6 Se24 -","- C108 H237 F35.94 N6 O9.5 P15 Re18 Sb5.99 Se24 -","- C432 H948 F143.76 N24 O38 P60 Re72 Sb23.96 Se96 -","4","0.333333","","Bryan K. Roland; Hugh D. Selby; Michael D. Carducci; Zhiping Zheng","Built to Order: Molecular Tinkertoys from the [Re6(μ3-Se)8]2+ Clusters","Journal of the American Chemical Society","2002","124","","3222","3223","10.1021/ja025869r","","","0.71073","MoKα","","0.1865","0.091","","","0.1962","0.2792","","","","","","1.115","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114712","12.767","0.006","16.259","0.007","9.811","0.004","104.373","0.008","103.391","0.007","105.219","0.007","1805.1","1.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H52 Fe O2 P4 -","- C38 H52 Fe O2 P4 -","- C76 H104 Fe2 O4 P8 -","2","1","","Leslie D. Field; Anthony J. Turnbull; Peter Turner","Acetylide-Bridged Organometallic Oligomers via the Photochemical Metathesis of Methyl-Iron(II) Complexes","Journal of the American Chemical Society","2002","124","","3692","3702","10.1021/ja011105k","","","0.71073","MoKα","","0.058","0.0375","","","0.0879","0.0982","","","","","","1.023","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114713","9.108","0.002","18.09","0.003","9.526","0.001","90","","94.42","0.01","90","","1564.9","0.5","293","2","294","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C29 H44 Fe O P4 -","- C29 H44 Fe O P4 -","- C58 H88 Fe2 O2 P8 -","2","0.5","","Leslie D. Field; Anthony J. Turnbull; Peter Turner","Acetylide-Bridged Organometallic Oligomers via the Photochemical Metathesis of Methyl-Iron(II) Complexes","Journal of the American Chemical Society","2002","124","","3692","3702","10.1021/ja011105k","","","1.54178","CuKα","","0.1371","0.0658","","","0.1803","0.1962","","","","","","1.498","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114714","9.1079","0.0006","8.904","0.0006","30.985","0.002","90","","95.732","0.001","90","","2500.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H40 Fe P4 -","- C21 H40 Fe P4 -","- C84 H160 Fe4 P16 -","4","1","","Leslie D. Field; Anthony J. Turnbull; Peter Turner","Acetylide-Bridged Organometallic Oligomers via the Photochemical Metathesis of Methyl-Iron(II) Complexes","Journal of the American Chemical Society","2002","124","","3692","3702","10.1021/ja011105k","","","0.71069","MoKα","","0.0825","0.0544","","","0.1203","0.1378","","","","","","1.16","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114715","15.963","0.001","11.278","0.001","15.269","0.001","90","","93.842","0.004","90","","2742.7","0.3","123.2","","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H37 O3 P -","- C31 H37 O3 P -","- C124 H148 O12 P4 -","4","1","","Junji Kobayashi; Kei Goto; Takayuki Kawashima; Michael W. Schmidt; Shigeru Nagase","Synthesis, Structure, and Bonding Properties of 5-Carbaphosphatranes: A New Class of Main Group Atrane","Journal of the American Chemical Society","2002","124","","3703","3712","10.1021/ja011458j","","","0.71073","MoKα","","0.066","0.057","","","0.1435","0.1483","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114716","13.8887","0.0012","21.6453","0.0018","7.7372","0.0007","90","","104.552","0.002","90","","2251.4","0.3","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H20 N2 O9 -","- C25 H20 N2 O9 -","- C100 H80 N8 O36 -","4","1","","Steven R. Angle; Nahla A. El-Said","Stereoselective Synthesis of Tetrahydrofurans via Formal [3+2]-Cycloaddition of Aldehydes and Allylsilanes. Formal Total Synthesis of the Muscarine Alkaloids (-)-Allomuscarine and (+)-Epimuscarine","Journal of the American Chemical Society","2002","124","","3608","3613","10.1021/ja012193b","","","0.71073","MoKα","","0.0667","0.0445","","","0.1186","0.1352","","","","","","1.024","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114717","7.087","0.0007","16.9693","0.0018","9.3073","0.001","90","","107.992","0.002","90","","1064.57","0.19","213","2","213","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 O3 -","- C12 H16 O3 -","- C48 H64 O12 -","4","1","","Steven R. Angle; Nahla A. El-Said","Stereoselective Synthesis of Tetrahydrofurans via Formal [3+2]-Cycloaddition of Aldehydes and Allylsilanes. Formal Total Synthesis of the Muscarine Alkaloids (-)-Allomuscarine and (+)-Epimuscarine","Journal of the American Chemical Society","2002","124","","3608","3613","10.1021/ja012193b","","","0.71073","MoKα","","0.0443","0.0404","","","0.1108","0.1159","","","","","","1.038","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114718","21.832","0.003","16.948","0.003","13.0648","0.0019","90","","102.938","0.003","90","","4711.4","1.3","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H22 N2 O9 -","- C26 H22 N2 O9 -","- C208 H176 N16 O72 -","8","1","","Steven R. Angle; Nahla A. El-Said","Stereoselective Synthesis of Tetrahydrofurans via Formal [3+2]-Cycloaddition of Aldehydes and Allylsilanes. Formal Total Synthesis of the Muscarine Alkaloids (-)-Allomuscarine and (+)-Epimuscarine","Journal of the American Chemical Society","2002","124","","3608","3613","10.1021/ja012193b","","","0.71073","MoKα","","0.0495","0.036","","","0.0972","0.106","","","","","","1.015","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114719","7.0177","0.0009","13.6122","0.0018","22.516","0.003","90","","90","","90","","2150.9","0.5","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 N2 O9 -","- C21 H20 N2 O9 -","- C84 H80 N8 O36 -","4","1","","Steven R. Angle; Nahla A. El-Said","Stereoselective Synthesis of Tetrahydrofurans via Formal [3+2]-Cycloaddition of Aldehydes and Allylsilanes. Formal Total Synthesis of the Muscarine Alkaloids (-)-Allomuscarine and (+)-Epimuscarine","Journal of the American Chemical Society","2002","124","","3608","3613","10.1021/ja012193b","","","0.71073","MoKα","","0.0559","0.0359","","","0.0743","0.0811","","","","","","1.017","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114720","6.962","0.001","20.91","0.003","7.2754","0.0011","90","","106.319","0.003","90","","1016.4","0.3","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H20 N2 O9 -","- C21 H20 N2 O9 -","- C42 H40 N4 O18 -","2","1","","Steven R. Angle; Nahla A. El-Said","Stereoselective Synthesis of Tetrahydrofurans via Formal [3+2]-Cycloaddition of Aldehydes and Allylsilanes. Formal Total Synthesis of the Muscarine Alkaloids (-)-Allomuscarine and (+)-Epimuscarine","Journal of the American Chemical Society","2002","124","","3608","3613","10.1021/ja012193b","","","0.71073","MoKα","","0.0457","0.0356","","","0.0793","0.084","","","","","","1.013","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114721","7.348","0.004","12.026","0.006","12.432","0.006","107.506","0.008","90.37","0.009","95.405","0.009","1042.3","0.9","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H25 N O5 Si -","- C21 H25 N O5 Si -","- C42 H50 N2 O10 Si2 -","2","1","","Steven R. Angle; Nahla A. El-Said","Stereoselective Synthesis of Tetrahydrofurans via Formal [3+2]-Cycloaddition of Aldehydes and Allylsilanes. Formal Total Synthesis of the Muscarine Alkaloids (-)-Allomuscarine and (+)-Epimuscarine","Journal of the American Chemical Society","2002","124","","3608","3613","10.1021/ja012193b","","","0.71073","MoKα","","0.1004","0.0756","","","0.1947","0.227","","","","","","1.019","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114722","19.972","0.007","14.196","0.005","20.986","0.008","90","","117.548","0.011","90","","5275","3","91","2","91","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4,5-dimethoxyl-o-quinodimethane-Sc3N@C80","","","- C102 H24 N O2 Sc3 -","- C102 H24 N O2 Sc3 -","- C408 H96 N4 O8 Sc12 -","4","1","","Hon Man Lee; Marilyn M. Olmstead; Erick Iezzi; James C. Duchamp; Harry C. Dorn; Alan L. Balch","Crystallographic Characterization and Structural Analysis of the First Organic Functionalization Product of the Endohedral Fullerene Sc3N@C80","Journal of the American Chemical Society","2002","124","","3494","3495","10.1021/ja020065x","","","0.71073","MoKα","","0.2161","0.0643","","","0.1098","0.1513","","","","","","0.848","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114723","12.5777","0.001","14.3912","0.0011","14.5461","0.0011","102.69","","91.498","0.001","98.53","0.001","2535.5","0.3","165","2","165","2","","","","","","","synthetic","5","P -1","-P 1","2","","","","- C44 H64 Co N18 V2 -","- C44 H64 Co N18 V2 -","- C88 H128 Co2 N36 V4 -","2","1","","Matthew P. Shores; Jeffrey R. Long","Tetracyanide-Bridged Divanadium Complexes: Redox Switching between Strong Antiferromagnetic and Strong Ferromagnetic Coupling","Journal of the American Chemical Society","2002","124","","3512","3513","10.1021/ja025512n","","","0.71073","MoKα","","0.1129","0.0605","","0.1595","0.1318","","","","1.018","1.077","1.077","","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114724","18.905","0.004","14.931","0.003","15.295","0.003","90","","90","","90","","4317.3","1.5","163","2","163","2","","","","","","","synthetic","5","P b c n","-P 2n 2ab","60","","","","- C33.5 H59.5 N16.5 O2.5 V2 -","- C33.5 H42 N16.5 O2.5 V2 -","- C134 H168 N66 O10 V8 -","4","0.5","","Matthew P. Shores; Jeffrey R. Long","Tetracyanide-Bridged Divanadium Complexes: Redox Switching between Strong Antiferromagnetic and Strong Ferromagnetic Coupling","Journal of the American Chemical Society","2002","124","","3512","3513","10.1021/ja025512n","","","0.71073","MoKα","","0.1486","0.0772","","0.2548","0.2184","","","","1.065","1.23","1.23","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114725","13.8604","0.0004","18.4059","0.0008","9.3622","0.0003","90","","102.925","0.002","90","","2327.91","0.14","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 Br O2 -","- C28 H24 Br O2 -","- C112 H96 Br4 O8 -","4","1","","Christopher P. McArdle; Steve Van; Michael C. Jennings; Richard J. Puddephatt","Gold(I) Macrocycles and Topologically Chiral [2]Catenanes","Journal of the American Chemical Society","2002","124","","3959","3965","10.1021/ja012006+","","","0.71073","MoKα","","0.1111","0.0407","","","0.0864","0.1011","","","","","","0.893","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114726","20.1462","0.0004","12.8256","0.0002","39.3165","0.0007","90","","99.197","0.001","90","","10028.3","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C57 H54.5 Au2 Br O3 P2 -","- C57 H54.5 Au2 Br O3 P2 -","- C456 H436 Au16 Br8 O24 P16 -","8","2","","Christopher P. McArdle; Steve Van; Michael C. Jennings; Richard J. Puddephatt","Gold(I) Macrocycles and Topologically Chiral [2]Catenanes","Journal of the American Chemical Society","2002","124","","3959","3965","10.1021/ja012006+","","","0.71073","MoKα","","0.1494","0.0593","","","0.1465","0.1651","","","","","","0.933","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114727","11.2137","0.0003","20.7128","0.0007","24.6213","0.0007","104.052","0.002","93.098","0.002","102.873","0.002","5372.7","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C56.5 H53 Au2 Br Cl3 O2.5 P2 -","- C56.5 H53 Au2 Br Cl3 O2.5 P2 -","- C226 H212 Au8 Br4 Cl12 O10 P8 -","4","2","","Christopher P. McArdle; Steve Van; Michael C. Jennings; Richard J. Puddephatt","Gold(I) Macrocycles and Topologically Chiral [2]Catenanes","Journal of the American Chemical Society","2002","124","","3959","3965","10.1021/ja012006+","","","0.71073","MoKα","","0.1119","0.0569","","","0.1318","0.1479","","","","","","0.946","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114728","17.9762","0.0006","14.4378","0.0005","23.713","0.0007","90","","104.178","0.001","90","","5966.9","0.3","293","2","188","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Fe(O2CArTol)(2,4-tBu2C6H3O)(4-tBuC5H4N)]","","","- C66 H68 Cl2 Fe N O5 -","- C66 H68 Cl2 Fe N O5 -","- C264 H272 Cl8 Fe4 N4 O20 -","4","1","","Dongwhan Lee; Brad Pierce; Carsten Krebs; Michael P. Hendrich; Boi Hanh Huynh; Stephen J. Lippard","Functional Mimic of Dioxygen-Activating Centers in Non-Heme Diiron Enzymes: Mechanistic Implications of Paramagnetic Intermediates in the Reactions between Diiron(II) Complexes and Dioxygen","Journal of the American Chemical Society","2002","124","","3993","4007","10.1021/ja012251t","","","0.71073","MoKα","","0.2091","0.0776","","","0.1728","0.2217","","","","","","0.988","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114729","10.865","0.001","19.237","0.002","10.054","0.001","90","0.002","114.442","0.001","90","0.002","1913.1","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","oktakis(μ-acetato-O,O')bis(μ-acetato-O,O)bis(μ-1,3-bis (dimethylamino)N,N'-2-propoxo-O) tetra-zinc(II)","","- C26 H52 N4 O14 Zn4 -","- C13 H26 N2 O7 Zn2 -","- C52 H104 N8 O28 Zn8 -","4","1","","Alojz Demšar; Janez Košmrlj; Saša Petriček","Variable-Temperature Nuclear Magnetic Resonance Spectroscopy Allows Direct Observation of Carboxylate Shift in Zinc Carboxylate Complexes","Journal of the American Chemical Society","2002","124","","3951","3958","10.1021/ja016534x","","","0.7107","MoKα","","0.124","0.061","","0.184","0.073","","","","1.853","0.991","0.991","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4114730","11.647","0.007","10.178","0.002","19.63","0.01","90","0.02","106.97","0.05","90","0.02","2225.7","1.9","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","oktakis(μ-propionato-O,O'bis(μ-propionato-O,O)bis(μ-1,3-bis (dimethylamino)N,N'-2-propoxo-O) tetra-zinc(II)","","- C32 H64 N4 O14 Zn4 -","- C16 H32 N2 O7 Zn2 -","- C64 H128 N8 O28 Zn8 -","4","1","","Alojz Demšar; Janez Košmrlj; Saša Petriček","Variable-Temperature Nuclear Magnetic Resonance Spectroscopy Allows Direct Observation of Carboxylate Shift in Zinc Carboxylate Complexes","Journal of the American Chemical Society","2002","124","","3951","3958","10.1021/ja016534x","","","0.7107","MoKα","","0.2","0.042","","0.268","0.047","","","","2.998","0.95","0.95","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4114731","10.7671","0.0002","13.4855","0.0003","15.5292","0.0004","90","","90.761","0.001","90","","2254.64","0.09","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","catena tetrakis(μ-acetato-O,O')(μ-acetato-O,O)(μ-1,3-bis (dimethylamino)N,N'-2-propoxo-O) di-zinc(II)","","- C14 H26 Cl2 D2 N2 O7 Zn2 -","- C14 H26 Cl2 D2 N2 O7 Zn2 -","- C56 H104 Cl8 D8 N8 O28 Zn8 -","4","1","","Alojz Demšar; Janez Košmrlj; Saša Petriček","Variable-Temperature Nuclear Magnetic Resonance Spectroscopy Allows Direct Observation of Carboxylate Shift in Zinc Carboxylate Complexes","Journal of the American Chemical Society","2002","124","","3951","3958","10.1021/ja016534x","","","0.71073","MoKα","","0.0612","0.0398","","","0.0882","0.0987","","","","","","1.036","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114732","7.3796","0.0006","12.147","0.0009","16.8549","0.0013","100.46","0.002","90.076","0.001","95.517","0.001","1478.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- F5 N O3 Pb3 -","- F5 N0.9915 O3 Pb3 -","- F40 N7.932 O24 Pb24 -","8","4","","Dat T. Tran; Peter Y. Zavalij; Scott R. J. Oliver","Pb3F5NO3, a Cationic Layered Material for Anion-Exchange","Journal of the American Chemical Society","2002","124","","3966","3969","10.1021/ja017333w","","","0.71073","MoKα","","0.0774","0.0496","","","0.0734","0.0797","","","","","","0.979","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114733","11.05","0.0003","13.1794","0.0003","14.4436","0.0003","105.362","0.001","92.979","0.001","114.077","0.001","1820.98","0.08","273.2","","273.2","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H55 Cl2 Hf Sn -","- C40 H55 Cl Hf Sn -","- C80 H110 Cl2 Hf2 Sn2 -","2","1","","Nathan R. Neale; T. Don Tilley","A New Mechanism for Metal-Catalyzed Stannane Dehydrocoupling Based on α-H-Elimination in a Hafnium Hydrostannyl Complex","Journal of the American Chemical Society","2002","124","","3802","3803","10.1021/ja017495s","","","0.7107","MoKα","","0","0.0343","","0","0.0398","","","","","","","1.296","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114734","17.2627","0.0005","17.2627","0.0005","25.6138","0.0008","90","","90","","120","","6610.3","0.3","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Gd4 H24 Mo12 O60 -","- Gd4 Mo12 O54 -","- Gd24 Mo72 O324 -","6","0.166667","","Chuan-De Wu; Can-Zhong Lu; Hong-Hui Zhuang; Jin-Shun Huang","Hydrothermal Assembly of a Novel Three-Dimensional Framework Formed by [GdMo12O42]9- Anions and Nine Coordinated GdIII Cations","Journal of the American Chemical Society","2002","124","","3836","3837","10.1021/ja017782w","","","0.71073","MoKα","","","0.0467","","","0.1124","0.1209","","","","","","1.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114735","10.1121","0.0006","17.4856","0.0007","19.8355","0.0011","98.784","0.004","90.512","0.004","94.789","0.004","3453.2","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","6,21-Di-p-tolyl-11,16-diphenyl-para-benziporphyrin","","- C48 H35 N3 -","- C48 H35 N3 -","- C192 H140 N12 -","4","2","","Marcin Stępień; Lechosław Latos-Grażyński","Tetraphenyl-p-benziporphyrin: A Carbaporphyrinoid with Two Linked Carbon Atoms in the Coordination Core","Journal of the American Chemical Society","2002","124","","3838","3839","10.1021/ja017852z","","","0.71073","MoKα","","0.0786","0.0524","","","0.1382","0.152","","","","","","1.129","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114736","18.669","0.001","15.602","0.001","14.583","0.001","90","","90","","90","","4247.6","0.5","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","5,10,15,20-tetraphenyl-para-benziporphyrin dication dichloride dichloromethane disolvate monohydrate","","- C47.8 H36.6 Cl5.9 N3 O0.9 -","- C47.823 H36.646 Cl5.922 N3 O0.862 -","- C191.292 H146.584 Cl23.688 N12 O3.448 -","4","0.5","","Marcin Stępień; Lechosław Latos-Grażyński","Tetraphenyl-p-benziporphyrin: A Carbaporphyrinoid with Two Linked Carbon Atoms in the Coordination Core","Journal of the American Chemical Society","2002","124","","3838","3839","10.1021/ja017852z","","","0.71073","MoKα","","0.0649","0.0539","","","0.1299","0.1362","","","","","","1.106","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114737","9.0546","0.0005","13.9101","0.0008","18.5544","0.0011","69.39","0.005","86.016","0.005","79.09","0.005","2147.8","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Chlorocadmium(II) 5,10,15,20-tetraphenyl-p-benziporphyrin chloroform-d disolvate","","- C48 H30 Cd Cl7 D2 N3 -","- C48 H30 Cd Cl7 D2 N3 -","- C96 H60 Cd2 Cl14 D4 N6 -","2","1","","Marcin Stępień; Lechosław Latos-Grażyński","Tetraphenyl-p-benziporphyrin: A Carbaporphyrinoid with Two Linked Carbon Atoms in the Coordination Core","Journal of the American Chemical Society","2002","124","","3838","3839","10.1021/ja017852z","","","0.71073","MoKα","","0.0475","0.0362","","","0.0883","0.0931","","","","","","1.091","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114738","8.155","0.002","17.61","0.004","17.818","0.002","90","","91.87","0.01","90","","2557.5","0.9","223.2","","223.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H37 O2 P -","- C27 H37 O2 P -","- C108 H148 O8 P4 -","4","2","","Li-Biao Han; Chang-Qiu Zhao; Shun-ya Onozawa; Midori Goto; Masato Tanaka","Retention of Configuration on the Oxidative Addition of P-H Bond to Platinum (0) Complexes: The First Straightforward Synthesis of Enantiomerically Pure P-Chiral Alkenylphosphinates via Palladium-Catalyzed Stereospecific Hydrophosphinylation of Alkynes","Journal of the American Chemical Society","2002","124","","3842","3843","10.1021/ja025816+","","","0.7107","MoKα","","0.0443","0.0443","","","0.0542","0.0542","","","","","","1.361","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114739","17.455","0.006","21.777","0.004","11.484","0.003","90","","90","","90","","4365","2","203.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H73 O2 P3 Pt -","- C42 H73 O2 P3 Pt -","- C168 H292 O8 P12 Pt4 -","4","1","","Li-Biao Han; Chang-Qiu Zhao; Shun-ya Onozawa; Midori Goto; Masato Tanaka","Retention of Configuration on the Oxidative Addition of P-H Bond to Platinum (0) Complexes: The First Straightforward Synthesis of Enantiomerically Pure P-Chiral Alkenylphosphinates via Palladium-Catalyzed Stereospecific Hydrophosphinylation of Alkynes","Journal of the American Chemical Society","2002","124","","3842","3843","10.1021/ja025816+","","","0.7107","MoKα","","","0.0486","","","","0.1258","","","","","","1.266","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114740","14.756","0.003","14.818","0.003","19.881","0.004","86.28","0.02","86.83","0.02","61.74","0.02","3819.4","1.5","111","2","113","2","","","","","","","","6","P -1","-P 1","2","Er2@C82.Co(OEP).1.4C6H6.0.3CHCl3","","","- C126.7 H52.7 Cl0.9 Co Er2 N4 -","- C126.7 H52.7 Cl0.9 Co Er1.845 N4 -","- C253.4 H105.4 Cl1.8 Co2 Er3.69 N8 -","2","1","","Marilyn M. Olmstead; Ana de Bettencourt-Dias; S. Stevenson; Harry C. Dorn; Alan L. Balch","Crystallographic Characterization of the Structure of the Endohedral Fullerene {Er2@C82Isomer I} with Cs Cage Symmetry and Multiple Sites for Erbium along a Band of Ten Contiguous Hexagons","Journal of the American Chemical Society","2002","124","","4172","4173","10.1021/ja0116019","","","0.773","16,039eV","","0.1607","0.1479","","","0.4079","0.4276","","","","","","1.928","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114741","17.0899","0.0003","9.0332","0.0001","15.8559","0.0001","90","","102.86","","90","","2386.38","0.05","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C19 H19 N3 -","- C19 H19 N3 -","- C114 H114 N18 -","6","1.5","","Man-kit Leung; Ashis B. Mandal; Chih-Chieh Wang; Gene-Hsiang Lee; Shie-Ming Peng; Hsing-Ling Cheng; Guor-Rong Her; Ito Chao; Hsiu-Feng Lu; Ying-Chieh Sun; Mei-Ying Shiao; Pi-Tai Chou","Self-Complementarity of Oligo-2-aminopyridines: A New Class of Hydrogen-Bonded Ladders","Journal of the American Chemical Society","2002","124","","4287","4297","10.1021/ja011679p","","","0.71073","MoKα","","0.1497","0.0778","","0.2142","0.1773","","","","1.08","1.258","1.258","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114742","12.9834","0.0005","5.6602","0.0002","21.9238","0.0007","90","","100.692","0.001","90","","1583.18","0.1","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H19 N3 -","- C19 H19 N3 -","- C76 H76 N12 -","4","2","","Man-kit Leung; Ashis B. Mandal; Chih-Chieh Wang; Gene-Hsiang Lee; Shie-Ming Peng; Hsing-Ling Cheng; Guor-Rong Her; Ito Chao; Hsiu-Feng Lu; Ying-Chieh Sun; Mei-Ying Shiao; Pi-Tai Chou","Self-Complementarity of Oligo-2-aminopyridines: A New Class of Hydrogen-Bonded Ladders","Journal of the American Chemical Society","2002","124","","4287","4297","10.1021/ja011679p","","","0.71073","MoKα","","0.1027","0.0627","","0.127","0.1087","","","","1.109","1.175","1.175","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114743","14.514","0.003","19.648","0.004","14.718","0.003","90","","99.31","0.02","90","","4141.9","1.5","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 N5 -","- C24 H23 N5 -","- C192 H184 N40 -","8","2","","Man-kit Leung; Ashis B. Mandal; Chih-Chieh Wang; Gene-Hsiang Lee; Shie-Ming Peng; Hsing-Ling Cheng; Guor-Rong Her; Ito Chao; Hsiu-Feng Lu; Ying-Chieh Sun; Mei-Ying Shiao; Pi-Tai Chou","Self-Complementarity of Oligo-2-aminopyridines: A New Class of Hydrogen-Bonded Ladders","Journal of the American Chemical Society","2002","124","","4287","4297","10.1021/ja011679p","","","0.71073","MoKα","","0.1363","0.0623","","0.1984","0.1528","","","","1.02","1.13","1.13","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114744","18.7395","0.0017","12.1337","0.0015","21.76","0.004","90","","98.389","0.011","90","","4894.8","1.2","293","","293","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C29 H27 N7 -","- C29 H27 N7 -","- C232 H216 N56 -","8","1","","Man-kit Leung; Ashis B. Mandal; Chih-Chieh Wang; Gene-Hsiang Lee; Shie-Ming Peng; Hsing-Ling Cheng; Guor-Rong Her; Ito Chao; Hsiu-Feng Lu; Ying-Chieh Sun; Mei-Ying Shiao; Pi-Tai Chou","Self-Complementarity of Oligo-2-aminopyridines: A New Class of Hydrogen-Bonded Ladders","Journal of the American Chemical Society","2002","124","","4287","4297","10.1021/ja011679p","","","0.7093","MolybdenumKα","","0.044","0.044","","0.042","0.042","","","","","1.39","1.39","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114745","9.3664","0.0002","12.7287","0.0003","15.7874","0.0004","77.924","0.002","85.989","0.002","86.248","0.002","1833.56","0.08","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H27 B Cu F20 N3 -","- C35 H27 B Cu F20 N3 -","- C70 H54 B2 Cu2 F40 N6 -","2","1","","Hong-Chang Liang; Christiana Xin Zhang; Mark J. Henson; Roger D. Sommer; Karen R. Hatwell; Susan Kaderli; Andreas D. Zuberbühler; Arnold L. Rheingold; Edward I. Solomon; Kenneth D. Karlin","Contrasting Copper-Dioxygen Chemistry Arising from Alike Tridentate Alkyltriamine Copper(I) Complexes","Journal of the American Chemical Society","2002","124","","4170","4171","10.1021/ja0125265","","","0.71073","MoKα","","0.114","0.0769","","","0.1815","0.216","","","","","","1.061","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114746","18.1702","0.001","23.3832","0.0013","33.8378","0.0018","90","","90","","90","","14376.9","1.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H25 B Cu F20 N3 -","- C34 H25 B Cu F20 N3 -","- C544 H400 B16 Cu16 F320 N48 -","16","2","","Hong-Chang Liang; Christiana Xin Zhang; Mark J. Henson; Roger D. Sommer; Karen R. Hatwell; Susan Kaderli; Andreas D. Zuberbühler; Arnold L. Rheingold; Edward I. Solomon; Kenneth D. Karlin","Contrasting Copper-Dioxygen Chemistry Arising from Alike Tridentate Alkyltriamine Copper(I) Complexes","Journal of the American Chemical Society","2002","124","","4170","4171","10.1021/ja0125265","","","0.71073","MoKα","","0.1307","0.0808","","","0.1646","0.1898","","","","","","1.155","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114747","18.599","0.003","18.661","0.003","21.015","0.003","90","","90","","90","","7294","2","173","2","173","2","","","","","","","Laurie Breyfogle","6","P b c a","-P 2ac 2ab","61","01008","","","- C28 H51 Fe N4 O Si4 -","- C28 H51 Fe N4 O Si4 -","- C224 H408 Fe8 N32 O8 Si32 -","8","1","","Brendan J. O'Keefe; Laurie E. Breyfogle; Marc A. Hillmyer; William B. Tolman","Mechanistic Comparison of Cyclic Ester Polymerizations by Novel Iron(III)-Alkoxide Complexes: Single vs Multiple Site Catalysis","Journal of the American Chemical Society","2002","124","","4384","4393","10.1021/ja012689t","","","0.71073","MoKα","","0.1387","0.0717","","","0.1167","0.1344","","","","","","1.04","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114748","19.2","0.003","10.9732","0.0015","21.207","0.003","90","","103.074","0.002","90","","4352.2","1.1","173","2","173","2","","","","","","","Laurie Breyfogle","6","P 1 21/n 1","-P 2yn","14","01121","","","- C39 H57 Fe N4 O Si4 -","- C39 H57 Fe N4 O Si4 -","- C156 H228 Fe4 N16 O4 Si16 -","4","1","","Brendan J. O'Keefe; Laurie E. Breyfogle; Marc A. Hillmyer; William B. Tolman","Mechanistic Comparison of Cyclic Ester Polymerizations by Novel Iron(III)-Alkoxide Complexes: Single vs Multiple Site Catalysis","Journal of the American Chemical Society","2002","124","","4384","4393","10.1021/ja012689t","","","0.71073","MoKα","","0.0384","0.0291","","","0.0767","0.0802","","","","","","1.042","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114749","10.8678","0.001","13.5829","0.0012","13.7118","0.0012","72.642","0.001","78.123","0.002","73.155","0.001","1833.2","0.3","293","2","293","2","","","","","","","Brendan OKeefe","4","P -1","-P 1","2","00201","","","- C46 H41 Fe O3 -","- C46 H41 Fe O3 -","- C92 H82 Fe2 O6 -","2","1","","Brendan J. O'Keefe; Laurie E. Breyfogle; Marc A. Hillmyer; William B. Tolman","Mechanistic Comparison of Cyclic Ester Polymerizations by Novel Iron(III)-Alkoxide Complexes: Single vs Multiple Site Catalysis","Journal of the American Chemical Society","2002","124","","4384","4393","10.1021/ja012689t","","","0.71073","MoKα","","0.0613","0.0521","","","0.1329","0.1392","","","","","","1.063","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114750","11.785","0.005","21.824","0.005","12.937","0.005","90","0.005","115.962","0.005","90","0.005","2991.6","1.9","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H40 Cl4 Pd2 -","- C31 H40 Cl4 Pd2 -","- C124 H160 Cl16 Pd8 -","4","1","","Marta Catellani; Carlo Mealli; Elena Motti; Paola Paoli; Enrique Perez-Carreño; Paul S. Pregosin","Palladium-Arene Interactions in Catalytic Intermediates: An Experimental and Theoretical Investigation of the Soft Rearrangement between η1 and η2 Coordination Modes","Journal of the American Chemical Society","2002","124","","4336","4346","10.1021/ja016587e","","","1.5418","CuKα","","0.0984","0.0746","","","0.1589","0.1701","","","","","","1.135","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114751","20.234","0.007","6.105","0.002","20.553","0.008","90","","109.701","0.007","90","","2390.3","1.5","213","2","213","2","","","","","","","","3","C 1 2 1","C 2y","5","(-)-terpestacin","","","- C25 H38 O4 -","- C25 H38 O4 -","- C100 H152 O16 -","4","1","","Andrew G. Myers; Michael Siu; Feng Ren","Enantioselective Synthesis of (-)-Terpestacin and (-)-Fusaproliferin: Clarification of Optical Rotational Measurements and Absolute Configurational Assignments Establishes a Homochiral Structural Series","Journal of the American Chemical Society","2002","124","","4230","4232","10.1021/ja020072l","","","0.71073","MoKα","","0.0772","0.0612","","","0.1513","0.1611","","","","","","1.014","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114752","13.1703","0.0006","13.312","0.0006","24.3236","0.001","79.445","0.001","76.067","0.001","83.726","0.001","4059.5","0.3","193","2","193","2","","","","","","","","8","P -1","-P 1","2","","","","- C112 H190 K4 N12 O24 P2 Pt4 Sn18 -","- C112 H190 K4 N12 O24 P2 Pt4 Sn18 -","- C112 H190 K4 N12 O24 P2 Pt4 Sn18 -","1","0.5","","Banu Kesanli; James Fettinger; Donna R. Gardner; Bryan Eichhorn","The [Sn9Pt2(PPh3)]2- and [Sn9Ni2(CO)]3- Complexes: Two Markedly Different Sn9M2L Transition Metal Zintl Ion Clusters and Their Dynamic Behavior","Journal of the American Chemical Society","2002","124","","4779","4786","10.1021/ja012528p","","","0.71073","MoKα","","0.079","0.0398","","","0.0684","0.0819","","","","","","1.012","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114753","12.4953","0.0016","13.7484","0.0018","24.276","0.003","86.795","0.002","86.925","0.002","83.24","0.002","4130.3","0.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C61 H95 K2 N4 O12 P Pt2 Sn9 -","- C61 H95 K2 N4 O12 P Pt2 Sn9 -","- C122 H190 K4 N8 O24 P2 Pt4 Sn18 -","2","1","","Banu Kesanli; James Fettinger; Donna R. Gardner; Bryan Eichhorn","The [Sn9Pt2(PPh3)]2- and [Sn9Ni2(CO)]3- Complexes: Two Markedly Different Sn9M2L Transition Metal Zintl Ion Clusters and Their Dynamic Behavior","Journal of the American Chemical Society","2002","124","","4779","4786","10.1021/ja012528p","","","0.71073","MoKα","","0.0781","0.0584","","","0.1815","0.1918","","","","","","1.045","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114754","31.197","0.001","23.8741","0.0008","27.9617","0.0009","90","","113.047","0.001","90","","19163.6","1.1","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C528 H988 K24 N64 Ni16 O152 P4 Sn72 -","- C528 H988 K24 N64 Ni16 O152 P4 Sn72 -","- C528 H988 K24 N64 Ni16 O152 P4 Sn72 -","1","0.25","","Banu Kesanli; James Fettinger; Donna R. Gardner; Bryan Eichhorn","The [Sn9Pt2(PPh3)]2- and [Sn9Ni2(CO)]3- Complexes: Two Markedly Different Sn9M2L Transition Metal Zintl Ion Clusters and Their Dynamic Behavior","Journal of the American Chemical Society","2002","124","","4779","4786","10.1021/ja012528p","","","0.71073","MoKα","","0.0849","0.0513","","","0.1403","0.1558","","","","","","1.059","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114755","7.9848","0.0007","11.861","0.0011","14.118","0.0013","80.29","0.02","85.29","0.02","87.07","0.02","1312.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H12 I8 N4 S2 -","- C8 H12 I8 N4 S2 -","- C16 H24 I16 N8 S4 -","2","1","","M. Carla Aragoni; Massimiliano Arca; Francesco Demartin; Francesco A. Devillanova; Alessandra Garau; Francesco Isaia; Vito Lippolis; Gaetano Verani","Anti-Thyroid Drug Methimazole: X-ray Characterization of Two Novel Ionic Disulfides Obtained from Its Chemical Oxidation by I2","Journal of the American Chemical Society","2002","124","","4538","4539","10.1021/ja012731k","","","0.71073","MoKα","","0.0437","0.0261","","0.0456","0.0445","","","","0.708","0.859","0.859","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114756","14.278","0.002","13.516","0.002","20.452","0.002","90","","106.06","0.01","90","","3792.8","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H22 I8 N8 S4 -","- C16 H22 I8 N8 S4 -","- C64 H88 I32 N32 S16 -","4","1","","M. Carla Aragoni; Massimiliano Arca; Francesco Demartin; Francesco A. Devillanova; Alessandra Garau; Francesco Isaia; Vito Lippolis; Gaetano Verani","Anti-Thyroid Drug Methimazole: X-ray Characterization of Two Novel Ionic Disulfides Obtained from Its Chemical Oxidation by I2","Journal of the American Chemical Society","2002","124","","4538","4539","10.1021/ja012731k","","","0.71073","MoKα","","0.0978","0.0463","","0.1229","0.1147","","","","0.927","1.19","1.19","","","","","has coordinates","209504","2020-10-21","18:00:00",""
"4114757","12.6313","0.0002","20.5633","0.0002","7.039","0.0001","90","","90","","90","","1828.32","0.04","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C8 H19 N9 O7 Pt2 -","- C8 H19 N9 O7 Pt2 -","- C32 H76 N36 O28 Pt8 -","4","1","","Seiji Komeda; Martin Lutz; Anthony L. Spek; Yasuyuki Yamanaka; Takaji Sato; Masahiko Chikuma; Jan Reedijk","A Novel Isomerization on Interaction of Antitumor-Active Azole-Bridged Dinuclear Platinum(II) Complexes with 9-Ethylguanine. Platinum(II) Atom Migration from N2 to N3 on 1,2,3-Triazole","Journal of the American Chemical Society","2002","124","","4738","4746","10.1021/ja0168559","","","0.71073","MoKα","","0.0354","0.034","","","0.0921","0.0932","","","","","","1.051","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114758","12.5835","0.0003","16.5181","0.0005","29.7871","0.0008","90","","90","","90","","6191.4","0.3","150","1","150","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C60 H85 Cl4 Co N4 O6 -","- C60 H85 Cl4 Co N4 O6 -","- C240 H340 Cl16 Co4 N16 O24 -","4","1","","Rhiana Bobb; Gamil Alhakimi; Lisa Studnicki; Alan Lough; Jik Chin","Stereoselective Recognition of an Aziridine with a Co(III) Complex: A Potential Transition-State Analogue for Catalytic Epoxidation","Journal of the American Chemical Society","2002","124","","4544","4545","10.1021/ja017418x","","","0.7107","MoKα","","0.0825","0.0591","","","0.1326","0.1469","","","","","","1.057","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114759","14.3448","0.0004","27.295","0.0007","16.2612","0.0005","90","","91.495","0.009","90","","6364.8","0.3","150","1","150","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C55.5 H76 Cl1.5 Co N4 O3 -","- C55.5 H76 Cl1.5 Co N4 O3 -","- C222 H304 Cl6 Co4 N16 O12 -","4","2","","Rhiana Bobb; Gamil Alhakimi; Lisa Studnicki; Alan Lough; Jik Chin","Stereoselective Recognition of an Aziridine with a Co(III) Complex: A Potential Transition-State Analogue for Catalytic Epoxidation","Journal of the American Chemical Society","2002","124","","4544","4545","10.1021/ja017418x","","","0.71073","MoKα","","0.1081","0.0769","","","0.1949","0.2088","","","","","","1.218","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114760","10.2765","0.0006","5.251","0.0003","13.5499","0.0008","90","","98.98","0.001","90","","722.22","0.07","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Ba O7 Te3 -","- Ba O7 Te3 -","- Ba4 O28 Te12 -","4","1","","Magnus G. Johnston; William T. A. Harrison","Lone-Pair Self-Containment in Tellurite Tubes: Hydrothermal Syntheses and Structures of BaTe3O7 and BaTe4O9","Journal of the American Chemical Society","2002","124","","4576","4577","10.1021/ja017648b","","","0.71073","MoKα","","0.0371","0.0299","","","0.0687","0.0709","","","","","","0.982","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114761","19.5354","0.001","4.5099","0.0002","23.3021","0.0012","90","","112.961","0.001","90","","1890.32","0.16","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Ba O9 Te4 -","- Ba O9 Te4 -","- Ba8 O72 Te32 -","8","1","","Magnus G. Johnston; William T. A. Harrison","Lone-Pair Self-Containment in Tellurite Tubes: Hydrothermal Syntheses and Structures of BaTe3O7 and BaTe4O9","Journal of the American Chemical Society","2002","124","","4576","4577","10.1021/ja017648b","","","0.71073","MoKα","","0.0483","0.039","","","0.0921","0.0954","","","","","","1.014","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114762","8.198","0.003","14.912","0.006","19.402","0.007","104.457","0.008","97.953","0.008","102.998","0.008","2189.8","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28.5 H22 Fe4 N0 O14.5 S6 -","- C28.5 H20 Fe4 O14.5 S6 -","- C57 H40 Fe8 O29 S12 -","2","1","","Li-Cheng Song; Hong-Tao Fan; Qing-Mei Hu","The First Example of Macrocycles Containing Butterfly Transition Metal Cluster Cores via Novel Tandem Reactions","Journal of the American Chemical Society","2002","124","","4566","4567","10.1021/ja020151x","","","0.71073","MoKα","","0.2744","0.0737","","","0.1197","0.1665","","","","","","0.862","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114763","12.643","0.004","15.601","0.006","16.768","0.006","82.643","0.006","70.777","0.006","84.743","0.007","3092.9","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H27 Cl2 Fe8 O27.5 S6 -","- C37 H26 Cl2 Fe8 O27.5 S6 -","- C74 H52 Cl4 Fe16 O55 S12 -","2","1","","Li-Cheng Song; Hong-Tao Fan; Qing-Mei Hu","The First Example of Macrocycles Containing Butterfly Transition Metal Cluster Cores via Novel Tandem Reactions","Journal of the American Chemical Society","2002","124","","4566","4567","10.1021/ja020151x","","","0.71073","MoKα","","0.157","0.0688","","","0.147","0.2046","","","","","","0.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114764","6.332","0.002","12.636","0.005","19.532","0.008","81.077","0.007","90","0.007","90","0.008","1543.9","1","213","2","213","2","","","","","","","","6","P 1","P 1","1","","","","- C30 H32 Br Cl N2 O8 -","- C30 H32 Br Cl N2 O8 -","- C60 H64 Br2 Cl2 N4 O16 -","2","2","","Andrew G. Myers; Alexander R. Hurd; Philip C. Hogan","Evidence for Facile Atropisomerism and Simple (Non-Nucleophilic) Biradical-Forming Cycloaromatization within Kedarcidin Chromophore Aglycon","Journal of the American Chemical Society","2002","124","","4583","4585","10.1021/ja020152p","","","0.71073","MoKα","","0.1667","0.1306","","","0.3692","0.3995","","","","","","1.54","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114765","19.4853","0.0007","19.4853","0.0007","19.4853","0.0007","90","","90","","90","","7398.1","0.5","188","2","188","2","","","","","","","","6","F -4 3 m","F -4 2 3","216","","","","- C38 H78 F24 Fe13 N5 O21 -","- C36.72 H60 F24 Fe13 O16 -","- C146.88 H240 F96 Fe52 O64 -","4","0.0416667","","Avi Bino; Michael Ardon; Dongwhan Lee; Bernhard Spingler; Stephen J. Lippard","Synthesis and Structure of [Fe13O4F24(OMe)12]5-: The First Open-Shell Keggin Ion","Journal of the American Chemical Society","2002","124","","4578","4579","10.1021/ja025590a","","","0.71073","MoKα","","0.0352","0.035","","","0.1169","0.1172","","","","","","1.168","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114766","8.4041","0.0006","12.1348","0.0008","26.9259","0.0018","90","","90","","90","","2746","0.3","183","2","183","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H42 Fe2 N2 -","- C31 H42 Fe2 N2 -","- C124 H168 Fe8 N8 -","4","1","","Michael M.-C. Lo; Gregory C. Fu","Cu(I)/Bis(azaferrocene)-Catalyzed Enantioselective Synthesis of β-Lactams via Couplings of Alkynes with Nitrones","Journal of the American Chemical Society","2002","124","","4572","4573","10.1021/ja025833z","","","0.71073","MoKα","","0.03","0.0296","","","0.0792","0.0795","","","","","","1.088","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4114767","8.8016","0.0005","8.8016","0.0005","46.695","0.004","90","","90","","90","","3617.4","0.4","183","2","183","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C21 H16 Br N O -","- C21 H16 Br N O -","- C168 H128 Br8 N8 O8 -","8","1","","Michael M.-C. Lo; Gregory C. Fu","Cu(I)/Bis(azaferrocene)-Catalyzed Enantioselective Synthesis of β-Lactams via Couplings of Alkynes with Nitrones","Journal of the American Chemical Society","2002","124","","4572","4573","10.1021/ja025833z","","","0.71073","MoKα","","0.0417","0.0342","","","0.0718","0.0744","","","","","","1.04","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4114768","8.6099","0.0006","13.3474","0.001","17.2548","0.0013","101.114","0.001","97.188","0.001","90.108","0.001","1929.7","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4,7,12,15-tetra(bromomethyl)[2.2]paracyclophane","","- C20 H20 Br4 -","- C20 H20 Br4 -","- C80 H80 Br16 -","4","2","","Glenn P. Bartholomew; Guillermo C. Bazan","Synthesis, Characterization, and Spectroscopy of 4,7,12,15-[2.2]Paracyclophane Containing Donor and Acceptor Groups: Impact of Substitution Patterns on Through-Space Charge Transfer","Journal of the American Chemical Society","2002","124","","5183","5196","10.1021/ja0121383","","","0.71073","MoKα","","0.1094","0.0709","","0.1649","0.1561","","","","1.498","1.854","1.854","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114769","22.4743","0.0014","11.6272","0.0007","31.793","0.002","90","","106.503","0.001","90","","7965.7","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-bis(4'-dihexylaminostyryl)benzene","","- C46 H68 N2 -","- C46 H68 N2 -","- C368 H544 N16 -","8","2","","Glenn P. Bartholomew; Guillermo C. Bazan","Synthesis, Characterization, and Spectroscopy of 4,7,12,15-[2.2]Paracyclophane Containing Donor and Acceptor Groups: Impact of Substitution Patterns on Through-Space Charge Transfer","Journal of the American Chemical Society","2002","124","","5183","5196","10.1021/ja0121383","","","0.71073","MoKα","","0.1147","0.0427","","0.1323","0.1","","","","0.832","1.048","1.048","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114770","31.858","0.003","16.2284","0.0013","21.78","0.002","90","","131.118","0.001","90","","8483.1","1.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4,7,12,15-tetra(4'-dihexylaminostyryl)[2.2]paracyclophane","","- C96 H140 N4 -","- C96 H140 N4 -","- C384 H560 N16 -","4","0.5","","Glenn P. Bartholomew; Guillermo C. Bazan","Synthesis, Characterization, and Spectroscopy of 4,7,12,15-[2.2]Paracyclophane Containing Donor and Acceptor Groups: Impact of Substitution Patterns on Through-Space Charge Transfer","Journal of the American Chemical Society","2002","124","","5183","5196","10.1021/ja0121383","","","0.71073","MoKα","","0.165","0.1037","","0.2678","0.2375","","","","2.343","3.033","3.033","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114771","10.201","0.003","12.508","0.004","24.779","0.008","101.804","0.006","97.221","0.006","96.463","0.007","3039","1.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,7-bis(4'dihexylaminostyryl)-12,15-di-4''nitrostyryl[2.2]paracyclophane","","- C72 H88 N4 O4 -","- C72 H88 N4 O4 -","- C144 H176 N8 O8 -","2","1","","Glenn P. Bartholomew; Guillermo C. Bazan","Synthesis, Characterization, and Spectroscopy of 4,7,12,15-[2.2]Paracyclophane Containing Donor and Acceptor Groups: Impact of Substitution Patterns on Through-Space Charge Transfer","Journal of the American Chemical Society","2002","124","","5183","5196","10.1021/ja0121383","","","0.71073","MoKα","","0.1934","0.0759","","0.1859","0.1619","","","","1.055","1.654","1.654","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114772","27.4425","0.0006","13.8076","0.0002","15.2781","0.0004","90","","90","","90","","5789.1","0.2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C30 H32 Cl2 Cr O5 -","- C30 H32 Cl2 Cr O5 -","- C240 H256 Cl16 Cr8 O40 -","8","2","","Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed","Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure","Journal of the American Chemical Society","2002","124","","5109","5116","10.1021/ja012141m","","","0.71073","MoKα","","0.0908","0.0598","","","0.1031","0.1131","","","","","","1.041","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114773","19.7635","0.0006","19.7635","0.0006","15.172","0.0007","90","","90","","90","","5926.1","0.4","120","2","120","2","","","","","","","","5","P 41","P 4w","76","","","","- C30 H32 Cl2 Cr O5 -","- C30 H32 Cl2 Cr O5 -","- C240 H256 Cl16 Cr8 O40 -","8","2","","Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed","Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure","Journal of the American Chemical Society","2002","124","","5109","5116","10.1021/ja012141m","","","0.71073","MoKα","","0.1224","0.0663","","","0.1296","0.1495","","","","","","1.018","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114774","8.6518","0.0006","10.0312","0.0008","14.6724","0.0009","90","","97.809","0.004","90","","1261.58","0.15","120","2","120","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C29 H36 O3 -","- C29 H36 O3 -","- C58 H72 O6 -","2","1","","Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed","Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure","Journal of the American Chemical Society","2002","124","","5109","5116","10.1021/ja012141m","","","0.71073","MoKα","","0.0775","0.068","","","0.1639","0.1721","","","","","","1.059","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114775","10.0416","0.0008","11.4518","0.0008","18.8534","0.0009","90","","90","","90","","2168","0.3","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H30 O2 -","- C26 H28.998 O2 -","- C104 H115.992 O8 -","4","1","","Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed","Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure","Journal of the American Chemical Society","2002","124","","5109","5116","10.1021/ja012141m","","","0.71073","MoKα","","0.1144","0.068","","","0.1446","0.164","","","","","","1.044","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114776","10.4305","0.0004","18.126","0.0008","30.9046","0.0011","90","","90","","90","","5842.9","0.4","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 Cr2 O8 -","- C32 H30 Cr2 O8 -","- C256 H240 Cr16 O64 -","8","2","","Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed","Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure","Journal of the American Chemical Society","2002","124","","5109","5116","10.1021/ja012141m","","","0.71073","MoKα","","0.0667","0.0494","","","0.119","0.1285","","","","","","1.01","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114777","12.7753","0.0006","13.2878","0.0006","18.6941","0.0008","77.804","0.003","89.098","0.003","89.761","0.002","3101.4","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C32.5 H31 Cl Cr2 O8 -","- C32.5 H31 Cl Cr2 O8 -","- C130 H124 Cl4 Cr8 O32 -","4","2","","Susan E. Gibson; Hasim Ibrahim; Jonathan W. Steed","Intermolecular Interactions in (Arene)chromium Carbonyl Compounds: Prediction of Chiral Crystal Packing from Racemate Structure","Journal of the American Chemical Society","2002","124","","5109","5116","10.1021/ja012141m","","","0.71073","MoKα","","0.1145","0.0773","","","0.1775","0.1975","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114778","8.914","0.002","10.946","0.002","11.207","0.002","86.88","0.03","88.04","0.03","85.24","0.03","1087.6","0.4","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H32 Br4 N4 O Zn -","- C15 H32 Br4 N4 O Zn -","- C30 H64 Br8 N8 O2 Zn2 -","2","1","","Johan Springborg; Bente Nielsen; Carl Erik Olsen; Inger Søtofte","Synthesis, Crystal Structure, and H/D Exchange of the Inside Protonated Form of the Cage Imine 4,8,12-Triaza-1-azoniatricyclo[6.6.3.24,12]nonadec-1(15)-ene. A Model for Proton Transfer through an Aliphatic Membrane","Journal of the American Chemical Society","2002","124","","5084","5090","10.1021/ja0127638","","","0.71073","MoKα","","0.0698","0.0482","","0.1208","0.1108","","","","1.05","1.104","1.104","","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114779","12.6439","0.0004","13.4981","0.0004","18.8481","0.0005","90.833","0.001","95.243","0.001","90.721","0.001","3202.67","0.16","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H60 B F24 P2 Rh2 -","- C58 H60 B F30 P2 Rh2 -","- C116 H120 B2 F60 P4 Rh4 -","2","1","","Felicia L. Taw; Heather Mellows; Peter S. White; Frederick J. Hollander; Robert G. Bergman; Maurice Brookhart; D. Michael Heinekey","Synthesis and Investigation of [Cp*(PMe3)Rh(H)(H2)]+ and Its Partially Deuterated and Tritiated Isotopomers: Evidence for a Hydride/Dihydrogen Structure","Journal of the American Chemical Society","2002","124","","5100","5108","10.1021/ja0165990","","","0.71073","MolybdenumKα","","0.089","0.065","","0.135","0.09","","","","","3.99","3.99","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114780","12.1814","0.0002","19.197","0.0004","24.7379","0.0005","90","","100.841","0.001","90","","5681.62","0.19","159.2","","159.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H41 B Cl2 F24 P Rh -","- C49 H41 B Cl4 F39 P Rh -","- C196 H164 B4 Cl16 F156 P4 Rh4 -","4","1","","Felicia L. Taw; Heather Mellows; Peter S. White; Frederick J. Hollander; Robert G. Bergman; Maurice Brookhart; D. Michael Heinekey","Synthesis and Investigation of [Cp*(PMe3)Rh(H)(H2)]+ and Its Partially Deuterated and Tritiated Isotopomers: Evidence for a Hydride/Dihydrogen Structure","Journal of the American Chemical Society","2002","124","","5100","5108","10.1021/ja0165990","","","0.7107","MoKα","","0","0.0412","","0","0.0464","","","","","","","1.622","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114781","8.523","0.004","19.434","0.003","15.469","0.003","90","","91.84","0.02","90","","2560.9","1.4","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Ir3 Mo O11 -","- C21 H15 Ir3 Mo O11 -","- C84 H60 Ir12 Mo4 O44 -","4","1","","Nigel T. Lucas; Jonathan P. Blitz; Simon Petrie; Robert Stranger; Mark G. Humphrey; Graham A. Heath; Vincent Otieno-Alego","Mixed-Metal Cluster Chemistry. 19. Crystallographic, Spectroscopic, Electrochemical, Spectroelectrochemical, and Theoretical Studies of Systematically Varied Tetrahedral Group 6-Iridium Clusters","Journal of the American Chemical Society","2002","124","","5139","5153","10.1021/ja0173829","","","0.7107","MoKα","","0.0757","0.0436","","0.0541","","0.0513","","","1.901","","","2.169","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114782","16.332","0.002","16.332","","24.696","0.005","90","","90","","90","","6587.3","1.6","296.2","","296.2","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C30 H30 Ir2 Mo2 O10 -","- C30 H30 Ir2 Mo2 O10 -","- C240 H240 Ir16 Mo16 O80 -","8","1","","Nigel T. Lucas; Jonathan P. Blitz; Simon Petrie; Robert Stranger; Mark G. Humphrey; Graham A. Heath; Vincent Otieno-Alego","Mixed-Metal Cluster Chemistry. 19. Crystallographic, Spectroscopic, Electrochemical, Spectroelectrochemical, and Theoretical Studies of Systematically Varied Tetrahedral Group 6-Iridium Clusters","Journal of the American Chemical Society","2002","124","","5139","5153","10.1021/ja0173829","","","0.7107","MoKα","","0.0494","0.0332","","0.0358","","0.0341","","","1.519","","","1.594","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114783","9.2819","0.0001","9.6886","0.0001","14.9537","0.0002","81.7838","0.0005","72.8327","0.0005","68.1183","0.0008","1191.46","0.02","473.2","","200","","","","","","","","","6","P -1","-P 1","2","","","","- C19 H16 Ir3 O10 P W -","- C19 H16 Ir3 O10 P W -","- C38 H32 Ir6 O20 P2 W2 -","2","1","","Nigel T. Lucas; Jonathan P. Blitz; Simon Petrie; Robert Stranger; Mark G. Humphrey; Graham A. Heath; Vincent Otieno-Alego","Mixed-Metal Cluster Chemistry. 19. Crystallographic, Spectroscopic, Electrochemical, Spectroelectrochemical, and Theoretical Studies of Systematically Varied Tetrahedral Group 6-Iridium Clusters","Journal of the American Chemical Society","2002","124","","5139","5153","10.1021/ja0173829","","","0.7107","MoKα","","0.0551","0.0481","","0.0595","","0.057","","","1.367","","","1.41","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114784","14.0627","0.0004","13.694","0.0004","16.0505","0.0005","90","","90","","90","","3090.92","0.16","120","","120","","","","","","","","local laboratory","3","P n m a","-P 2ac 2n","62","","","","- C34 H40 O10 -","- C34 H40 O10 -","- C136 H160 O40 -","4","0.5","","Ming He; Rolanda J. Johnson; Jorge O. Escobedo; Patricia A. Beck; Kyu Kwang Kim; Nadia N. St. Luce; Claude J. Davis; Patrick T. Lewis; Frank R. Fronczek; Bruce J. Melancon; Anthony A. Mrse; W. Dale Treleaven; Robert M. Strongin","Chromophore Formation in Resorcinarene Solutions and the Visual Detection of Mono- and Oligosaccharides","Journal of the American Chemical Society","2002","124","","5000","5009","10.1021/ja017713h","","","0.71073","MoKα","","0.09","0.064","","","0.145","0.165","","","","","","1.116","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114785","12.0481","0.0001","13.9921","0.0001","14.2119","0.0002","88.584","0.0004","83.4641","0.0004","84.0046","0.0005","2367.03","0.04","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C48.5 H49 Br Cl I N2 P2 Pt -","- C48.5 H49 Br Cl I N2 P2 Pt -","- C97 H98 Br2 Cl2 I2 N4 P4 Pt2 -","2","1","","Gema Rodríguez; Martin Albrecht; Jeroen Schoenmaker; Alan Ford; Martin Lutz; Anthony L. Spek; Gerard van Koten","Bifunctional Pincer-type Organometallics as Substrates for Organic Transformations and as Novel Building Blocks for Polymetallic Materials","Journal of the American Chemical Society","2002","124","","5127","5138","10.1021/ja0177657","","","0.71073","MoKα","","0.043","0.0339","","","0.0913","0.0955","","","","","","1.042","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4114786","10.7151","0.0013","7.3901","0.0005","21.018","0.003","90","","114.673","0.009","90","","1512.4","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Br I N2 Pt -","- C12 H18 Br I N2 Pt -","- C48 H72 Br4 I4 N8 Pt4 -","4","1","","Gema Rodríguez; Martin Albrecht; Jeroen Schoenmaker; Alan Ford; Martin Lutz; Anthony L. Spek; Gerard van Koten","Bifunctional Pincer-type Organometallics as Substrates for Organic Transformations and as Novel Building Blocks for Polymetallic Materials","Journal of the American Chemical Society","2002","124","","5127","5138","10.1021/ja0177657","","","0.71073","MoKα","","0.0547","0.0432","","","0.0986","0.1034","","","","","","1.062","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114787","15.4841","0.0001","21.1002","0.0002","21.8256","0.0002","90","","133.623","0.0003","90","","5161.96","0.08","125","2","125","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49.8 H51.6 Cl3.6 I2 N2 P2 Pt -","- C49.8 H51.6 Cl3.6 I2 N2 P2 Pt -","- C199.2 H206.4 Cl14.4 I8 N8 P8 Pt4 -","4","1","","Gema Rodríguez; Martin Albrecht; Jeroen Schoenmaker; Alan Ford; Martin Lutz; Anthony L. Spek; Gerard van Koten","Bifunctional Pincer-type Organometallics as Substrates for Organic Transformations and as Novel Building Blocks for Polymetallic Materials","Journal of the American Chemical Society","2002","124","","5127","5138","10.1021/ja0177657","","","0.71073","MoKα","","0.0439","0.0311","","","0.0728","0.0773","","","","","","1.034","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4114788","23.794","0.003","16.816","0.003","12.502","0.003","90","","90","","90","","5002.3","1.6","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C54 H54 I2 N2 P2 Pt2 -","- C54 H55 I2 N2 P2 Pt2 -","- C216 H220 I8 N8 P8 Pt8 -","4","0.5","","Gema Rodríguez; Martin Albrecht; Jeroen Schoenmaker; Alan Ford; Martin Lutz; Anthony L. Spek; Gerard van Koten","Bifunctional Pincer-type Organometallics as Substrates for Organic Transformations and as Novel Building Blocks for Polymetallic Materials","Journal of the American Chemical Society","2002","124","","5127","5138","10.1021/ja0177657","","","0.71073","MoKα","","0.0419","0.026","","","0.0527","0.0596","","","","","","1.063","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4114789","13.6334","0.0015","14.1668","0.0019","10.1738","0.0008","90","","100.739","0.008","90","","1930.6","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H27 I N2 Pt Si -","- C15 H27 I N2 Pt Si -","- C60 H108 I4 N8 Pt4 Si4 -","4","1","","Gema Rodríguez; Martin Albrecht; Jeroen Schoenmaker; Alan Ford; Martin Lutz; Anthony L. Spek; Gerard van Koten","Bifunctional Pincer-type Organometallics as Substrates for Organic Transformations and as Novel Building Blocks for Polymetallic Materials","Journal of the American Chemical Society","2002","124","","5127","5138","10.1021/ja0177657","","","0.71073","MoKα","","0.052","0.0383","","","0.0833","0.0885","","","","","","1.022","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114790","7.2432","0.0004","12.3845","0.0009","21.8269","0.0014","90","","90","","90","","1957.9","0.2","200","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(1R,2S-[2S,2-bS])-2-[(2-methyl-hexahydro-pyrrolo[1,2-b]isoxazol- 2-ylmethyl)-amino]-1-phenyl-propan-1-ol bis-hydrochloride","","- C17 H30 Cl2 N2 O3 -","- C17 H28 Cl2 N2 O3 -","- C68 H112 Cl8 N8 O12 -","4","1","","Florian Viton; Gérald Bernardinelli; E. Peter Kündig","Iron and Ruthenium Lewis Acid Catalyzed Asymmetric 1,3-Dipolar Cycloaddition Reactions between Nitrones and Enals","Journal of the American Chemical Society","2002","124","","4968","4969","10.1021/ja017814f","","","0.71073","MoKα","","","0.038","","","","0.042","","","","","","1.809","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114791","12.6202","0.0006","13.7596","0.0007","14.0294","0.0007","64.6376","0.0009","64.257","0.0009","66.0549","0.0009","1909.22","0.16","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H48 Cu3 N24 O8 Re2 -","- C96 H48 Cu3 N24 O8 Re2 -","- C96 H48 Cu3 N24 O8 Re2 -","1","0.5","","Anna S. Gardberg; Kaiming Deng; Donald E. Ellis; James A. Ibers","Preparation and Structure of (Cu(pc))~3~(ReO~4~)~2~ and Theoretical Investigation of Cu(pc)(ReO~4~), Cu(pc)(ReO~4~)~2~, and (Cu(pc))~3~(ReO~4~)~2~","Journal of the American Chemical Society","2002","124","","5476","5480","10.1021/ja011829w","","","0.71073","MoKα","","0.0958","0.0526","","","0.1049","0.1201","","","","","","1.005","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114792","12.707","0.0005","12.94","0.0005","15.748","0.0006","81.849","0.0011","87.601","0.0012","63.889","0.0017","2301.05","0.16","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H34 F12 N10 P2 Ru -","- C48 H31 F12 N10 P2 Ru -","- C96 H62 F24 N20 P4 Ru2 -","2","1","","Dalia Gut; Amira Rudi; Jacob Kopilov; Israel Goldberg; Moshe Kol","Pairing of Propellers: Dimerization of Octahedral Ruthenium(II) and Osmium(II) Complexes of Eilatin via π-π Stacking Featuring Heterochiral Recognition","Journal of the American Chemical Society","2002","124","","5449","5456","10.1021/ja012636b","","","0.7107","MoKα","","0.1455","0.0675","","","0.1499","0.1818","","","","","","1.042","","","","has coordinates,has disorder","178918","2020-10-21","18:00:00",""
"4114793","12.645","0.001","13.399","0.001","15.324","0.001","85.671","0.01","79.804","0.01","63.816","0.01","2293.1","0.4","115","","115","","","","","","","","","7","P -1","-P 1","2","","","","- C50 H33 F12 N9 O P2 Ru -","- C50 H28 F12 N9 O0.5 P2 Ru -","- C100 H56 F24 N18 O P4 Ru2 -","2","1","","Dalia Gut; Amira Rudi; Jacob Kopilov; Israel Goldberg; Moshe Kol","Pairing of Propellers: Dimerization of Octahedral Ruthenium(II) and Osmium(II) Complexes of Eilatin via π-π Stacking Featuring Heterochiral Recognition","Journal of the American Chemical Society","2002","124","","5449","5456","10.1021/ja012636b","","","0.7107","MoKα","","0.0636","0.0477","","","0.1169","0.1261","","","","","","1.018","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114794","11.442","0.001","13.447","0.001","16.397","0.001","77.294","0.01","78.438","0.01","81.707","0.01","2397.9","0.3","115","","115","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H28 F12 N8 Os P2 -","- C44 H28 F12 N8 Os P2 -","- C88 H56 F24 N16 Os2 P4 -","2","1","","Dalia Gut; Amira Rudi; Jacob Kopilov; Israel Goldberg; Moshe Kol","Pairing of Propellers: Dimerization of Octahedral Ruthenium(II) and Osmium(II) Complexes of Eilatin via π-π Stacking Featuring Heterochiral Recognition","Journal of the American Chemical Society","2002","124","","5449","5456","10.1021/ja012636b","","","0.7107","MoKα","","0.0677","0.048","","","0.1106","0.1174","","","","","","1.011","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114795","12.975","0.0003","13.448","0.0002","18.39","0.0005","74.303","0.0017","85.451","0.0013","76.894","0.0017","3008.14","0.12","115","","115","","","","","","","","","7","P -1","-P 1","2","","","","- C68 H52 F12 N10 O P2 Ru -","- C66 H47 F12 N10 O0.5 P2 Ru -","- C132 H94 F24 N20 O P4 Ru2 -","2","1","","Dalia Gut; Amira Rudi; Jacob Kopilov; Israel Goldberg; Moshe Kol","Pairing of Propellers: Dimerization of Octahedral Ruthenium(II) and Osmium(II) Complexes of Eilatin via π-π Stacking Featuring Heterochiral Recognition","Journal of the American Chemical Society","2002","124","","5449","5456","10.1021/ja012636b","","","0.7107","MoKα","","0.0879","0.069","","","0.1893","0.2079","","","","","","1.017","","","","has coordinates","178918","2020-10-21","18:00:00",""
"4114796","12.3084","0.0004","12.9874","0.0005","8.2414","0.0003","90","","90.591","0.003","90","","1317.35","0.08","150","","150","","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H14 Cu N6 S2 -","- C8 H14 Cu N6 S2 -","- C32 H56 Cu4 N24 S8 -","4","0.5","","Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Elena Labisbal; Antonio Sousa","An Unusual Dimeric Structure of a Cu(I) Bis(thiosemicarbazone) Complex: Implications for the Mechanism of Hypoxic Selectivity of the Cu(II) Derivatives","Journal of the American Chemical Society","2002","124","","5270","5271","10.1021/ja012668z","","","0.71073","MoKα","","","0.0243","","","","0.0298","","","","","","0.988","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114797","7.3522","0.0001","9.9455","0.0002","10.0514","0.0003","99.1702","0.0008","107.503","0.0008","105.033","0.001","654.09","0.03","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C8 H14 N6 S2 Zn -","- C8 H14 N6 S2 Zn -","- C16 H28 N12 S4 Zn2 -","2","1","","Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Elena Labisbal; Antonio Sousa","An Unusual Dimeric Structure of a Cu(I) Bis(thiosemicarbazone) Complex: Implications for the Mechanism of Hypoxic Selectivity of the Cu(II) Derivatives","Journal of the American Chemical Society","2002","124","","5270","5271","10.1021/ja012668z","","","0.71073","MoKα","","","0.0207","","","","0.0243","","","","","","1.0068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114798","17.9984","0.0003","26.7127","0.0005","11.7729","0.0002","90","","114.064","0.0005","90","","5168.32","0.16","150","","150","","","","","","","","?","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H30 Cu F6 N8 O2 P S2 -","- C14 H30 Cu F6 N8 O2 P S2 -","- C112 H240 Cu8 F48 N64 O16 P8 S16 -","8","1","","Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Elena Labisbal; Antonio Sousa","An Unusual Dimeric Structure of a Cu(I) Bis(thiosemicarbazone) Complex: Implications for the Mechanism of Hypoxic Selectivity of the Cu(II) Derivatives","Journal of the American Chemical Society","2002","124","","5270","5271","10.1021/ja012668z","","","0.71073","MoKα","","","0.0368","","","","0.0423","","","","","","1.0428","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114799","12.349","0.001","14.77","0.001","14.109","0.001","90","","103.62","0.004","90","","2501","0.3","113.2","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C17 H34 Cl N7 O8.5 P Zn -","- C17 H33 Cl N7 O8.5 P Zn -","- C68 H132 Cl4 N28 O34 P4 Zn4 -","4","1","","Shin Aoki; Kenta Iwaida; Noriko Hanamoto; Motoo Shiro; Eiichi Kimura","Guanidine Is a Zn2±Binding Ligand at Neutral pH in Aqueous Solution","Journal of the American Chemical Society","2002","124","","5256","5257","10.1021/ja020029y","","","0.7107","MoKα","","","0.0765","","","","0.1831","","","","","","1.184","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114800","9.3182","0.0008","14.92","0.001","14.618","0.002","90","","97.934","0.003","90","","2012.9","0.4","113.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H27 Cl2 N7 O8 Zn -","- C11 H27 Cl2 N7 O8 Zn -","- C44 H108 Cl8 N28 O32 Zn4 -","4","1","","Shin Aoki; Kenta Iwaida; Noriko Hanamoto; Motoo Shiro; Eiichi Kimura","Guanidine Is a Zn2±Binding Ligand at Neutral pH in Aqueous Solution","Journal of the American Chemical Society","2002","124","","5256","5257","10.1021/ja020029y","","","0.7107","MoKα","","","0.0294","","","","0.0501","","","","","","1.053","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114801","9.6947","0.0006","12.0858","0.0008","21.2732","0.0014","90","","90","","90","","2492.5","0.3","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H22 B F10 Ta -","- C29 H22 B F10 Ta -","- C116 H88 B4 F40 Ta4 -","4","1","","Kevin S. Cook; Warren E. Piers; Robert McDonald","Synthesis and Chemistry of Zwitterionic Tantala-3-boratacyclopentenes: Olefin-like Reactivity of a Borataalkene Ligand","Journal of the American Chemical Society","2002","124","","5411","5418","10.1021/ja025547n","","","0.71073","MoKα","","0.0533","0.0367","","","0.0531","0.0564","","","","","","0.863","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114802","14.9651","0.0007","12.6093","0.0006","16.1443","0.0008","90","","103.1","0.001","90","","2967.1","0.2","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H24 B Cl F10 Ta -","- C34 H24 B Cl F10 Ta -","- C136 H96 B4 Cl4 F40 Ta4 -","4","1","","Kevin S. Cook; Warren E. Piers; Robert McDonald","Synthesis and Chemistry of Zwitterionic Tantala-3-boratacyclopentenes: Olefin-like Reactivity of a Borataalkene Ligand","Journal of the American Chemical Society","2002","124","","5411","5418","10.1021/ja025547n","","","0.71073","MoKα","","0.0265","0.023","","","0.0605","0.0623","","","","","","1.052","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114803","12.592","0.0006","11.5277","0.0006","19.4942","0.0009","90","","108.217","0.0011","90","","2687.9","0.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H20 B F10 Ta -","- C32 H20 B F10 Ta -","- C128 H80 B4 F40 Ta4 -","4","1","","Kevin S. Cook; Warren E. Piers; Robert McDonald","Synthesis and Chemistry of Zwitterionic Tantala-3-boratacyclopentenes: Olefin-like Reactivity of a Borataalkene Ligand","Journal of the American Chemical Society","2002","124","","5411","5418","10.1021/ja025547n","","","0.71073","MoKα","","0.0481","0.0329","","","0.072","0.0769","","","","","","0.988","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114804","9.719","0.0002","6.765","0.0001","18.174","0.0004","90","","93.314","0.001","90","","1192.92","0.04","100","","100","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Cr N2 O5 -","- C10 H8 Cr N2 O5 -","- C40 H32 Cr4 N8 O20 -","4","1","","Maxim Tafipolsky; Wolfgang Scherer; Karl Öfele; Georg Artus; Bjørn Pedersen; Wolfgang A. Herrmann; G. Sean McGrady","Electron Delocalization in Acyclic and N-Heterocyclic Carbenes and Their Complexes: A Combined Experimental and Theoretical Charge-Density Study","Journal of the American Chemical Society","2002","124","","5865","5880","10.1021/ja011761k","","","0.71073","MoKα","","0.038","0.0198","","","0.048","","","","","","","0.8006","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114805","13.244","0.0003","10.551","0.0002","18.117","0.0003","90","","106.538","0.001","90","","2426.89","0.08","173","","173","","","","","","","","see text","5","I 1 a 1","I -2ya","9","","","","- C10 H8 Cr N2 O5 -","- C10 H8 Cr N2 O5 -","- C80 H64 Cr8 N16 O40 -","8","2","","Maxim Tafipolsky; Wolfgang Scherer; Karl Öfele; Georg Artus; Bjørn Pedersen; Wolfgang A. Herrmann; G. Sean McGrady","Electron Delocalization in Acyclic and N-Heterocyclic Carbenes and Their Complexes: A Combined Experimental and Theoretical Charge-Density Study","Journal of the American Chemical Society","2002","124","","5865","5880","10.1021/ja011761k","","","0.71073","MoKα","","0.0252","0.0239","","","0.0561","0.0566","","","","","","1.065","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114806","8.1983","0.0001","12.5454","0.0001","18.9873","0.0001","90","","90","","90","","1952.86","0.03","173","","173","","","","","","","","see text","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H28 Cr N2 O4 -","- C17 H28 Cr N2 O4 -","- C68 H112 Cr4 N8 O16 -","4","1","","Maxim Tafipolsky; Wolfgang Scherer; Karl Öfele; Georg Artus; Bjørn Pedersen; Wolfgang A. Herrmann; G. Sean McGrady","Electron Delocalization in Acyclic and N-Heterocyclic Carbenes and Their Complexes: A Combined Experimental and Theoretical Charge-Density Study","Journal of the American Chemical Society","2002","124","","5865","5880","10.1021/ja011761k","","","0.71073","MoKα","","0.0266","0.024","","","0.0582","0.0595","","","","","","1.04","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114807","9.184","0.002","17.409","0.004","18.815","0.004","90","0.03","90","0.03","90","0.03","3008.2","1.1","140","2","140","2","","","","","","","","4","P b a m","-P 2 2ab","55","[Au(2-py)]3","","","- C15 H12 Au3 N3 -","- C15 H12 Au3 N3 -","- C120 H96 Au24 N24 -","8","1","","Akari Hayashi; Marilyn M. Olmstead; Saeed Attar; Alan L. Balch","Crystal Chemistry of the Gold (I) Trimer, Au3(NC5H4)3: Formation of Hourglass Figures and Self-Association through Aurophilic Attraction","Journal of the American Chemical Society","2002","124","","5791","5795","10.1021/ja012416y","","","0.71073","MoKα","","0.1133","0.0523","","","0.1266","0.1545","","","","","","1.037","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114808","26.327","0.001","17.0084","0.0008","26.99","0.001","90","","121.266","0.002","90","","10330.4","0.8","296.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C120 H94 N8 O7 Zn4 -","- C120 H94 N8 O7 Zn4 -","- C480 H376 N32 O28 Zn16 -","4","0.5","","Hiroyuki Furuta; Tomoya Ishizuka; Atsuhiro Osuka","Flexible Inner and Outer Coordination of Zn(II) N-Confused Porphyrin Complex","Journal of the American Chemical Society","2002","124","","5622","5623","10.1021/ja017016p","","","0.7107","MoKα","","","0.07","","","","0.098","","","","","","0.228","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114809","13.067","0.002","13.443","0.002","14.917","0.002","75.04","0.008","70.377","0.003","66.321","0.005","2237.1","0.6","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C54 H37 N6 O2 Zn -","- C54 H37 N6 O2 Zn -","- C108 H74 N12 O4 Zn2 -","2","1","","Hiroyuki Furuta; Tomoya Ishizuka; Atsuhiro Osuka","Flexible Inner and Outer Coordination of Zn(II) N-Confused Porphyrin Complex","Journal of the American Chemical Society","2002","124","","5622","5623","10.1021/ja017016p","","","0.7107","MoKα","","","0.086","","","","0.126","","","","","","0.245","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114810","12.118","0.005","13.945","0.005","15.406","0.005","93.277","0.005","102.539","0.005","97.88","0.005","2507.1","1.6","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H94 B2 O4 P2 Ru -","- C48 H94 B2 O4 P2 Ru -","- C96 H188 B4 O8 P4 Ru2 -","2","1","","Virginia Montiel-Palma; María Lumbierres; Bruno Donnadieu; Sylviane Sabo-Etienne; Bruno Chaudret","σ-Borane and Dihydroborate Complexes of Ruthenium","Journal of the American Chemical Society","2002","124","","5624","5625","10.1021/ja017429q","","","0.71073","MoKα","","0.0744","0.0405","","","0.0769","0.0862","","","","","","0.929","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114811","6.43","0.009","20.827","0.004","11.58","0.002","90","","94.6","0.03","90","","1546","2","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 B2 O5 -","- C12 H24 B2 O5 -","- C48 H96 B8 O20 -","4","1","","Virginia Montiel-Palma; María Lumbierres; Bruno Donnadieu; Sylviane Sabo-Etienne; Bruno Chaudret","σ-Borane and Dihydroborate Complexes of Ruthenium","Journal of the American Chemical Society","2002","124","","5624","5625","10.1021/ja017429q","","","0.71073","MoKα","","0.0934","0.0688","","","0.1916","0.2136","","","","","","1.067","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114812","13.6919","0.0008","30.832","0.0019","15.1279","0.0009","90","","97.35","0.001","90","","6333.7","0.7","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetrakis(m^2-2,4,6-triisopropylbenzoato-O,O') dirhodium(II,II)","","- C64 H92 O8 Rh2 -","- C64 H92 O8 Rh2 -","- C256 H368 O32 Rh8 -","4","1","","F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo","The First Dirhodium Tetracarboxylate Molecule without Axial Ligation: New Insight into the Electronic Structures of Molecules with Importance in Catalysis and Other Reactions","Journal of the American Chemical Society","2002","124","","5658","5660","10.1021/ja025760j","","","0.71073","MoKα","","0.0789","0.0503","","","0.1034","0.1163","","","","","","1.062","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114813","14.776","0.0012","16.429","0.0014","17.4638","0.0015","65.457","0.001","78.709","0.002","87.445","0.002","3778.5","0.6","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","tetrakis(m^2-2,4,6-triisopropylbenzoato-O,O')dirhodium(II,II), acetone solvate","","- C72.67 H109.44 O10.9 Rh2 -","- C72.672 H109.448 O10.908 Rh2 -","- C145.344 H218.896 O21.816 Rh4 -","2","1","","F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo","The First Dirhodium Tetracarboxylate Molecule without Axial Ligation: New Insight into the Electronic Structures of Molecules with Importance in Catalysis and Other Reactions","Journal of the American Chemical Society","2002","124","","5658","5660","10.1021/ja025760j","","","0.71073","MoKα","","0.0684","0.0519","","","0.1337","0.1472","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114814","6.1315","0.0001","9.2705","0.0001","11.2898","0.0001","79.0812","0.0008","77.3338","0.0009","88.9802","0.001","614.595","0.013","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H14 S2 -","- C16 H14 S2 -","- C32 H28 S4 -","2","1","","Ronny Priefer; Yoon Joo Lee; Fabiola Barrios; Jordan H. Wosnick; Anne-Marie Lebuis; Patrick G. Farrell; David N. Harpp; Aiming Sun; Shaoxiong Wu; James P. Snyder","Dicubyl Disulfide","Journal of the American Chemical Society","2002","124","","5626","5627","10.1021/ja025823y","","","1.54178","CuKα","","0.0681","0.0666","","","0.189","0.1913","","","","","","1.083","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114815","14.0562","0.0014","5.4159","0.0006","18.8953","0.0016","90","0.008","111.635","0.008","90","0.008","1337.1","0.2","293","","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H26 O8 S -","- C32 H26 O8 S -","- C64 H52 O16 S2 -","2","1","","David Crich; Jan Mataka; Lev N. Zakharov; Arnold L. Rheingold; Donald J. Wink","Stereoselective Formation of Glycosyl Sulfoxides and Their Subsequent Equilibration: Ring Inversion of an α-Xylopyranosyl Sulfoxide Dependent on the Configuration at Sulfur","Journal of the American Chemical Society","2002","124","","6028","6036","10.1021/ja0122694","","","0.71073","MoKα","","0.123","0.084","","0.062","0.052","","","","3.547","3.869","3.869","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4114816","7.452","0.004","10.874","0.005","31.285","0.013","90","","90","","90","","2535","2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H26 O8 S -","- C29 H26 O8 S -","- C116 H104 O32 S4 -","4","1","","David Crich; Jan Mataka; Lev N. Zakharov; Arnold L. Rheingold; Donald J. Wink","Stereoselective Formation of Glycosyl Sulfoxides and Their Subsequent Equilibration: Ring Inversion of an α-Xylopyranosyl Sulfoxide Dependent on the Configuration at Sulfur","Journal of the American Chemical Society","2002","124","","6028","6036","10.1021/ja0122694","","","0.71073","MoKα","","0.1168","0.0961","","","0.2025","0.2106","","","","","","1.313","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114817","9.4724","0.0013","16.6094","0.0014","18.744","0.002","90","","97.183","0.008","90","","2925.9","0.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-dimethoxy-2,5-bis(2-pyridyl)benzene","","- C18 H16 N2 O2 -","- C18 H15.633 N2 O2 -","- C144 H125.064 N16 O16 -","8","2","","Andrew P. Monkman; Lars-Olof Pålsson; Roger W. T. Higgins; Changsheng Wang; Martin R. Bryce; Andrei S. Batsanov; Judith A. K. Howard","Protonation and Subsequent Intramolecular Hydrogen Bonding as a Method to Control Chain Structure and Tune Luminescence in Heteroatomic Conjugated Polymers","Journal of the American Chemical Society","2002","124","","6049","6055","10.1021/ja012409+","","","1.54184","CuKα","","0.0655","0.0506","","0.1499","0.128","","","","1.044","1.083","1.083","","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114818","3.8209","0.0005","10.6755","0.0018","10.9854","0.0017","98.934","0.013","94.267","0.013","93.942","0.013","439.96","0.12","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","1,4-dimethoxy-2,5-bis(2-pyridyl)benzene complex with formic acid","","- C20 H20 N2 O6 -","- C20 H20 N2 O6 -","- C20 H20 N2 O6 -","1","0.5","","Andrew P. Monkman; Lars-Olof Pålsson; Roger W. T. Higgins; Changsheng Wang; Martin R. Bryce; Andrei S. Batsanov; Judith A. K. Howard","Protonation and Subsequent Intramolecular Hydrogen Bonding as a Method to Control Chain Structure and Tune Luminescence in Heteroatomic Conjugated Polymers","Journal of the American Chemical Society","2002","124","","6049","6055","10.1021/ja012409+","","","1.54184","CuKα","","0.0437","0.0363","","","0.0909","0.0964","","","","","","1.027","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114819","8.45","0.0009","7.2674","0.0009","15.6406","0.0013","90","","91.118","0.008","90","","960.3","0.18","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,4-dimethoxy-2,5-bis(2-pyridyl)benzene-bis(tetrafluoroboric acid) salt","","- C18 H18 B2 F8 N2 O2 -","- C18 H18 B2 F8 N2 O2 -","- C36 H36 B4 F16 N4 O4 -","2","0.5","","Andrew P. Monkman; Lars-Olof Pålsson; Roger W. T. Higgins; Changsheng Wang; Martin R. Bryce; Andrei S. Batsanov; Judith A. K. Howard","Protonation and Subsequent Intramolecular Hydrogen Bonding as a Method to Control Chain Structure and Tune Luminescence in Heteroatomic Conjugated Polymers","Journal of the American Chemical Society","2002","124","","6049","6055","10.1021/ja012409+","","","1.54184","CuKα","","0.0523","0.0397","","","0.0973","0.1048","","","","","","1.04","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114820","14.657","0.0006","22.001","0.0006","25.009","0.0009","90","","104.178","0.002","90","","7819","0.5","180","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C70 H96 F12 Fe2 N6 O17 P2 -","- C70 H96 F12 Fe2 N6 O17 P2 -","- C280 H384 F48 Fe8 N24 O68 P8 -","4","1","","Masashi Enomoto; Takuzo Aida","Iron Complexes Capped with Dendrimer-Appended Triazacyclononanes as the Novel Spatially Encumbered Models of Non-Heme Iron Proteins","Journal of the American Chemical Society","2002","124","","6099","6108","10.1021/ja012589n","","","0.7107","MoKα","","","0.0484","","","","0.0595","","","","","","2.235","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114821","7.6651","0.0005","13.3047","0.0007","23.7387","0.0012","90","","90","","90","","2420.9","0.2","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3'S,5'R)-N6-benzoyl-9-(2'-deoxy-3',5'-ethano-5',6'-methano -D-ribofuranosyl)adenine","","- C24 H31 N5 O6 -","- C24 H31 N5 O6 -","- C96 H124 N20 O24 -","4","1","","Dorte Renneberg; Christian J. Leumann","Watson-Crick Base-Pairing Properties of Tricyclo-DNA","Journal of the American Chemical Society","2002","124","","5993","6002","10.1021/ja025569+","","","0.71073","MoKα","","0.0725","0.0425","","","0.0928","0.1017","","","","","","0.89","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114822","6.2225","0.0004","11.3686","0.0006","35.12","0.002","90","","90","","90","","2484.4","0.3","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3'S,5'R)-N4-Benzoyl-1-{5'-O-[(tert-butyl)dimethylsilyl]-2'-deoxy -3',5'-ethano-5',6'-methano-D-ribofuranosyl}cytidine","","- C25 H33 N3 O5 Si -","- C25 H33 N3 O5 Si -","- C100 H132 N12 O20 Si4 -","4","1","","Dorte Renneberg; Christian J. Leumann","Watson-Crick Base-Pairing Properties of Tricyclo-DNA","Journal of the American Chemical Society","2002","124","","5993","6002","10.1021/ja025569+","","","0.71073","MoKα","","0.0579","0.0441","","","0.0934","0.0997","","","","","","1.042","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114823","17.2784","0.0009","27.2637","0.0015","28.9377","0.0016","113.436","0.001","99.289","0.001","99.656","0.001","11931.4","1.1","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C75.5 H158 As16 K4 N11.5 O24 Pd7 -","- C75.5 H158 As16 K4 N11.5 O24 Pd7 -","- C302 H632 As64 K16 N46 O96 Pd28 -","4","2","","Melanie J. Moses; James Fettinger; Bryan Eichhorn","Charged Molecular Alloys: Synthesis and Characterization of the Binary Anions Pd7As164- and Pd2As144-","Journal of the American Chemical Society","2002","124","","5944","5945","10.1021/ja025627r","","","0.71073","MoKα","","0.118","0.0534","","","0.1294","0.1485","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114824","15.9132","0.001","23.733","0.0014","34.141","0.002","90","","90.817","0.001","90","","12892.7","1.3","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C82 H184 As14 K4 N18 O24 Pd2 -","- C82 H184 As14 K4 N18 O24 Pd2 -","- C328 H736 As56 K16 N72 O96 Pd8 -","4","0.5","","Melanie J. Moses; James Fettinger; Bryan Eichhorn","Charged Molecular Alloys: Synthesis and Characterization of the Binary Anions Pd7As164- and Pd2As144-","Journal of the American Chemical Society","2002","124","","5944","5945","10.1021/ja025627r","","","0.71073","MoKα","","0.0753","0.0431","","","0.1051","0.1147","","","","","","1.051","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114825","9.446","0.003","17.746","0.005","21.634","0.007","90","","90","","90","","3626.5","1.9","85","","85","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","2b, [Fc""(CH)3Fc""]+[PF6]-","1,3-bis(2,3,4,5,1',2',3',4'-octamethylferrocen-1-yl)allylium hexafluorophosphate","","- C39 H53 F6 Fe2 P -","- C39 H53 F6 Fe2 P -","- C156 H212 F24 Fe8 P4 -","4","1","","Stephen Barlow; Lawrence M. Henling; Michael W. Day; William P. Schaefer; Jennifer C. Green; Tony Hascall; Seth R. Marder","Metallocene-Terminated Allylium Salts: The Effect of End Group on Localization in Polymethines","Journal of the American Chemical Society","2002","124","","6285","6296","10.1021/ja012472z","","","0.71073","MoKα","","0.034","0.0298","","","0.0587","0.0602","","","","","","1.507","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4114826","16.5037","0.0006","18.7047","0.0003","18.3623","0.0005","90","","111.946","0.002","90","","5257.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3c, [Rc(CH)3Rc]+[BAr'4]-","1,3-bis(ruthenocenyl)allylium tetrakis(3,5-bis(trifluoromethyl)phenyl)borate","","- C55 H33 B F24 Ru2 -","- C55 H33 B F24 Ru2 -","- C220 H132 B4 F96 Ru8 -","4","1","","Stephen Barlow; Lawrence M. Henling; Michael W. Day; William P. Schaefer; Jennifer C. Green; Tony Hascall; Seth R. Marder","Metallocene-Terminated Allylium Salts: The Effect of End Group on Localization in Polymethines","Journal of the American Chemical Society","2002","124","","6285","6296","10.1021/ja012472z","","x-ray","0.71073","MoKα","","0.1269","0.0636","","","0.1437","0.1817","","","","","","1.021","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114827","8.702","0.003","20.419","0.004","15.446","0.003","90","","93.24","0.02","90","","2740.2","1.2","85","","85","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4a, [Fc(CH)3Fc""]+[BF4]-","1-ferrocenyl-3-(2,3,4,5,1',2',3'4'-octamethylferrocenyl)allylium tetrafluoroborate","","- C31 H37 B F4 Fe2 -","- C31 H37 B F4 Fe2 -","- C124 H148 B4 F16 Fe8 -","4","1","","Stephen Barlow; Lawrence M. Henling; Michael W. Day; William P. Schaefer; Jennifer C. Green; Tony Hascall; Seth R. Marder","Metallocene-Terminated Allylium Salts: The Effect of End Group on Localization in Polymethines","Journal of the American Chemical Society","2002","124","","6285","6296","10.1021/ja012472z","","","0.7107","MoKα","","0.0594","0.0594","","0.1132","0.1132","","","","2.73","2.73","2.73","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114828","26.411","0.006","14.753","0.003","11.9","0.003","90","","112.92","0.02","90","","4270.7","1.8","84","","84","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","5b, [Rc(CH)3Fc]+[PF6]-","1-(ruthenocenyl)-3-(ferrocenyl)allylium hexafluorophosphate","","- C23 H21 F6 Fe P Ru -","- C23 H21 F6 Fe P Ru -","- C184 H168 F48 Fe8 P8 Ru8 -","8","1","","Stephen Barlow; Lawrence M. Henling; Michael W. Day; William P. Schaefer; Jennifer C. Green; Tony Hascall; Seth R. Marder","Metallocene-Terminated Allylium Salts: The Effect of End Group on Localization in Polymethines","Journal of the American Chemical Society","2002","124","","6285","6296","10.1021/ja012472z","","","0.71073","MoKα","","0.0402","0.0344","","","0.075","0.0757","","","","","","2.322","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114829","6.6894","0.0007","18.0963","0.0018","27.195","0.003","90","","90","","90","","3292","0.6","110","2","110","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H54 N2 O2 -","- C36 H54 N2 O2 -","- C144 H216 N8 O8 -","4","1","","Donald J. Darensbourg; Jason C. Yarbrough","Mechanistic Aspects of the Copolymerization Reaction of Carbon Dioxide and Epoxides, Using a Chiral Salen Chromium Chloride Catalyst","Journal of the American Chemical Society","2002","124","","6335","6342","10.1021/ja012714v","","","0.71073","MoKα","","0.1164","0.0629","","","0.1319","0.155","","","","","","0.828","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114830","12.593","0.003","30.774","0.007","11.704","0.003","90","","110.88","0.005","90","","4237.9","1.8","110","2","110","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C76 H112 Cl10 Cr2 N4 O4 -","- C75.8 H111.4 Cl10 Cr2.008 N4 O4 -","- C151.6 H222.8 Cl20 Cr4.016 N8 O8 -","2","1","","Donald J. Darensbourg; Jason C. Yarbrough","Mechanistic Aspects of the Copolymerization Reaction of Carbon Dioxide and Epoxides, Using a Chiral Salen Chromium Chloride Catalyst","Journal of the American Chemical Society","2002","124","","6335","6342","10.1021/ja012714v","","","0.71073","MoKα","","0.2765","0.1079","","","0.2488","0.3453","","","","","","0.693","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114831","14.3075","0.0003","14.7516","0.0004","16.6486","0.0004","90","","103.422","0.0007","90","","3417.85","0.14","158.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C34 H35 Cu D2 F6 N2 O P2 -","- C34 H35 Cu F6 N2 O P2 -","- C136 H140 Cu4 F24 N8 O4 P8 -","4","1","","Masayasu Taki; Shinichi Teramae; Shigenori Nagatomo; Yoshimitsu Tachi; Teizo Kitagawa; Shinobu Itoh; Shunichi Fukuzumi","Fine-Tuning of Copper(I)-Dioxygen Reactivity by 2-(2-Pyridyl)ethylamine Bidentate Ligands","Journal of the American Chemical Society","2002","124","","6367","6377","10.1021/ja026047x","","","0.7107","MoKα","","","0.057","","","","0.087","","","","","","0.925","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114832","22.512","0.002","8.2258","0.0007","14.925","0.001","90","","90","","90","","2763.8","0.4","223.1","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C27 H29 Cu F6 N2 P2 -","- C27 H29 Cu F6 N2 P2 -","- C108 H116 Cu4 F24 N8 P8 -","4","1","","Masayasu Taki; Shinichi Teramae; Shigenori Nagatomo; Yoshimitsu Tachi; Teizo Kitagawa; Shinobu Itoh; Shunichi Fukuzumi","Fine-Tuning of Copper(I)-Dioxygen Reactivity by 2-(2-Pyridyl)ethylamine Bidentate Ligands","Journal of the American Chemical Society","2002","124","","6367","6377","10.1021/ja026047x","","","0.7107","MoKα","","","0.043","","","","0.034","","","","","","0.847","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114833","10.515","0.001","12.2207","0.0008","12.041","0.001","90","","106.414","0.003","90","","1484.2","0.2","296.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Cu2 F6 N4 O8 S2 -","- C20 H30 Cu2 F6 N4 O7 S2 -","- C40 H60 Cu4 F12 N8 O14 S4 -","2","0.5","","Masayasu Taki; Shinichi Teramae; Shigenori Nagatomo; Yoshimitsu Tachi; Teizo Kitagawa; Shinobu Itoh; Shunichi Fukuzumi","Fine-Tuning of Copper(I)-Dioxygen Reactivity by 2-(2-Pyridyl)ethylamine Bidentate Ligands","Journal of the American Chemical Society","2002","124","","6367","6377","10.1021/ja026047x","","","0.7107","MoKα","","","0.045","","","","0.079","","","","","","0.939","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114834","13.654","0.009","13.776","0.008","32.91","0.01","90","","90","","90","","6190","6","294.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C51 H72 I4 Ir4 N8 -","- C51 H64 I4 Ir4 N8 -","- C204 H256 I16 Ir16 N32 -","4","1","","Yoshiaki Tanabe; Shigeki Kuwata; Youichi Ishii","Syntheses and Skeletal Transformations of NCNH- and NCN-Bridged Tetrairidium(III) Cages","Journal of the American Chemical Society","2002","124","","6528","6529","10.1021/ja017436e","","","0.7107","MoKα","","","0.05","","","","0.0499","","","","","","1.373","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114835","11.8609","0.0006","13.632","0.001","17.707","0.001","110.448","0.002","91.827","0.004","115.614","0.002","2361.6","0.3","123.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C47.5 H64 Ir4 N8 -","- C47.5 H60 Ir4 N8 -","- C95 H120 Ir8 N16 -","2","1","","Yoshiaki Tanabe; Shigeki Kuwata; Youichi Ishii","Syntheses and Skeletal Transformations of NCNH- and NCN-Bridged Tetrairidium(III) Cages","Journal of the American Chemical Society","2002","124","","6528","6529","10.1021/ja017436e","","","0.7107","MoKα","","","0.0296","","","","0.0385","","","","","","1.798","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114836","11.967","0.002","11.9674","","15.248","0.005","90","","90","","90","","2183.7","0.8","294.2","","","","","","","","","","","4","I -4 2 m","I -4 2","121","","","","- C44 H60 Ir4 N8 -","- C44 H68 Ir4 N8 -","- C88 H136 Ir8 N16 -","2","0.125","","Yoshiaki Tanabe; Shigeki Kuwata; Youichi Ishii","Syntheses and Skeletal Transformations of NCNH- and NCN-Bridged Tetrairidium(III) Cages","Journal of the American Chemical Society","2002","124","","6528","6529","10.1021/ja017436e","","","0.7107","MoKα","","","0.025","","","","0.032","","","","","","0.979","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114837","10.1282","0.0007","14.4441","0.0008","21.89","0.001","75.375","0.001","81.124","0.001","69.916","0.001","2902.1","0.3","165","","","","","","","","","","Local laboratory","4","P -1","-P 1","2","","","","- C72 H65 N3 O4 -","- C72 H65 N3 O4 -","- C144 H130 N6 O8 -","2","1","","Sigurd Höger; Donald L. Morrison; Volker Enkelmann","Solvent Triggering between Conformational States in Amphiphilic Shape-Persistent Macrocycles","Journal of the American Chemical Society","2002","124","","6734","6736","10.1021/ja017628+","","","1.5418","CuKα","","","0.0618","","","0.0715","","","","","1.0458","1.0458","","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114838","17.6104","0.001","9.2651","0.0005","22.0135","0.001","88.493","0.002","92.791","0.002","82.969","0.002","3558.6","0.3","165","","","","","","","","","","Local laboratory","3","P -1","-P 1","2","","","","- C81 H98 O10 -","- C82.5 H50 O9.667 -","- C165 H100 O19.334 -","2","1","","Sigurd Höger; Donald L. Morrison; Volker Enkelmann","Solvent Triggering between Conformational States in Amphiphilic Shape-Persistent Macrocycles","Journal of the American Chemical Society","2002","124","","6734","6736","10.1021/ja017628+","","","1.5418","CuKα","","","0.0531","","","0.0653","0.0631","","","","","","0.872","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114839","5.683","0.0002","11.138","0.0003","15.2124","0.0006","90","","95.0784","0.0013","90","","959.12","0.06","200","1","200","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0583","0.038","","","0.0878","0.0972","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114840","7.4427","0.0002","8.8081","0.0002","17.2876","0.0005","93.6327","0.0009","90.9294","0.001","94.3935","0.0008","1127.45","0.05","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 Ag N5 O5 -","- C24 H20 Ag N5 O5 -","- C48 H40 Ag2 N10 O10 -","2","1","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0472","0.0323","","","0.0658","0.0707","","","","","","1.046","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114841","17.692","0.0003","10.2177","0.0002","15.1922","0.0003","90","","115.401","0.0012","90","","2480.82","0.08","200","1","200","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 N4 O6 Zn -","- C28 H26 N4 O6 Zn -","- C112 H104 N16 O24 Zn4 -","4","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0541","0.0388","","","0.0921","0.099","","","","","","1.025","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114842","8.0203","0.0002","8.7561","0.0003","9.8058","0.0003","76.776","0.002","75.4011","0.0018","83.5565","0.0014","647.63","0.03","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","","","- C28 H26 Cu N4 O6 -","- C28 H26 Cu N4 O6 -","- C28 H26 Cu N4 O6 -","1","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0804","0.0459","","","0.0861","0.0957","","","","","","1.046","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114843","15.8579","0.0004","5.4924","0.0001","16.0201","0.0005","90","","110.486","0.0011","90","","1307.08","0.06","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Co N4 O8 -","- C28 H30 Co N4 O8 -","- C56 H60 Co2 N8 O16 -","2","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.047","0.0321","","","0.0753","0.0818","","","","","","1.03","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114844","19.8901","0.0003","12.3626","0.0003","15.0476","0.0003","90","","113.957","0.0015","90","","3381.35","0.12","200","1","200","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 N4 O10 Zn2 -","- C32 H32 N4 O10 Zn2 -","- C128 H128 N16 O40 Zn8 -","4","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.081","0.0389","","","0.0816","0.0958","","","","","","1.003","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114845","7.4471","0.0002","12.6393","0.0002","14.7616","0.0004","90","","97.8869","0.0014","90","","1376.31","0.06","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 Co N6 O10 -","- C26 H28 Co N6 O10 -","- C52 H56 Co2 N12 O20 -","2","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0498","0.0337","","","0.0748","0.0819","","","","","","1.042","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114846","7.438","0.0002","12.6144","0.0005","14.7117","0.0005","90","","97.618","0.002","90","","1368.16","0.08","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N6 Ni O10 -","- C26 H28 N6 Ni O10 -","- C52 H56 N12 Ni2 O20 -","2","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0571","0.0362","","","0.0778","0.0865","","","","","","1.031","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114847","7.4389","0.0003","12.6873","0.0002","14.7479","0.0005","90","","97.9708","0.0012","90","","1378.45","0.08","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N6 O10 Zn -","- C26 H28 N6 O10 Zn -","- C52 H56 N12 O20 Zn2 -","2","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0499","0.0334","","","0.0764","0.0835","","","","","","1.039","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114848","7.4848","0.0002","9.1264","0.0003","10.0961","0.0003","75.442","0.0016","73.0274","0.0014","82.5842","0.0012","637.28","0.03","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 Mn N6 O10 -","- C24 H24 Mn N6 O10 -","- C24 H24 Mn N6 O10 -","1","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.0446","0.0329","","","0.0761","0.0815","","","","","","1.033","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114849","7.4425","0.0003","12.6362","0.0005","14.7425","0.0008","90","","97.8068","0.0017","90","","1373.61","0.11","200","1","200","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 Co0.5 N6 Ni0.5 O10 -","- C26 H28 Co0.484 N6 Ni0.484 O10 -","- C52 H56 Co0.968 N12 Ni0.968 O20 -","2","0.5","","Juan C. Noveron; Myoung Soo Lah; Rico E. Del Sesto; Atta M. Arif; Joel S. Miller; Peter J. Stang","Engineering the Structure and Magnetic Properties of Crystalline Solids via the Metal-Directed Self-Assembly of a Versatile Molecular Building Unit","Journal of the American Chemical Society","2002","124","","6613","6625","10.1021/ja0200241","","","0.71073","MoKα","","0.1046","0.0481","","","0.0789","0.0918","","","","","","1.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114850","17.1447","0.0015","4.553","0.0005","19.4408","0.0015","90","","103.212","0.005","90","","1477.4","0.2","295","1","295","1","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- B12 Co2 Na2 O21 -","- B12 Co2 Na2 O21 -","- B48 Co8 Na8 O84 -","4","0.5","","Jesse L. C. Rowsell; Nicholas J. Taylor; Linda F. Nazar","Structure and Ion Exchange Properties of a New Cobalt Borate with a Tunnel Structure ""Templated"" by Na+","Journal of the American Chemical Society","2002","124","","6522","6523","10.1021/ja020106p","","","0.71073","MoKα","","0.0399","0.0265","","","0.0503","0.0515","","","","","","1.223","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114851","17.4296","0.0007","4.5518","0.0002","19.5893","0.0008","90","","103.91","0.001","90","","1508.56","0.11","295","1","295","1","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- B12 Co2 H4 Li2 O23 -","- B12 Co2 Li2 O23 -","- B48 Co8 Li8 O92 -","4","0.5","","Jesse L. C. Rowsell; Nicholas J. Taylor; Linda F. Nazar","Structure and Ion Exchange Properties of a New Cobalt Borate with a Tunnel Structure ""Templated"" by Na+","Journal of the American Chemical Society","2002","124","","6522","6523","10.1021/ja020106p","","","0.71073","MoKα","","0.049","0.042","","","0.0887","0.09","","","","","","1.904","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114852","13.532","0.0016","5.6217","0.0008","21.626","0.003","90","","95.168","0.009","90","","1638.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 Ag F5 N -","- C19 H11 Ag F5 N -","- C76 H44 Ag4 F20 N4 -","4","1","","Antonio Codina; Eduardo J. Fernández; Peter G. Jones; Antonio Laguna; José M. López-de-Luzuriaga; Miguel Monge; M. Elena Olmos; Javier Pérez; Miguel A. Rodríguez","Do Aurophilic Interactions Compete against Hydrogen Bonds? Experimental Evidence and Rationalization Based on ab Initio Calculations","Journal of the American Chemical Society","2002","124","","6781","6786","10.1021/ja025765g","","","0.71073","MoKα","","0.0233","0.0187","","","0.0464","0.0476","","","","","","1.032","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114853","13.678","0.0004","7.6814","0.0003","17.4676","0.0005","90","","109.807","0.0019","90","","1726.68","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 Au F5 N -","- C19 H11 Au F5 N -","- C76 H44 Au4 F20 N4 -","4","1","","Antonio Codina; Eduardo J. Fernández; Peter G. Jones; Antonio Laguna; José M. López-de-Luzuriaga; Miguel Monge; M. Elena Olmos; Javier Pérez; Miguel A. Rodríguez","Do Aurophilic Interactions Compete against Hydrogen Bonds? Experimental Evidence and Rationalization Based on ab Initio Calculations","Journal of the American Chemical Society","2002","124","","6781","6786","10.1021/ja025765g","","","0.7107","MoKα","","0.0487","0.0339","","","0.08","0.0865","","","","","","1.084","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114854","22.543","0.005","6.776","0.0014","28.608","0.006","90","","90","","90","","4369.9","1.6","301","2","301","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C20 H12 F3 N3 O3 Pt S -","- C20 H12 F3 N3 O3 Pt S -","- C160 H96 F24 N24 O24 Pt8 S8 -","8","1","","Vivian Wing-Wah Yam; Keith Man-Chung Wong; Nianyong Zhu","Solvent-Induced Aggregation through Metal...Metal/π...π Interactions: Large Solvatochromism of Luminescent Organoplatinum(II) Terpyridyl Complexes","Journal of the American Chemical Society","2002","124","","6506","6507","10.1021/ja025811c","","","0.71073","MoKα","","0.1239","0.0596","","","0.1805","0.2144","","","","","","0.948","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114855","19.847","0.004","14.801","0.003","6.867","0.0014","90","","94.35","0.03","90","","2011.4","0.7","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C20 H12 F3 N3 O3 Pt S -","- C20 H12 F3 N3 O3 Pt S -","- C80 H48 F12 N12 O12 Pt4 S4 -","4","1","","Vivian Wing-Wah Yam; Keith Man-Chung Wong; Nianyong Zhu","Solvent-Induced Aggregation through Metal...Metal/π...π Interactions: Large Solvatochromism of Luminescent Organoplatinum(II) Terpyridyl Complexes","Journal of the American Chemical Society","2002","124","","6506","6507","10.1021/ja025811c","","","0.71073","MoKα","","0.1067","0.0896","","","0.2463","0.2597","","","","","","1.07","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114856","10.04","0.002","14.759","0.003","15.488","0.003","72.86","0.03","75.94","0.03","72.7","0.03","2063.3","0.8","301","2","301","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H48 F3 N3 O5 Pt S -","- C38 H48 F3 N3 O5 Pt S -","- C76 H96 F6 N6 O10 Pt2 S2 -","2","1","","Vivian Wing-Wah Yam; Keith Man-Chung Wong; Nianyong Zhu","Solvent-Induced Aggregation through Metal...Metal/π...π Interactions: Large Solvatochromism of Luminescent Organoplatinum(II) Terpyridyl Complexes","Journal of the American Chemical Society","2002","124","","6506","6507","10.1021/ja025811c","","","0.71073","MoKα","","0.0609","0.0507","","","0.132","0.1432","","","","","","1.041","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114857","15.722","0.001","27.7418","0.0008","30.0706","0.0007","90","","90","","90","","13115.5","1","150.2","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C144 H166 B2 N4 O2 P4 Ru2 -","- C142 H122 B2 N4 O2 P4 Ru2 -","- C568 H488 B8 N16 O8 P16 Ru8 -","4","1","","Takeshi Ohkuma; Masatoshi Koizumi; Kilian Muñiz; Gerhard Hilt; Chizuko Kabuto; Ryoji Noyori","trans-RuH(η1-BH4)(binap)(1,2-diamine): A Catalyst for Asymmetric Hydrogenation of Simple Ketones under Base-Free Conditions","Journal of the American Chemical Society","2002","124","","6508","6509","10.1021/ja026136+","","","0.7107","MoKα","","","0.0483","","","","0.0559","","","","","","0.819","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114858","7.2867","0.0002","12.3688","0.0004","19.2042","0.0005","90","","90","","90","","1730.83","0.09","122.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H23 N O2 S -","- C19 H23 N O2 S -","- C76 H92 N4 O8 S4 -","4","1","","Takuya Kochi; Tony P. Tang; Jonathan A. Ellman","Asymmetric Synthesis of syn- and anti-1,3-Amino Alcohols","Journal of the American Chemical Society","2002","124","","6518","6519","10.1021/ja026292g","","","0.7107","MoKα","","","0.0319","","","","0.0373","","","","","","1.3","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114859","5.8532","0.0008","11.64","0.002","26.638","0.003","90","","90","","90","","1814.9","0.4","133.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H24 N O3 S -","- C19 H25 N O2 S -","- C76 H100 N4 O8 S4 -","4","1","","Takuya Kochi; Tony P. Tang; Jonathan A. Ellman","Asymmetric Synthesis of syn- and anti-1,3-Amino Alcohols","Journal of the American Chemical Society","2002","124","","6518","6519","10.1021/ja026292g","","","0.7107","MoKα","","","0.0504","","","","0.0469","","","","","","1.173","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114860","9.8881","0.0002","10.8511","0.0002","12.9294","0.0003","108.128","0.0007","90.8731","0.0007","103.525","0.0011","1276.03","0.05","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H33 F2 N O2 S Si -","- C23 H33 F2 N O2 S Si -","- C46 H66 F4 N2 O4 S2 Si2 -","2","1","","Qilong Shen; Gerald B. Hammond","Regiospecific Synthesis of Bicyclo- and Heterobicyclo-gem-difluorocyclobutenes Using Functionalized Fluoroallenes and a Novel Mo-Catalyzed Intramolecular [2 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2002","124","","6534","6535","10.1021/ja0263893","","","0.71073","MoKα","","0.0841","0.0512","","","0.1236","0.1417","","","","","","1.026","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114861","9.2413","0.0001","11.398","0.0001","14.1375","0.0002","98.7602","0.0005","108.931","0.0006","105.847","0.0006","1306.7","0.03","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H35 F2 N O2 S Si -","- C24 H35 F2 N O2 S Si -","- C48 H70 F4 N2 O4 S2 Si2 -","2","1","","Qilong Shen; Gerald B. Hammond","Regiospecific Synthesis of Bicyclo- and Heterobicyclo-gem-difluorocyclobutenes Using Functionalized Fluoroallenes and a Novel Mo-Catalyzed Intramolecular [2 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2002","124","","6534","6535","10.1021/ja0263893","","","0.71073","MoKα","","0.0581","0.0493","","","0.1344","0.1429","","","","","","1.05","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114862","8.0586","0.0001","16.9207","0.0003","17.8474","0.0003","90","","90","","90","","2433.62","0.07","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C23 H33 F2 N O2 S Si -","- C23 H33 F2 N O2 S Si -","- C92 H132 F8 N4 O8 S4 Si4 -","4","1","","Qilong Shen; Gerald B. Hammond","Regiospecific Synthesis of Bicyclo- and Heterobicyclo-gem-difluorocyclobutenes Using Functionalized Fluoroallenes and a Novel Mo-Catalyzed Intramolecular [2 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2002","124","","6534","6535","10.1021/ja0263893","","","0.71073","MoKα","","0.0499","0.0379","","","0.0835","0.0893","","","","","","1.026","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114863","8.276","0.0001","17.1805","0.0003","18.292","0.0003","90","","90","","90","","2600.86","0.07","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C24 H35 F2 N O2 S Si -","- C24 H35 F2 N O2 S Si -","- C96 H140 F8 N4 O8 S4 Si4 -","4","1","","Qilong Shen; Gerald B. Hammond","Regiospecific Synthesis of Bicyclo- and Heterobicyclo-gem-difluorocyclobutenes Using Functionalized Fluoroallenes and a Novel Mo-Catalyzed Intramolecular [2 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2002","124","","6534","6535","10.1021/ja0263893","","","0.71073","MoKα","","0.0534","0.0435","","","0.1099","0.118","","","","","","1.056","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114864","8.168","0.0001","28.4033","0.0005","11.9889","0.0002","90","","99.5929","0.0007","90","","2742.51","0.07","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H39 F2 N O2 S Si -","- C26 H39 F2 N O2 S Si -","- C104 H156 F8 N4 O8 S4 Si4 -","4","1","","Qilong Shen; Gerald B. Hammond","Regiospecific Synthesis of Bicyclo- and Heterobicyclo-gem-difluorocyclobutenes Using Functionalized Fluoroallenes and a Novel Mo-Catalyzed Intramolecular [2 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2002","124","","6534","6535","10.1021/ja0263893","","","0.71073","MoKα","","0.0616","0.0436","","","0.1098","0.1199","","","","","","1.022","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114865","16.305","0.003","17.315","0.004","18.344","0.004","90","","90","","90","","5178.9","1.9","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C29 H36 P Rh -","- C29 H36 P Rh -","- C232 H288 P8 Rh8 -","8","1","","Helmut Werner; Ralf Wiedemann; Matthias Laubender; Bettina Windmüller; Paul Steinert; Olaf Gevert; Justin Wolf","Unusual Pathways for Metal-Assisted C-C and C-P Coupling Reactions Using Allenylidenerhodium Complexes as Precursors","Journal of the American Chemical Society","2002","124","","6966","6980","10.1021/ja012479g","","","0.71073","MoKα","","0.1597","0.0523","","","0.117","0.1483","","","","","","0.986","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114866","9.463","0.004","11.369","0.005","17.936","0.009","92","0.03","97.9","0.02","108.25","0.02","1808.9","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33.5 H52 Cl4 P2 Rh -","- C33.5 H52 Cl4 P2 Rh -","- C67 H104 Cl8 P4 Rh2 -","2","1","","Helmut Werner; Ralf Wiedemann; Matthias Laubender; Bettina Windmüller; Paul Steinert; Olaf Gevert; Justin Wolf","Unusual Pathways for Metal-Assisted C-C and C-P Coupling Reactions Using Allenylidenerhodium Complexes as Precursors","Journal of the American Chemical Society","2002","124","","6966","6980","10.1021/ja012479g","","","0.7093","","","0.0481","0.0317","","0.0858","0.0791","","","","1.057","1.068","1.068","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114867","9.4521","0.0002","12.6281","0.0002","17.1232","0.0004","107.122","0.0011","94.5036","0.001","95.8229","0.0008","1930.53","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H54 N O3 P -","- C42 H54 N O3 P -","- C84 H108 N2 O6 P2 -","2","1","","Natalya V. Timosheva; A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Conversion of Tricoordinate to Hexacoordinate Phosphorus. Formation of a Phosphorane-Phosphatrane System1","Journal of the American Chemical Society","2002","124","","7035","7040","10.1021/ja012579m","","","0.71073","MoKα","","0.0705","0.0474","","","0.1092","0.1229","","","","","","1.02","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114868","13.4625","0.0002","22.5793","0.0004","13.7246","0.0003","90","","106.137","0.0008","90","","4007.54","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H64 N O4 P -","- C42 H64 N O4 P -","- C168 H256 N4 O16 P4 -","4","1","","Natalya V. Timosheva; A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Conversion of Tricoordinate to Hexacoordinate Phosphorus. Formation of a Phosphorane-Phosphatrane System1","Journal of the American Chemical Society","2002","124","","7035","7040","10.1021/ja012579m","","","0.71073","MoKα","","0.0798","0.0553","","","0.1323","0.145","","","","","","1.055","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114869","11.3043","0.0001","14.7072","0.0002","19.1561","0.0003","90","","105.111","0.0005","90","","3074.67","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H40 N O5 P -","- C33 H40 N O5 P -","- C132 H160 N4 O20 P4 -","4","1","","Natalya V. Timosheva; A. Chandrasekaran; Roberta O. Day; Robert R. Holmes","Conversion of Tricoordinate to Hexacoordinate Phosphorus. Formation of a Phosphorane-Phosphatrane System1","Journal of the American Chemical Society","2002","124","","7035","7040","10.1021/ja012579m","","","0.71073","MoKα","","0.0704","0.0529","","","0.1417","0.157","","","","","","1.025","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114870","16.68","0.003","11.185","0.002","18.324","0.004","90","","110.38","0.03","90","","3204.6","1.2","175","2","175","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C12 H4 Ag Al F24 O4 P4 S3 -","- C12 H4 Ag Al F24 O4 P4 S3 -","- C48 H16 Ag4 Al4 F96 O16 P16 S12 -","4","1","","Ariane Adolf; Marcin Gonsior; Ingo Krossing","Extending the Coordination Chemistry of Molecular P4S3: The Polymeric Ag(P4S3)+ and Ag(P4S3)2+ Cations","Journal of the American Chemical Society","2002","124","","7111","7116","10.1021/ja012760v","","","0.71073","MoKα","","0.064","0.0504","","","0.1363","0.1444","","","","","","1.033","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114871","16.3639","0.0014","10.9494","0.0005","26.47","0.002","90","","94.578","0.01","90","","4727.6","0.6","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C17 Ag Al F36 O4 P8 S8 -","- C17 Ag Al F36 O4 P8 S8 -","- C68 Ag4 Al4 F144 O16 P32 S32 -","4","1","","Ariane Adolf; Marcin Gonsior; Ingo Krossing","Extending the Coordination Chemistry of Molecular P4S3: The Polymeric Ag(P4S3)+ and Ag(P4S3)2+ Cations","Journal of the American Chemical Society","2002","124","","7111","7116","10.1021/ja012760v","","","0.71073","MoKα","","0.0518","0.0435","","","0.113","0.1175","","","","","","1.058","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114872","23.508","0.003","12.133","0.0014","31.393","0.004","90","","109.602","0.002","90","","8435.1","1.8","168","2","168","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(Sn3(THME)2)5 * (hexane)solvent","","","- C56 H100 O30 Sn15 -","- C28 H50 O15 Sn7.5 -","- C224 H400 O120 Sn60 -","8","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0573","0.0349","","","0.0727","0.0784","","","","","","0.907","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114873","21.4033","0.0014","24.3825","0.0015","24.4347","0.0015","90","","90","","90","","12751.6","1.4","168","2","168","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Sn3(THME)2","","","- C10 H18 O6 Sn3 -","- C10 H18 O6 Sn3 -","- C320 H576 O192 Sn96 -","32","8","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0695","0.0433","","","0.0752","0.0801","","","","","","1.274","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114874","12.3788","0.0019","22.642","0.003","25.337","0.004","90","","90","","90","","7101.5","1.8","168","2","168","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","[Sn(THME)2]2 . (THF)solvent","","","- C12 H22 O6.5 Sn3 -","- C10 H18 O6 Sn3 -","- C160 H288 O96 Sn48 -","16","2","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0306","0.0205","","","0.0438","0.0466","","","","","","1.036","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114875","22.278","0.004","10.0634","0.0016","23.648","0.004","90","","90","","90","","5301.7","1.6","168","2","168","2","","","","","","","","5","P n m a","-P 2ac 2n","62","[Sn(THME)2]3 * (Py)solvent","","","- C35 H59 N O18 Sn9 -","- C30 H57 O18 Sn9 -","- C120 H228 O72 Sn36 -","4","0.5","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0322","0.0234","","","0.0538","0.057","","","","","","1.103","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114876","30.379","0.004","10.4956","0.0015","12.414","0.0018","90","","113.638","0.002","90","","3626.1","0.9","168","2","168","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[Sn3(THME)2]2 * (Diox)slovent","","","- C24 H44 O14 Sn6 -","- C20 H36 O12 Sn6 -","- C80 H144 O48 Sn24 -","4","0.5","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0207","0.0178","","","0.0434","0.0443","","","","","","1.041","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114877","6.834","0.003","17.68","0.007","15.981","0.006","90","","101.05","0.005","90","","1895.1","1.3","168","2","168","2","","","","","","","","6","P 1 21 1","P 2yb","4","Sn4(THME)2[N(Si2)(CH3)6]2","","","- C22 H54 N2 O6 Si4 Sn4 -","- C22 H54 N2 O6 Si4 Sn4 -","- C44 H108 N4 O12 Si8 Sn8 -","2","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0454","0.0413","","","0.0975","0.1016","","","","","","1.032","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114878","14.226","0.003","9.178","0.0018","15.553","0.003","90","","95.867","0.003","90","","2020.1","0.7","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Sn(THME)2(OMe)2","","","- C12 H24 O8 Sn4 -","- C12 H24 O8 Sn4 -","- C48 H96 O32 Sn16 -","4","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0298","0.0232","","","0.0533","0.0554","","","","","","0.999","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114879","8.845","0.003","10.63","0.003","12.957","0.004","98.746","0.005","101.834","0.005","106.563","0.005","1113.7","0.6","168","2","168","2","","","","","","","","4","P -1","-P 1","2","Sn4(THME)2(OEt)2","","","- C14 H28 O8 Sn4 -","- C14 H28 O8 Sn4 -","- C28 H56 O16 Sn8 -","2","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0398","0.0336","","","0.0849","0.0949","","","","","","0.519","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114880","15.051","0.002","12.1069","0.0018","15.607","0.002","90","","92.027","0.003","90","","2842.1","0.7","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Sn4(THME)2[OBu(OMe)]2","","","- C20 H40 O8 Sn4 -","- C20 H40 O8 Sn4 -","- C80 H160 O32 Sn16 -","4","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0312","0.0267","","","0.0606","0.0625","","","","","","1.052","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114881","11.0984","0.0016","11.9361","0.0017","12.1199","0.0017","109.963","0.002","100.248","0.002","99.461","0.002","1440.3","0.4","168","2","168","2","","","","","","","","4","P -1","-P 1","2","[Sn2(THME)2(ONep)2]2","","","- C20 H40 O8 Sn4 -","- C20 H40 O8 Sn4 -","- C40 H80 O16 Sn8 -","2","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0437","0.0319","","","0.0812","0.0886","","","","","","1.04","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114882","22.209","0.006","8.843","0.002","29.053","0.008","90","","90","","90","","5706","3","168","2","168","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Sn4(THME)2(mMP)2","","","- C24 H32 O8 Sn4 -","- C24 H32 O8 Sn4 -","- C192 H256 O64 Sn32 -","8","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0477","0.0316","","","0.0666","0.0706","","","","","","0.983","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114883","20.967","0.004","8.9897","0.0015","29.726","0.005","90","","90","","90","","5603","1.7","168","2","168","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Sn4(THME)2(OMP)2","","","- C24 H32 O8 Sn4 -","- C24 H32 O8 Sn4 -","- C192 H256 O64 Sn32 -","8","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0576","0.0356","","","0.0653","0.0699","","","","","","1.028","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114884","19.446","0.0014","8.3861","0.0006","18.4826","0.0013","90","","92.69","0.001","90","","3010.7","0.4","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Sn4(THME)2(DMP)2'","","","- C26 H36 O8 Sn4 -","- C26 H36 O8 Sn4 -","- C104 H144 O32 Sn16 -","4","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0681","0.0331","","","0.0576","0.0647","","","","","","0.89","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114885","16.066","0.004","17.328","0.004","28.081","0.006","90","","90","","90","","7818","3","168","2","168","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Sn4(THME)2(DIP)2","","","- C34 H52 O8 Sn4 -","- C34 H52 O8 Sn4 -","- C272 H416 O64 Sn32 -","8","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.0909","0.0384","","","0.0593","0.0683","","","","","","0.825","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114886","17.174","0.01","18.681","0.011","13.09","0.007","90","","106.92","0.01","90","","4018","4","168","2","168","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Sn3Ti(THME)2(ONep)4","","","- C30 H62 O10 Sn3 Ti -","- C30 H62 O10 Sn3 Ti -","- C120 H248 O40 Sn12 Ti4 -","4","1","","Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana","Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters","Journal of the American Chemical Society","2002","124","","6904","6913","10.1021/ja0202309","","","0.71073","MoKα","","0.202","0.0765","","","0.1423","0.1758","","","","","","0.858","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114887","6.7055","0.0003","8.2104","0.0003","13.4884","0.0006","90","","101.287","0.002","90","","728.24","0.05","100","","100","","","","","","","","see paper","3","P 1 21 1","P 2yb","4","","","","- C15 H24 O4 -","- C15 H24 O4 -","- C30 H48 O8 -","2","1","","Alois Fürstner; Karin Radkowski; Conny Wirtz; Richard Goddard; Christian W. Lehmann; Richard Mynott","Total Syntheses of the Phytotoxic Lactones Herbarumin I and II and a Synthesis-Based Solution of the Pinolidoxin Puzzle","Journal of the American Chemical Society","2002","124","","7061","7069","10.1021/ja020238i","","","0.71073","MoKα","","0.11","0.0725","","","0.1666","0.1901","","","","","","1.024","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114888","9.4709","0.0006","9.4709","0.0006","33.6977","0.0016","90","","90","","90","","3022.6","0.3","100","","100","","","","","","","","see paper","4","P 41 21 2","P 4abw 2nw","92","Herbarumin II","2,7,8-trihydroxy-5-dodecen-9-olide","","- C12.5 H20.5 Cl1.5 O5 -","- C12.52 H13 Cl1.5 O5 -","- C100.16 H104 Cl12 O40 -","8","1","","Alois Fürstner; Karin Radkowski; Conny Wirtz; Richard Goddard; Christian W. Lehmann; Richard Mynott","Total Syntheses of the Phytotoxic Lactones Herbarumin I and II and a Synthesis-Based Solution of the Pinolidoxin Puzzle","Journal of the American Chemical Society","2002","124","","7061","7069","10.1021/ja020238i","","","0.71073","MoKα","","0.119","0.0888","","","0.1996","0.2176","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4114889","14.7888","0.0007","18.5968","0.001","6.7764","0.0003","90","","90","","90","","1863.68","0.16","100","","100","","","","","","","","see paper","3","P 21 21 2","P 2 2ab","18","","","","- C18 H27 O6.5 -","- C18 H27 O6.5 -","- C72 H108 O26 -","4","1","","Alois Fürstner; Karin Radkowski; Conny Wirtz; Richard Goddard; Christian W. Lehmann; Richard Mynott","Total Syntheses of the Phytotoxic Lactones Herbarumin I and II and a Synthesis-Based Solution of the Pinolidoxin Puzzle","Journal of the American Chemical Society","2002","124","","7061","7069","10.1021/ja020238i","","","0.71073","MoKα","","0.1422","0.0777","","","0.1627","0.194","","","","","","1.094","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114890","11.7691","0.0002","5.7168","0.0001","18.3157","0.0002","90","","108.209","0.001","90","","1170.6","0.03","100","","100","","","","","","","","see paper","4","P 1 21 1","P 2yb","4","","(2R,3S,4S)-2,3-((1-methylethylidene)-dioxy)-1,4-O-p-bromobenzoyloxy-heptane","","- C24 H26 Br2 O6 -","- C24 H26 Br2 O6 -","- C48 H52 Br4 O12 -","2","1","","Alois Fürstner; Karin Radkowski; Conny Wirtz; Richard Goddard; Christian W. Lehmann; Richard Mynott","Total Syntheses of the Phytotoxic Lactones Herbarumin I and II and a Synthesis-Based Solution of the Pinolidoxin Puzzle","Journal of the American Chemical Society","2002","124","","7061","7069","10.1021/ja020238i","","","0.71073","MoKα","","0.0426","0.0377","","","0.0979","0.1071","","","","","","1.123","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114891","8.795","0.0004","26.016","0.0014","11.617","0.0006","90","","102.853","0.003","90","","2591.5","0.2","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","compound 2-d27","","","- C29 H13 D27 N2 Pt -","- C29 H40 N2 Pt -","- C116 H160 N8 Pt4 -","4","1","","Ulrich Fekl; Karen I. Goldberg","Five-Coordinate Platinum(IV) Complex as a Precursor to a Novel Pt(II) Olefin Hydride Complex for Alkane Activation","Journal of the American Chemical Society","2002","124","","6804","6805","10.1021/ja0258677","","","0.7107","MoKα","","0.1186","0.0421","","","0.0636","0.0781","","","","","","0.716","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114892","18.4873","0.001","10.9402","0.0007","20.2958","0.001","90","","90","","90","","4104.9","0.4","103","2","103","2","","","","","","","","4","P n a 21","P 2c -2n","33","germabenzene","","","- C32 H64 Ge Si6 -","- C32 H64 Ge Si6 -","- C128 H256 Ge4 Si24 -","4","1","","Norio Nakata; Nobuhiro Takeda; Norihiro Tokitoh","Synthesis and Properties of the First Stable Germabenzene","Journal of the American Chemical Society","2002","124","","6914","6920","10.1021/ja0262941","","","0.7107","MoKα","","0.0236","0.0224","","","0.0556","0.0561","","","","","","1.092","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114893","8.9287","0.0005","9.9445","0.0005","12.401","0.0007","95.166","0.001","106.82","0.001","96.277","0.001","1039.07","0.1","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H26 O9 -","- C20 H26 O9 -","- C40 H52 O18 -","2","1","","Yoshihiko Yamamoto; Hideyuki Takagishi; Kenji Itoh","Ruthenium(II)-Catalyzed [2 + 2 + 2] Cycloaddition of 1,6-Diynes with Tricarbonyl Compounds","Journal of the American Chemical Society","2002","124","","6844","6845","10.1021/ja0264100","","","0.71073","MoKα","","0.0625","0.0557","","","0.1765","0.1911","","","","","","0.811","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114894","8.1787","0.0005","11.8767","0.0007","13.1547","0.0008","100.193","0.001","97.805","0.001","109.716","0.001","1157.24","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H21 Cl2 N O5 S -","- C24 H21 Cl2 N O5 S -","- C48 H42 Cl4 N2 O10 S2 -","2","1","","Yoshihiko Yamamoto; Hideyuki Takagishi; Kenji Itoh","Ruthenium(II)-Catalyzed [2 + 2 + 2] Cycloaddition of 1,6-Diynes with Tricarbonyl Compounds","Journal of the American Chemical Society","2002","124","","6844","6845","10.1021/ja0264100","","","0.71073","MoKα","","0.0615","0.0502","","","0.1491","0.1644","","","","","","0.702","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4114895","11.21","0","7.938","0.001","11.76","0","90","","114.33","0","90","","953.52","0.12","273.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H20 Br N O3 -","- C20 H20 Br N O3 -","- C40 H40 Br2 N2 O6 -","2","1","","Barry M. Trost; Kalindi Dogra","Synthesis of Novel Quaternary Amino Acids Using Molybdenum-Catalyzed Asymmetric Allylic Alkylation","Journal of the American Chemical Society","2002","124","","7256","7257","10.1021/ja020290e","","","0.7107","MoKα","","","0.033","","","","0.082","","","","","","0.721","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114896","8.8043","0.0004","18.4412","0.0007","10.0523","0.0004","90","","99.256","0.004","90","","1610.86","0.12","73","2","73","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H24 B9 Br2 N -","- C4 H24 B9 Br2 N -","- C16 H96 B36 Br8 N4 -","4","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","1.54184","CuKα","","0.0476","0.0424","","","0.1118","0.1168","","","","","","1.042","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114897","7.717","0.0015","11.674","0.002","10.054","0.002","90","","95.09","0.03","90","","902.2","0.3","143","2","143","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- B9 H14 K -","- B9 H14 K -","- B36 H56 K4 -","4","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","0.71073","MoKα","","0.0444","0.0302","","","0.0632","0.0678","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114898","6.0434","0.0007","18.628","0.002","12.6874","0.0015","90","","92.062","0.002","90","","1427.4","0.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H16 B9 P -","- C6 H16 B9 P -","- C24 H64 B36 P4 -","4","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","0.6942","","","0.0457","0.04","","","0.1031","0.1075","","","","","","1.11","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114899","9.5057","0.0001","12.8371","0.0002","20.9018","0.0003","90","","90","","90","","2550.56","0.06","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C4 H24 B9 N -","- C4 H24 B9 N -","- C32 H192 B72 N8 -","8","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","0.71073","MoKα","","0.0451","0.0387","","","0.1059","0.1124","","","","","","1.063","","","","has coordinates","178919","2020-10-21","18:00:00",""
"4114900","5.7787","0.0004","10.1992","0.0007","10.4677","0.0008","87.154","0.002","76.907","0.002","84.296","0.002","597.7","0.07","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C5 H18 B9 N -","- C5 H18 B9 N -","- C10 H36 B18 N2 -","2","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","1.54184","CuKα","","0.0518","0.0412","","","0.1107","0.1169","","","","","","1.054","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114901","10.1178","0.0003","5.6413","0.0001","24.525","0.0008","90","","90","","90","","1399.83","0.07","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H22 B9 N -","- C7 H22 B9 N -","- C28 H88 B36 N4 -","4","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","0.71073","MoKα","","0.0505","0.0395","","","0.088","0.093","","","","","","1.049","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114902","5.6183","0.0011","9.0867","0.0018","9.844","0.002","90","","90.41","0.03","90","","502.54","0.17","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C2 H16 B9 N -","- C2 H16 B9 N -","- C4 H32 B18 N2 -","2","1","","Jonathan Bould; Robert Greatrex; John D. Kennedy; Daniel L. Ormsby; Michael G. S. Londesborough; Karen L. F. Callaghan; Mark Thornton-Pett; Trevor R. Spalding; Simon J. Teat; William Clegg; Hong Fang; Nigam P. Rath; Lawrence Barton","Structural Chemistry of arachno-Nonaboranes","Journal of the American Chemical Society","2002","124","","7429","7439","10.1021/ja025700d","","","0.71073","MoKα","","0.0651","0.0432","","","0.0983","0.1118","","","","","","1.062","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114903","15.958","0.006","6.429","0.003","16.963","0.004","90","","113.83","0.02","90","","1591.9","1.1","296.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 O2 -","- C18 H24 O2 -","- C72 H96 O8 -","4","1","","Makoto Yasuda; Shoki Tsuji; Yusuke Shigeyoshi; Akio Baba","Cross-Coupling Reaction of α-Chloroketones and Organotin Enolates Catalyzed by Zinc Halides for Synthesis of γ-Diketones","Journal of the American Chemical Society","2002","124","","7440","7447","10.1021/ja0258172","","","0.7107","MoKα","","","0.0669","","","","0.0586","","","","","","2.841","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114904","12.041","0.0002","18.204","0.0003","18.59","0.0003","90","","90","","90","","4074.82","0.12","110","2","110","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Ga-NO2-corrole","","","- C48 H18 F15 Ga N6 O2 -","- C48 H18 F15 Ga N6 O2 -","- C192 H72 F60 Ga4 N24 O8 -","4","1","","Irena Saltsman; Atif Mahammed; Israel Goldberg; Elena Tkachenko; Mark Botoshansky; Zeev Gross","Selective Substitution of Corroles: Nitration, Hydroformylation, and Chlorosulfonation","Journal of the American Chemical Society","2002","124","","7411","7420","10.1021/ja025851g","","","0.7107","MoKα","","0.0637","0.0459","","","0.1019","0.1127","","","","","","1.014","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114905","17.908","0.004","12.516","0.002","25.133","0.005","90","","122.65","0.002","90","","4743.1","1.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Ga-(NO2)2-corrole","","","- C47 H16 F15 Ga N9 Na O7 -","- C47 H16 F15 Ga N9 Na O7 -","- C188 H64 F60 Ga4 N36 Na4 O28 -","4","1","","Irena Saltsman; Atif Mahammed; Israel Goldberg; Elena Tkachenko; Mark Botoshansky; Zeev Gross","Selective Substitution of Corroles: Nitration, Hydroformylation, and Chlorosulfonation","Journal of the American Chemical Society","2002","124","","7411","7420","10.1021/ja025851g","","","0.7107","MoKα","","0.1579","0.0689","","","0.1524","0.1813","","","","","","0.894","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114906","11.399","0.0003","19.023","0.0004","22.761","0.0006","90","","104.564","0.0012","90","","4777","0.2","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Ga-(NO2)3-corrole","","","- C49 H24 Cl2 F15 Ga N8 O6 -","- C49.15 H10 Cl2 F15 Ga N8 O6 -","- C196.6 H40 Cl8 F60 Ga4 N32 O24 -","4","1","","Irena Saltsman; Atif Mahammed; Israel Goldberg; Elena Tkachenko; Mark Botoshansky; Zeev Gross","Selective Substitution of Corroles: Nitration, Hydroformylation, and Chlorosulfonation","Journal of the American Chemical Society","2002","124","","7411","7420","10.1021/ja025851g","","","0.7107","MoKα","","0.1601","0.1014","","","0.2706","0.312","","","","","","0.994","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114907","13.827","0.003","13.815","0.003","18.209","0.004","76.76","0.02","79.18","0.02","70.13","0.02","3161.2","1.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","Co-(SO2)2-corrole","","","- C71 H47 Co F15 N6 O4 P S2 -","- C71 H47 Co F15 N6 O4 P S2 -","- C142 H94 Co2 F30 N12 O8 P2 S4 -","2","1","","Irena Saltsman; Atif Mahammed; Israel Goldberg; Elena Tkachenko; Mark Botoshansky; Zeev Gross","Selective Substitution of Corroles: Nitration, Hydroformylation, and Chlorosulfonation","Journal of the American Chemical Society","2002","124","","7411","7420","10.1021/ja025851g","","","0.71073","MoKα","","0.1695","0.1046","","","0.2469","0.2698","","","","","","1.055","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114908","8.3195","0.0012","9.8962","0.0014","18.175","0.003","97.034","0.002","92.03","0.003","113.688","0.002","1354.1","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H24 Cl3 O8 P4 Rh -","- C19.994 H24 Cl3 O8 P4 Rh -","- C39.988 H48 Cl6 O16 P8 Rh2 -","2","1","","Kannan Raghuraman; Nagavarakishore Pillarsetty; Wynn A. Volkert; Charles Barnes; Silvia Jurisson; Kattesh V. Katti","Exceptional Kinetic Propensity of Hydroxymethyl Phosphanes toward Rh(III) Stabilization in Water","Journal of the American Chemical Society","2002","124","","7276","7277","10.1021/ja025987e","","","0.71073","MoKα","","0.0651","0.0586","","","0.166","0.169","","","","","","1.067","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114909","11.8195","0.0008","12.8382","0.0008","13.5007","0.0009","90","","90","","90","","2048.6","0.2","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H27 Cl3 O10 P3 Rh -","- C9 H18 Cl3 O10 P3 Rh -","- C36 H72 Cl12 O40 P12 Rh4 -","4","1","","Kannan Raghuraman; Nagavarakishore Pillarsetty; Wynn A. Volkert; Charles Barnes; Silvia Jurisson; Kattesh V. Katti","Exceptional Kinetic Propensity of Hydroxymethyl Phosphanes toward Rh(III) Stabilization in Water","Journal of the American Chemical Society","2002","124","","7276","7277","10.1021/ja025987e","","","0.71073","MoKα","","0.0741","0.0503","","","0.1154","0.1248","","","","","","1.025","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114910","15.4936","0.0017","8.2673","0.0009","13.1465","0.0015","90","","90","","90","","1683.9","0.3","293","2","293","2","","","","","","","","5","P b c 21","P 2c -2b","29","","","","- H3.2 K2 O18.6 Si6 V2 -","- K2 O18.693 Si6 V2 -","- K8 O74.772 Si24 V8 -","4","1","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1101","0.0458","","","0.0768","0.0898","","","","","","0.846","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114911","15.614","0.009","8.36","0.005","13.142","0.008","90","","90","","90","","1715.5","1.8","293","2","293","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- H3.2 O18.6 Rb2 Si6 V2 -","- O18.6 Rb2 Si6 V2 -","- O74.4 Rb8 Si24 V8 -","4","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1454","0.0781","","","0.1709","0.1975","","","","","","0.933","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114912","13.392","0.0018","13.392","0.0018","21.568","0.004","90","","90","","120","","3349.9","0.9","293","2","293","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- Cs2 H5.4 O13.7 Si4 V -","- Cs1.996 O13.7013 Si4 V -","- Cs17.964 O123.312 Si36 V9 -","9","0.25","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1448","0.0501","","","0.0687","0.0847","","","","","","0.879","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114913","13.2878","0.0008","13.2878","0.0008","21.256","0.002","90","","90","","120","","3250.3","0.4","293","2","293","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- H6 O14 Rb2 Si4 V -","- O13.8833 Rb1.996 Si4.004 V -","- O124.95 Rb17.964 Si36.036 V9 -","9","0.25","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1475","0.1109","","","0.3551","0.3725","","","","","","1.113","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114914","13.11","0.015","13.11","0.015","14.35","0.02","90","","90","","120","","2136","5","293","2","293","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","","","- Cs1.33 H4.8 K0.67 O13.4 Si4 V -","- Cs1.33 K0.67 O12.8933 Si4 V -","- Cs7.98 K4.02 O77.36 Si24 V6 -","6","1","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1788","0.142","","","0.3276","0.3474","","","","","","2.424","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114915","13.1698","0.0006","13.1698","0.0006","14.5054","0.0008","90","","90","","120","","2178.81","0.18","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- H6 O14 Rb2 Si4 V -","- O11.7367 Rb2 Si4 V -","- O70.42 Rb12 Si24 V6 -","6","0.25","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.0938","0.0791","","","0.2442","0.2581","","","","","","1.099","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114916","13.5674","0.0019","13.5674","0.0019","21.855","0.004","90","","90","","120","","3484","0.9","293","2","293","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- Cs H6 Na O14 Si4 V -","- Cs1.00233 Na O12.5867 Si4 V -","- Cs9.021 Na9 O113.28 Si36 V9 -","9","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.084","0.0754","","","0.2225","0.2283","","","","","","1.174","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114917","18.2124","0.0007","18.2124","0.0007","45.752","0.002","90","","90","","120","","13142.4","0.9","293","2","293","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- H5.6 Na O13.8 Rb Si4 V -","- Na O13.7765 Rb1.00067 Si4 V -","- Na36 O495.954 Rb36.024 Si144 V36 -","36","1","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1513","0.1222","","","0.2948","0.3121","","","","","","1.24","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114918","12.689","0.003","14.915","0.003","6.9835","0.0014","90","","90","","90","","1321.7","0.5","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Cs2 H2 O12 Si4 V -","- Cs2.013 O12.176 Si4 V -","- Cs8.052 O48.704 Si16 V4 -","4","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1314","0.1131","","","0.2378","0.2443","","","","","","1.261","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114919","12.859","0.003","14.911","0.004","7.078","0.002","90","","90","","90","","1357.1","0.6","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- H5.5 Li2 O13.75 Si4 V -","- Li1.99 O13.8 Si4 V -","- Li7.96 O55.2 Si16 V4 -","4","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.2733","0.0868","","","0.209","0.2708","","","","","","0.879","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114920","14.408","0.009","9.129","0.006","10.452","0.007","90","","90","","90","","1374.8","1.5","293","2","293","2","","","","","","","","5","I m m a","-I 2b 2","74","","","","- H6.3 Na2 O14.15 Si4 V -","- Na2 O14.16 Si4 V -","- Na8 O56.64 Si16 V4 -","4","0.25","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1325","0.0594","","","0.1036","0.1256","","","","","","0.891","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114921","27.544","0.004","8.69","0.0014","10.0607","0.0016","90","","109.581","0.003","90","","2268.8","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H2.8 Na2 O12.4 Si4 V -","- Na2 O12.4 Si4 V -","- Na16 O99.2 Si32 V8 -","8","1","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.192","0.058","","","0.103","0.1329","","","","","","0.821","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114922","13.967","0.001","15.928","0.001","30.332","0.001","92.3","0.01","100.89","0.01","103.46","0.01","6419.3","0.8","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C420 H128 Cl12 Co2 Cr4 N16 -","- C420 H128 Cl12 Co2 Cr4 N16 -","- C420 H128 Cl12 Co2 Cr4 N16 -","1","0.5","","Dmitry V. Konarev; Salavat S. Khasanov; Akihiro Otsuka; Yukihiro Yoshida; Gunzi Saito","Synthesis and Crystal Structure of Ionic Multicomponent Complex: {[CrI(PhH)2].+}2[CoIITPP(C60(CN)2)]-[C60(CN)2].-.3(o-C6H4Cl2) Containing C60(CN)2.- Radical Anion and σ-Bonded Diamagnetic CoIITPP(C60(CN)2)- Anion","Journal of the American Chemical Society","2002","124","","7648","7649","10.1021/ja0203667","","","0.71073","MoKα","","0.0841","0.0666","","","0.1707","0.1882","","","","","","1.024","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114923","8.5157","0.0019","9.547","0.002","14.467","0.003","77.315","0.004","76.469","0.004","72.97","0.004","1078.8","0.4","100","2","100","2","","","","","","","","2","P -1","-P 1","2","","","","- C60 H46 -","- C60 H46 -","- C60 H46 -","1","0.5","","Zaira Dominguez; Hung Dang; M. Jane Strouse; Miguel A. Garcia-Garibay","Molecular ""Compasses"" and ""Gyroscopes."" III. Dynamics of a Phenylene Rotor and Clathrated Benzene in a Slipping-Gear Crystal Lattice","Journal of the American Chemical Society","2002","124","","7719","7727","10.1021/ja025753v","","","0.71073","MoKα","","0.0732","0.0409","","","0.0793","0.0885","","","","","","0.892","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114924","9.15","0.0014","10.3067","0.0016","10.5004","0.0017","61.736","0.003","85.731","0.003","72.477","0.003","829","0.2","100","2","100","2","","","","","","","","2","P -1","-P 1","2","","","","- C48 H34 -","- C48 H34 -","- C48 H34 -","1","0.5","","Zaira Dominguez; Hung Dang; M. Jane Strouse; Miguel A. Garcia-Garibay","Molecular ""Compasses"" and ""Gyroscopes."" III. Dynamics of a Phenylene Rotor and Clathrated Benzene in a Slipping-Gear Crystal Lattice","Journal of the American Chemical Society","2002","124","","7719","7727","10.1021/ja025753v","","","0.71073","MoKα","","0.0525","0.0395","","","0.1072","0.1149","","","","","","1.093","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114925","16.5688","0.0013","13.229","0.0018","17.8632","0.0017","90","","90","","90","","3915.4","0.7","223","2","223","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C5 H16 Al B11 Cl6 -","- C5 H16 Al B11 Cl6 -","- C40 H128 Al8 B88 Cl48 -","8","1","","Kee-Chan Kim; Christopher A. Reed; Gregory S. Long; Ayusman Sen","Et2Al+ Alumenium Ion-like Chemistry. Synthesis and Reactivity toward Alkenes and Alkene Oxides","Journal of the American Chemical Society","2002","124","","7662","7663","10.1021/ja0259990","","","0.71073","MoKα","","0.0432","0.0333","","","0.0906","0.097","","","","","","1.012","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114926","8.0441","0.001","14.6679","0.0018","17.537","0.002","90","","90","","90","","2069.2","0.4","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C5 H16 Al B11 Br6 -","- C5 H16 Al B11 Br6 -","- C20 H64 Al4 B44 Br24 -","4","1","","Kee-Chan Kim; Christopher A. Reed; Gregory S. Long; Ayusman Sen","Et2Al+ Alumenium Ion-like Chemistry. Synthesis and Reactivity toward Alkenes and Alkene Oxides","Journal of the American Chemical Society","2002","124","","7662","7663","10.1021/ja0259990","","","0.71073","MoKα","","0.0331","0.0287","","","0.0623","0.0631","","","","","","1.01","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114927","20.2143","0.0016","13.86","0.0011","24.184","0.002","90","","100.803","0.002","90","","6655.6","0.9","223","2","223","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C18 H29 Al B11 Br6 N2 -","- C18 H29 Al B11 Br6 N2 -","- C144 H232 Al8 B88 Br48 N16 -","8","1","","Kee-Chan Kim; Christopher A. Reed; Gregory S. Long; Ayusman Sen","Et2Al+ Alumenium Ion-like Chemistry. Synthesis and Reactivity toward Alkenes and Alkene Oxides","Journal of the American Chemical Society","2002","124","","7662","7663","10.1021/ja0259990","","","0.71073","MoKα","","0.0484","0.0306","","","0.0551","0.0569","","","","","","1.018","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114928","8.957","0.003","26.048","0.008","11.715","0.004","90","","97.026","0.005","90","","2712.7","1.5","183","2","183","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C46 H61 I N3 O2 U -","- C46 H61 I N3 O2 U -","- C92 H122 I2 N6 O4 U2 -","2","1","","Paula L. Diaconescu; Christopher C. Cummins","Diuranium Inverted Sandwiches Involving Naphthalene and Cyclooctatetraene","Journal of the American Chemical Society","2002","124","","7660","7661","10.1021/ja026200n","","","0.71073","MoKα","","0.0613","0.058","","","0.1674","0.1705","","","","","","1.084","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114929","12.82","0.003","29.511","0.007","25.647","0.006","90","","99.737","0.004","90","","9563","4","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C98 H138 K2 N6 O U2 -","- C98 H138 K2 N6 O U2 -","- C392 H552 K8 N24 O4 U8 -","4","1","","Paula L. Diaconescu; Christopher C. Cummins","Diuranium Inverted Sandwiches Involving Naphthalene and Cyclooctatetraene","Journal of the American Chemical Society","2002","124","","7660","7661","10.1021/ja026200n","","","0.71073","MoKα","","0.0648","0.0437","","","0.1068","0.1211","","","","","","1.052","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114930","11.4758","0.001","23.639","0.002","19.4963","0.0018","90","","102.527","0.002","90","","5163","0.8","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H69 N3 Na O U -","- C54 H69 N3 Na O U -","- C216 H276 N12 Na4 O4 U4 -","4","1","","Paula L. Diaconescu; Christopher C. Cummins","Diuranium Inverted Sandwiches Involving Naphthalene and Cyclooctatetraene","Journal of the American Chemical Society","2002","124","","7660","7661","10.1021/ja026200n","","","0.71073","MoKα","","0.047","0.0352","","","0.0878","0.0927","","","","","","1.053","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114931","13.8845","0.001","22.2016","0.0016","14.6531","0.0011","90","","104.03","0.001","90","","4382.2","0.6","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H63 N3 U -","- C46 H63 N3 U -","- C184 H252 N12 U4 -","4","1","","Paula L. Diaconescu; Christopher C. Cummins","Diuranium Inverted Sandwiches Involving Naphthalene and Cyclooctatetraene","Journal of the American Chemical Society","2002","124","","7660","7661","10.1021/ja026200n","","","0.71073","MoKα","","0.0301","0.0242","","","0.058","0.0608","","","","","","1.049","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114932","14.2312","0.0004","14.2312","0.0004","28.1433","0.001","90","","90","","120","","4936.2","0.3","293","2","293","2","","","","","","","","8","P -3 1 c","-P 3 2c","163","","","","- C72 H126 Cl3 K Mn Mo6 N36 O12 -","- C72 H126 Cl3 K Mn Mo6 N36 O12.04 -","- C144 H252 Cl6 K2 Mn2 Mo12 N72 O24.08 -","2","0.166667","","Jennifer J. Sokol; Allan G. Hee; Jeffrey R. Long","A Cyano-Bridged Single-Molecule Magnet: Slow Magnetic Relaxation in a Trigonal Prismatic MnMo6(CN)18 Cluster","Journal of the American Chemical Society","2002","124","","7656","7657","10.1021/ja0263846","","","0.71073","MoKα","","0.0718","0.0514","","0.1375","0.128","","","","1.066","1.172","1.172","","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114933","9.416","0.002","9.416","0.002","51.331","0.014","90","","90","","90","","4551.1","1.8","213","2","213","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C25 H33 N O4 -","- C25 H33 N O4 -","- C200 H264 N8 O32 -","8","1","","Thorsten Bach; Hermann Bergmann; Benjamin Grosch; Klaus Harms","Highly Enantioselective Intra- and Intermolecular [2 + 2] Photocycloaddition Reactions of 2-Quinolones Mediated by a Chiral Lactam Host: Host-Guest Interactions, Product Configuration, and the Origin of the Stereoselectivity in Solution","Journal of the American Chemical Society","2002","124","","7982","7990","10.1021/ja0122288","","","1.54178","CuKα","","0.0933","0.0628","","","0.1625","0.1863","","","","","","1.035","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114934","7.665","0.001","11.644","0.001","12.606","0.001","98.57","0.01","105.09","0.01","97.31","0.01","1057.8","0.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H33 N O3 Si -","- C21 H33 N O3 Si -","- C42 H66 N2 O6 Si2 -","2","1","","Thorsten Bach; Hermann Bergmann; Benjamin Grosch; Klaus Harms","Highly Enantioselective Intra- and Intermolecular [2 + 2] Photocycloaddition Reactions of 2-Quinolones Mediated by a Chiral Lactam Host: Host-Guest Interactions, Product Configuration, and the Origin of the Stereoselectivity in Solution","Journal of the American Chemical Society","2002","124","","7982","7990","10.1021/ja0122288","","","1.54178","CuKα","","0.0906","0.0628","","","0.1558","0.1756","","","","","","1.039","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114935","13.8946","0.0006","15.149","0.0009","17.4672","0.001","75.587","0.002","67.113","0.003","70.637","0.003","3165","0.3","200","2","200","2","","","","","","","chemical synthesis","3","P -1","-P 1","2","","1:2:1 2,3,5,6,7,8-hexaphenyl-1,4-di(o-tolyl)naphthalene : 1,2,3,8,9,10- hexaphenyldibenzo[fg,op]naphthacene : dichloromethane complex","","- C181 H122 Cl2 -","- C181 H115.044 Cl2 -","- C181 H115.044 Cl2 -","1","0.5","","Jun Lu; Jiajia Zhang; Xianfeng Shen; Douglas M. Ho; Robert A. Pascal","Octaphenylbiphenylene and Dodecaphenyltriptycene","Journal of the American Chemical Society","2002","124","","8035","8041","10.1021/ja0203723","","","0.71073","MoKα","","0.147","0.0973","","0.2352","0.2081","","","","1.087","1.21","1.21","","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114936","18.6482","0.0005","24.2381","0.0008","10.5573","0.0003","90","","90","","90","","4771.9","0.2","200","2","200","2","","","","","","","chemical synthesis","3","P b c n","-P 2n 2ab","60","","Octaphenylbiphenylene","","- C62 H44 Cl4 -","- C62 H44 Cl4 -","- C248 H176 Cl16 -","4","0.5","","Jun Lu; Jiajia Zhang; Xianfeng Shen; Douglas M. Ho; Robert A. Pascal","Octaphenylbiphenylene and Dodecaphenyltriptycene","Journal of the American Chemical Society","2002","124","","8035","8041","10.1021/ja0203723","","","0.71073","MoKα","","0.1038","0.0626","","0.1803","0.1531","","","","1.018","1.085","1.085","","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114937","19.2738","0.0004","28.5548","0.0005","32.331","0.0005","90","","125.485","0.0008","90","","14488.9","0.5","200","2","200","2","","","","","","","chemical synthesis","3","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,5,6,7,8,13,14,15,16-Dodecaphenyltriptycene","","- C93 H64 Cl2 -","- C93 H64 Cl2 -","- C744 H512 Cl16 -","8","2","","Jun Lu; Jiajia Zhang; Xianfeng Shen; Douglas M. Ho; Robert A. Pascal","Octaphenylbiphenylene and Dodecaphenyltriptycene","Journal of the American Chemical Society","2002","124","","8035","8041","10.1021/ja0203723","","","0.71073","MoKα","","0.1119","0.0753","","0.2266","0.2071","","","","1.036","1.172","1.172","","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114938","24.1553","0.0015","17.016","0.0012","26.221","0.002","90","","90","","90","","10777.5","1.3","200","2","200","2","","","","","","","chemical synthesis","2","P n a 21","P 2c -2n","33","","1,2,3,4,5,6,7,8,13,14,15,16-Dodecaphenyltriptycene Benzene Clathrate","","- C146 H116 -","- C146 H116 -","- C584 H464 -","4","1","","Jun Lu; Jiajia Zhang; Xianfeng Shen; Douglas M. Ho; Robert A. Pascal","Octaphenylbiphenylene and Dodecaphenyltriptycene","Journal of the American Chemical Society","2002","124","","8035","8041","10.1021/ja0203723","","","0.71073","MoKα","","0.0993","0.0602","","0.139","0.1182","","","","1.058","1.114","1.114","","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114939","25.566","0.008","11.361","0.003","9.734","0.002","89.99","0.02","89.95","0.02","90.01","0.02","2827.3","1.3","298.1","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H13 F O -","- C21.7143 H14.8571 F1.14286 O1.14286 -","- C152 H104 F8 O8 -","7","0.875","","Yoshiaki Nishibayashi; Youichi Inada; Masanobu Hidai; Sakae Uemura","Ruthenium-Catalyzed Cycloaddition of Propargylic Alcohols with Phenol Derivatives via Allenylidene Intermediates: Catalytic Use of the Allenylidene Ligand as the C3 Unit","Journal of the American Chemical Society","2002","124","","7900","7901","10.1021/ja026168x","","","0.7107","MoKα","","","0.043","","","","0.031","","","","","","2.336","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114940","11.2616","0.0004","5.7722","0.0001","20.9491","0.0003","90","","94.707","0.003","90","","1357.19","0.06","296.1","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 O3 -","- C17 H16 O3 -","- C68 H64 O12 -","4","1","","Yoshiaki Nishibayashi; Youichi Inada; Masanobu Hidai; Sakae Uemura","Ruthenium-Catalyzed Cycloaddition of Propargylic Alcohols with Phenol Derivatives via Allenylidene Intermediates: Catalytic Use of the Allenylidene Ligand as the C3 Unit","Journal of the American Chemical Society","2002","124","","7900","7901","10.1021/ja026168x","","","0.7107","MoKα","","","0.037","","","","0.036","","","","","","1.577","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114941","8.6796","0.0011","12.275","0.0016","19.378","0.003","81.824","0.002","85.027","0.002","75.882","0.002","1979","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H33.17 N11.5 O6.34 Ru -","- C43 H31 N11.5 O6.34 Ru -","- C86 H62 N23 O12.68 Ru2 -","2","1","","Yuan-Qing Fang; Nicholas J. Taylor; Garry S. Hanan; Frédérique Loiseau; Rosalba Passalacqua; Sebastiano Campagna; Hélène Nierengarten; Alain Van Dorsselaer","A Strategy for Improving the Room-Temperature Luminescence Properties of Ru(II) Complexes with Tridentate Ligands","Journal of the American Chemical Society","2002","124","","7912","7913","10.1021/ja0261776","","","0.71073","MoKα","","0.0995","0.083","","","0.1456","0.1485","","","","","","1.889","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114942","29.963","0.004","16.29","0.01","17.264","0.004","90","","115.82","0.01","90","","7585","5","258.2","","258.2","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C32 H26 Cl2 F10 N2 O2 Si2 Ti -","- C32 H26 Cl2 F10 N2 O2 Si2 Ti -","- C256 H208 Cl16 F80 N16 O16 Si16 Ti8 -","8","1","","Makoto Mitani; Rieko Furuyama; Jun-ichi Mohri; Junji Saito; Seiichi Ishii; Hiroshi Terao; Norio Kashiwa; Terunori Fujita","Fluorine- and Trimethylsilyl-Containing Phenoxy-Imine Ti Complex for Highly Syndiotactic Living Polypropylenes with Extremely High Melting Temperatures","Journal of the American Chemical Society","2002","124","","7888","7889","10.1021/ja026229r","","","0.7107","MoKα","","0.0401","0.0401","","","0.0978","0.0978","","","","","","1.302","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114943","10.994","0.003","11.951","0.004","13.757","0.004","90","","90","","90","","1807.5","0.9","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H22 N2 O4 -","- C19 H22 N2 O4 -","- C76 H88 N8 O16 -","4","1","","Phil S. Baran; E. J. Corey","A Short Synthetic Route to (+)-Austamide, (+)-Deoxyisoaustamide, and (+)-Hydratoaustamide from a Common Precursor by a Novel Palladium-Mediated Indole →Dihydroindoloazocine Cyclization","Journal of the American Chemical Society","2002","124","","7904","7905","10.1021/ja026663t","","","0.71073","MoKα","","0.1497","0.0557","","","0.0689","0.085","","","","","","0.857","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114944","19.216","0.004","16.339","0.003","20.751","0.005","90","0.02","114.05","0.02","90","0.02","5950","2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C48 H58 Ag3 N11 O10 Si4 -","- C48 H56 Ag3 N11 O9.75 Si4 -","- C192 H224 Ag12 N44 O39 Si16 -","4","2","","Ok-Sang Jung; Yun Ju Kim; Kwan Mook Kim; Young-A Lee","A 20-Å-Thick Interwoven Sheet Consisting of Nanotubes","Journal of the American Chemical Society","2002","124","","7906","7907","10.1021/ja026774s","","","0.71073","MoKα","","0.052","0.0492","","","0.1258","0.1289","","","","","","0.996","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114945","16.1489","0.001","11.4856","0.0007","24.025","0.0015","90","","90","","90","","4456.2","0.5","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C45 H40 F8 N8 O12 -","- C45 H40 F8 N8 O12 -","- C180 H160 F32 N32 O48 -","4","1","","Arindam Chakraborty; Anxin Wu; Dariusz Witt; Jason Lagona; James C. Fettinger; Lyle Isaacs","Diastereoselective Formation of Glycoluril Dimers: Isomerization Mechanism and Implications for Cucurbit[n]uril Synthesis","Journal of the American Chemical Society","2002","124","","8297","8306","10.1021/ja025876f","","","0.71073","MoKα","","0.0451","0.0342","","","0.084","0.0917","","","","","","1.044","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114946","16.1151","0.0011","15.887","0.002","26.0621","0.0007","90","","92.813","0.0004","90","","6664.4","1","180.2","","180.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H84 N6 Nb2 P4 Si8 -","- C48 H84 N6 Nb2 P4 Si8 -","- C192 H336 N24 Nb8 P16 Si32 -","4","1","","Michael D. Fryzuk; Christopher M. Kozak; Michael R. Bowdridge; Brian O. Patrick; Steven J. Rettig","Nitride Formation by Thermolysis of a Kinetically Stable Niobium Dinitrogen Complex","Journal of the American Chemical Society","2002","124","","8389","8397","10.1021/ja025997f","","","0.7107","MoKα","","0.1142","0.073","","0.1242","","0.1242","","","2.586","","","2.586","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114947","14.5273","0.0012","13.4604","0.0009","33.633","0.003","90","","99.36","0.004","90","","6489.1","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H42 N3 Nb P2 Si4 -","- C24 H41.727 N3 Nb P2 Si4 -","- C192 H333.816 N24 Nb8 P16 Si32 -","8","2","","Michael D. Fryzuk; Christopher M. Kozak; Michael R. Bowdridge; Brian O. Patrick; Steven J. Rettig","Nitride Formation by Thermolysis of a Kinetically Stable Niobium Dinitrogen Complex","Journal of the American Chemical Society","2002","124","","8389","8397","10.1021/ja025997f","","","0.71069","MoKα","","0.1007","0.0606","","","0.1409","0.1538","","","","","","1.007","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114948","15.8295","0.0006","12.521","0.0004","19.466","0.001","90","","90","","90","","3858.2","0.3","198.2","","198.2","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C32 H48 N2 Nb P2 Si4 -","- C32 H48 N2 Nb P2 Si4 -","- C128 H192 N8 Nb4 P8 Si16 -","4","1","","Michael D. Fryzuk; Christopher M. Kozak; Michael R. Bowdridge; Brian O. Patrick; Steven J. Rettig","Nitride Formation by Thermolysis of a Kinetically Stable Niobium Dinitrogen Complex","Journal of the American Chemical Society","2002","124","","8389","8397","10.1021/ja025997f","","","0.7107","MoKα","","0.048","0.027","","0.0702","","0.0702","","","0.826","","","0.826","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114949","9.9298","0.0001","12.9553","0.0001","20.4921","0.0003","85.1981","0.0004","88.5163","0.0004","72.341","0.0004","2503.14","0.05","200","","","","","","","","","","Local laboratory","7","P -1","-P 1","2","","","","- C58.5 H58 B Br Ni O2 P2 -","- C58.5 H58 B Br Ni O2 P2 -","- C117 H116 B2 Br2 Ni2 O4 P4 -","2","1","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.71073","MoKα","","","0.0286","","","","0.0318","","","","","","1.0706","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114950","20.3184","0.0003","22.7581","0.0004","10.587","0.0001","90","","90","","90","","4895.52","0.12","200","","200","","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C48 H82 B Br O2 P2 Pd -","- C48 H82 B Br O2 P2 Pd -","- C192 H328 B4 Br4 O8 P8 Pd4 -","4","0.5","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.7107","MoKα","","0.064","0.049","","0.086","","0.077","","","2.1","","","1.993","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4114951","8.7037","0.0001","12.4606","0.0001","36.1403","0.0004","90","","94.6632","0.0005","90","","3906.56","0.07","200","","200","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H64 B Br O2 P2 Pd -","- C38 H64 B Br O2 P2 Pd -","- C152 H256 B4 Br4 O8 P8 Pd4 -","4","1","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.7107","MoKα","","0.0844","0.0631","","0.1397","","0.1135","","","2.5846","","","2.2637","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114952","9.9982","0.0001","28.9827","0.0003","15.1034","0.0002","90","","96.1217","0.0005","90","","4351.63","0.09","200","","","","","","","","","","Local laboratory","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H76 Ni P2 -","- C48 H73.5976 Ni P2 -","- C192 H294.39 Ni4 P8 -","4","1","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.71073","MoKα","","","0.0403","","","","0.0452","","","","","","1.0867","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114953","10.1512","0.0001","29.5301","0.0003","15.077","0.0002","90","","97.1577","0.0006","90","","4484.35","0.09","200","","200","","","","","","","","?","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H76 P2 Pd -","- C48 H76 P2 Pd -","- C192 H304 P8 Pd4 -","4","1","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.71073","MoKα","","","0.063","","","","0.035","","","","","","0.8962","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114954","13.9055","0.0002","19.0192","0.0002","24.0778","0.0003","80.6763","0.0005","85.7074","0.0004","89.8127","0.0006","6265.88","0.14","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C65 H108 P4 Pd2 -","- C65 H108 P4 Pd2 -","- C260 H432 P16 Pd8 -","4","2","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.7107","MoKα","","0.1276","0.0667","","0.1412","","0.1029","","","2.1163","","","1.8672","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114955","11.7245","0.0004","18.1595","0.0008","14.7765","0.0006","90","","99.223","0.002","90","","3105.4","0.2","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H32 P2 Pd -","- C38 H32 P2 Pd -","- C152 H128 P8 Pd4 -","4","1","","Mikael Retbøll; Alison J. Edwards; A. David Rae; Anthony C. Willis; Martin A. Bennett; Eric Wenger","Preparation of Benzyne Complexes of Group 10 Metals by Intramolecular Suzuki Coupling of ortho-Metalated Phenylboronic Esters: Molecular Structure of the First Benzyne-Palladium(0) Complex","Journal of the American Chemical Society","2002","124","","8348","8360","10.1021/ja0264091","","","0.7107","MoKα","","0.1119","0.0531","","0.0788","","0.0634","","","2.017","","","1.979","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114956","12.663","0.003","19.441","0.004","13.35","0.003","90","","117.49","0.03","90","","2915.4","1.4","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H44 Ge N2 S -","- C30 H44 Ge N2 S -","- C120 H176 Ge4 N8 S4 -","4","1","","Yuqiang Ding; Qingjun Ma; Isabel Usón; Herbert W. Roesky; Mathias Noltemeyer; Hans-Georg Schmidt","Synthesis and Structures of [{HC(CMeNAr)2}Ge(S)X] (Ar = 2,6-iPr2C6H3, X = F, Cl, Me): Structurally Characterized Examples with a Formal Double Bond between Group 14 and 16 Elements Bearing a Halide","Journal of the American Chemical Society","2002","124","","8542","8543","10.1021/ja017645z","","","0.71073","MoKα","","0.0448","0.0373","","","0.0975","0.1032","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114957","16.88","0.003","13.044","0.003","13.801","0.003","90","","108.57","0.03","90","","2880.5","1.2","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 Cl Ge N2 S -","- C29 H41 Cl Ge N2 S -","- C116 H164 Cl4 Ge4 N8 S4 -","4","1","","Yuqiang Ding; Qingjun Ma; Isabel Usón; Herbert W. Roesky; Mathias Noltemeyer; Hans-Georg Schmidt","Synthesis and Structures of [{HC(CMeNAr)2}Ge(S)X] (Ar = 2,6-iPr2C6H3, X = F, Cl, Me): Structurally Characterized Examples with a Formal Double Bond between Group 14 and 16 Elements Bearing a Halide","Journal of the American Chemical Society","2002","124","","8542","8543","10.1021/ja017645z","","","0.71073","MoKα","","0.0369","0.0312","","","0.0699","0.0721","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114958","13.467","0.002","16.804","0.003","15.668","0.003","90","","92.783","0.016","90","","3541.5","1.1","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H49 F Ge N2 S -","- C36 H49 F Ge N2 S -","- C144 H196 F4 Ge4 N8 S4 -","4","1","","Yuqiang Ding; Qingjun Ma; Isabel Usón; Herbert W. Roesky; Mathias Noltemeyer; Hans-Georg Schmidt","Synthesis and Structures of [{HC(CMeNAr)2}Ge(S)X] (Ar = 2,6-iPr2C6H3, X = F, Cl, Me): Structurally Characterized Examples with a Formal Double Bond between Group 14 and 16 Elements Bearing a Halide","Journal of the American Chemical Society","2002","124","","8542","8543","10.1021/ja017645z","","","0.71073","MoKα","","0.0551","0.0469","","","0.1239","0.1318","","","","","","1.024","","","","has coordinates","189828","2020-10-21","18:00:00",""
"4114959","22.793","0.001","20.785","0.001","24.747","0.001","90","","106.387","0.003","90","","11247.7","0.9","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C368 H152 Cl16 Cr4 -","- C368 H152 Cl16 Cr4 -","- C736 H304 Cl32 Cr8 -","2","1","","Dmitri V. Konarev; Salavat S. Khasanov; Akihiro Otsuka; Gunzi Saito","The Reversible Formation of a Single-Bonded (C60-)2 Dimer in Ionic Charge Transfer Complex: Cp*2Cr.C60(C6H4Cl2)2. The Molecular Structure of (C60-)2","Journal of the American Chemical Society","2002","124","","8520","8521","10.1021/ja0202614","","","0.71073","MoKα","","0.0812","0.0508","","","0.1239","0.1469","","","","","","1.015","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114960","8.165","0.002","16.293","0.002","17.512","0.003","90","","90","","90","","2329.7","0.8","198","2","198","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H36 N2 O4 -","- C25 H36 N2 O4 -","- C100 H144 N8 O16 -","4","1","","John M. Humphrey; Yusheng Liao; Amjad Ali; Tobias Rein; Yue-Ling Wong; Hui-Ju Chen; Anne K. Courtney; Stephen F. Martin","Enantioselective Total Syntheses of Manzamine A and Related Alkaloids","Journal of the American Chemical Society","2002","124","","8584","8592","10.1021/ja0202964","","","0.71073","MoKα","","0.1819","0.0699","","0.1469","0.1039","","","","1","1.094","1.094","","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114961","17.598","0.002","8.93","0.001","13.646","0.002","90","","101.92","0.01","90","","2098.2","0.5","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20.3 H30.3 I N2 O0.3 -","- C20.3 I N2 O0.3 -","- C81.2 I4 N8 O1.2 -","4","1","","John M. Humphrey; Yusheng Liao; Amjad Ali; Tobias Rein; Yue-Ling Wong; Hui-Ju Chen; Anne K. Courtney; Stephen F. Martin","Enantioselective Total Syntheses of Manzamine A and Related Alkaloids","Journal of the American Chemical Society","2002","124","","8584","8592","10.1021/ja0202964","","","0.71073","MoKα","","0.108","0.0938","","","0.126","0.152","","","","","","2.62","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114962","9.908","0.004","10.763","0.004","38.02","0.02","90","","90","","90","","4054","3","183","2","183","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H31.6 I N2 O1.3 -","- C21 I N2 O1.3 -","- C168 I8 N16 O10.4 -","8","1","","John M. Humphrey; Yusheng Liao; Amjad Ali; Tobias Rein; Yue-Ling Wong; Hui-Ju Chen; Anne K. Courtney; Stephen F. Martin","Enantioselective Total Syntheses of Manzamine A and Related Alkaloids","Journal of the American Chemical Society","2002","124","","8584","8592","10.1021/ja0202964","","","0.71073","MoKα","","","0.0486","","","0.0513","","","","","","","1.428","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114963","17.2489","0.0005","17.2489","0.0005","24.0303","0.0008","90","","90","","90","","7149.6","0.4","150","2","150","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C72 H88 F N5 O8 -","- C72 H88 F N5 O8 -","- C288 H352 F4 N20 O32 -","4","0.25","","Christopher J. Woods; Salvatore Camiolo; Mark E. Light; Simon J. Coles; Michael B. Hursthouse; Michael A. King; Philip A. Gale; Jonathan W. Essex","Fluoride-Selective Binding in a New Deep Cavity Calix[4]pyrrole: Experiment and Theory","Journal of the American Chemical Society","2002","124","","8644","8652","10.1021/ja025572t","","","0.71073","MoKα","","0.1244","0.1126","","","0.3421","0.3517","","","","","","1.503","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114964","11.3723","0.0016","11.3723","0.0016","21.02","0.004","90","","90","","90","","2718.5","0.7","150","2","150","2","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C62 H61 N7 O8 -","- C62 H61 N7 O8 -","- C124 H122 N14 O16 -","2","0.25","","Christopher J. Woods; Salvatore Camiolo; Mark E. Light; Simon J. Coles; Michael B. Hursthouse; Michael A. King; Philip A. Gale; Jonathan W. Essex","Fluoride-Selective Binding in a New Deep Cavity Calix[4]pyrrole: Experiment and Theory","Journal of the American Chemical Society","2002","124","","8644","8652","10.1021/ja025572t","","","0.71073","MoKα","","0.099","0.0518","","","0.1258","0.1511","","","","","","1.018","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114965","10.9651","0.0004","15.8166","0.0005","27.5663","0.0009","90","","95.869","0.001","90","","4755.8","0.3","158.2","","158.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C51.5 H59 F3 N2 O3 S Ta -","- C53 H59 F3 N2 O3 S Ta -","- C212 H236 F12 N8 O12 S4 Ta4 -","4","1","","John Gavenonis; T. Don Tilley","Reversible Intramolecular Hydride Transfer between Tantalum and an Aromatic Ring: An η5-Cyclohexadienyl Complex as a Masked Hydride","Journal of the American Chemical Society","2002","124","","8536","8537","10.1021/ja025684k","","","0.7107","MoKα","","0.0714","0.0343","","0.0455","0.0357","0.0357","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114966","15.794","0.0008","15.794","0.0008","15.1279","0.0012","90","","90","","90","","3773.7","0.4","183","2","183","2","","","","","","","","5","P 43","P 4cw","78","","","","- C15 H24 N2 O8 S -","- C15 H24 N2 O8 S -","- C120 H192 N16 O64 S8 -","8","2","","Peter Tremmel; Armin Geyer","An Oligomeric Ser-Pro Dipeptide Mimetic Assuming the Polyproline II Helix Conformation","Journal of the American Chemical Society","2002","124","","8548","8549","10.1021/ja026098u","","","0.71073","MoKα","","0.1468","0.0586","","","0.1033","0.1267","","","","","","1.009","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114967","10.3795","0.0001","12.4469","0.0001","29.6317","0.0002","90","","95.2206","0.0003","90","","3812.32","0.05","160","1","160","1","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R)-2-endo-[(3S)-3-tert-butoxycarbonylamino-5- (2:3,4:6-di-O-isopropyliden-α-D-glucopyranosylpentanoyl]-2- exo-trimethylsilyloxy-1,7,7-trimethylbicyclo[2.2.1]heptane","","- C35 H61 N O9 Si -","- C35 H61 N O9 Si -","- C140 H244 N4 O36 Si4 -","4","2","","Claudio Palomo; Mikel Oiarbide; Aitor Landa; M. Concepción González-Rego; Jesús M. García; Alberto González; José M. Odriozola; Manuel Martín-Pastor; Anthony Linden","Design and Synthesis of a Novel Class of Sugar-Peptide Hybrids: C-Linked Glyco β-Amino Acids through a Stereoselective ""Acetate"" Mannich Reaction as the Key Strategic Element","Journal of the American Chemical Society","2002","124","","8637","8643","10.1021/ja026250s","","","0.71073","MoKα","","0.0936","0.0419","","0.0367","0.032","0.032","","","1.299","","","1.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114968","20.648","0.004","15.622","0.002","16.294","0.003","90","","90","","90","","5255.8","1.6","91","2","91","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","(Dipp*In)2","","","- C60 H74 In2 -","- C120 H148 In4 -","- C240 H296 In8 -","2","0.25","","Robert J. Wright; Andrew D. Phillips; Ned J. Hardman; Philip P. Power","The ""Diindene"" ArInInAr (Ar = C6H3-2,6-Dipp2, Dipp = C6H3-2,6-Pri2). Dimeric versus Monomeric In(I) Aryls: para-Substituent Effects in Terphenyl Ligands","Journal of the American Chemical Society","2002","124","","8538","8539","10.1021/ja026285s","","","0.71073","MoKα","","0.0619","0.0463","","","0.1172","0.1251","","","","","","1.494","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114969","17.2344","0.0009","23.2126","0.0012","22.2382","0.0012","90","","102.738","0.004","90","","8677.6","0.8","91","2","91","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Dipp*InBArF","","","- C48 H37 B F15 In -","- C48 H37 B F15 In -","- C384 H296 B8 F120 In8 -","8","2","","Robert J. Wright; Andrew D. Phillips; Ned J. Hardman; Philip P. Power","The ""Diindene"" ArInInAr (Ar = C6H3-2,6-Dipp2, Dipp = C6H3-2,6-Pri2). Dimeric versus Monomeric In(I) Aryls: para-Substituent Effects in Terphenyl Ligands","Journal of the American Chemical Society","2002","124","","8538","8539","10.1021/ja026285s","","","0.71073","MoKα","","0.0686","0.0401","","","0.0796","0.0966","","","","","","1.058","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114970","12.7252","0.0011","20.684","0.002","21.7198","0.0018","90","","106.729","0.003","90","","5474.9","0.8","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","B*InBArF","","","- C61 H57 B F15 In -","- C61 H57 B F15 In -","- C244 H228 B4 F60 In4 -","4","1","","Robert J. Wright; Andrew D. Phillips; Ned J. Hardman; Philip P. Power","The ""Diindene"" ArInInAr (Ar = C6H3-2,6-Dipp2, Dipp = C6H3-2,6-Pri2). Dimeric versus Monomeric In(I) Aryls: para-Substituent Effects in Terphenyl Ligands","Journal of the American Chemical Society","2002","124","","8538","8539","10.1021/ja026285s","","","0.71073","MoKα","","0.0458","0.0338","","","0.0894","0.0984","","","","","","0.898","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114971","14.9505","0.0008","9.4316","0.0004","23.3019","0.0013","90","","96.38","0.02","90","","3265.4","0.3","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Rh6(CO)14(Ppy3)","","","- C26 H12 N3 O14 P Rh6 -","- C26 H12 N3 O14 P Rh6 -","- C104 H48 N12 O56 P4 Rh24 -","4","1","","Claudia Babij; C. Scott Browning; David H. Farrar; Igor O. Koshevoy; Ivan S. Podkorytov; Anthony J. Poë; Sergey P. Tunik","Tripyrrolylphosphine as a Unique Bridging Ligand in the Rh6(CO)14(μ2-P(NC4H4)3) Cluster: Structure, Bonding, Fluxionality, Thermodynamics, and Kinetics Studies","Journal of the American Chemical Society","2002","124","","8922","8931","10.1021/ja012440b","","","0.71073","MoKα","","0.0813","0.0495","","","0.1227","0.1312","","","","","","1.076","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114972","15.661","0.0012","17.337","0.0012","23.302","0.002","87.001","0.005","87.703","0.004","83.786","0.004","6277.3","0.8","120","","120","","","","","","","","","7","P -1","-P 1","2","","5-Iodo-2,4,6,8,9,10-hexakis(tri-tert-butylsilyl)heptacyclo-[4.4.0.0^1,3^.0^2,5^.0^3,9^.0^4,7^.0^8,10^]decagerman-7-yliumtetrakis(2,3,5,6-tetrafluorophenyl)borate","","- C103 H174 B F16 Ge10 I Si6 -","- C103 H174 B F16 Ge10 I Si6 -","- C206 H348 B2 F32 Ge20 I2 Si12 -","2","1","","Akira Sekiguchi; Yutaka Ishida; Yoshio Kabe; Masaaki Ichinohe","The Cation Cluster of Heavier Group 14 Elements: A Free Germyl Cation with Trishomoaromaticity","Journal of the American Chemical Society","2002","124","","8776","8777","10.1021/ja020395h","","","0.7107","MoKα","","0.1721","0.0839","","","0.1898","0.2377","","","","","","1.057","","","","has coordinates","211398","2020-10-21","18:00:00",""
"4114973","8.571","0.005","10.465","0.005","9.368","0.004","90","0","97.075","0.02","90","0","833.9","0.7","298","","","","","","","","","","Local laboratory","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O4 -","- C20 H18 O4 -","- C40 H36 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.71073","xray","","","0.0632","","","0.1106","","","","","2.723","2.723","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114974","8.0986","0.0001","5.4164","0.0003","13.8414","0.0005","90","","101.047","0.002","90","","595.91","0.04","203.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C10 H12 Cl2 O4 -","- C10 H12 Cl2 O4 -","- C20 H24 Cl4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.058","","","","0.126","","","","","","1.528","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114975","8.3045","0.0009","5.5002","0.0007","13.84","0.002","90","","95.622","0.008","90","","629.12","0.14","296.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C10 H12 Br2 O4 -","- C10 H12 Br2 O4 -","- C20 H24 Br4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.041","","","","0.071","","","","","","0.921","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114976","9.152","0.022","5.706","0.006","16.959","0.024","90","0","104.683","0.06","90","0","857","3","298","","","","","","","","","","Local laboratory","3","P 1 21 1","P 2yb","4","","","","- C20 H18 O4 -","- C20 H18 O4 -","- C40 H36 O8 -","2","1","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.71073","xray","","","0.0385","","","0.0402","","","","","1.06","1.06","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114977","5.766","0.002","8.861","0.01","32.978","0.018","90","0","90","0","90","0","1685","2","298","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H18 O4 -","- C20 H18 O4 -","- C80 H72 O16 -","4","1","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.71073","xray","","","0.0387","","","0.0393","","","","","1.673","1.673","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114978","6.015","0.004","8.415","0.005","18.08","0.005","90","","90.99","0.05","90","","915","0.9","243.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","- C40 H32 Cl4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.069","","","","0.104","","","","","","1.246","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114979","9.373","0.002","10.665","0.002","9.906","0.002","90","","112.54","0.02","90","","914.6","0.3","233.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","- C40 H32 Cl4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.042","","","","0.065","","","","","","0.821","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114980","23.593","0.003","5.6741","0.0008","16.123","0.002","90","","114.22","0.003","90","","1968.4","0.4","296.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Br2 O4 -","- C20 H16 Br2 O4 -","- C80 H64 Br8 O16 -","4","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.083","","","","0.142","","","","","","1.624","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114981","8.458","0.002","13.544","0.003","4.0436","0.0005","93.971","0.007","101.29","0.01","78.737","0.008","445.27","0.16","296.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","1","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.052","","","","0.091","","","","","","1.138","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114982","5.629","0.0057","5.122","0.0058","32.082","0.0248","90","0","93.712","0.001","90","0","923","1.6","298","","","","","","","","","","Local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","- C40 H32 Cl4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.71073","xray","","","0.0808","","","0.0795","","","","","1.763","1.763","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114983","5.6457","0.0002","5.0639","0.0003","31.685","0.002","90","","92.746","0.004","90","","904.81","0.08","296.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","- C40 H32 Cl4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.07","","","","0.162","","","","","","1.583","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114984","5.6796","0.0003","4.8631","0.0001","32.097","0.001","90","","90.185","0.002","90","","886.53","0.06","296.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Cl2 O4 -","- C20 H16 Cl2 O4 -","- C40 H32 Cl4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.066","","","","0.17","","","","","","1.698","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114985","11.459","0.005","4.112","0.006","18.704","0.005","90","","96.45","0.03","90","","875.7","1.4","296.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 F2 O4 -","- C20 H16 F2 O4 -","- C40 H32 F4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.05","","","","0.078","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114986","5.683","0.0126","5.206","0.0122","32.256","0.0726","90","0","92.95","0.001","90","0","953","4","298","","","","","","","","","","Local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Br2 O4 -","- C20 H16 Br2 O4 -","- C40 H32 Br4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.71073","xray","","","0.083","","","0.0935","","","","","4.038","4.038","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114987","8.049","0.001","5.6585","0.0006","21.477","0.003","90","","96.97","0.003","90","","970.9","0.2","296.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 Br2 O4 -","- C20 H16 Br2 O4 -","- C40 H32 Br4 O8 -","2","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.049","","","","0.091","","","","","","1.127","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114988","5.4658","0.0005","7.6205","0.0004","11.7151","0.0007","103.828","0.006","91.99","0.003","101.947","0.004","461.73","0.06","296.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 O4 -","- C22 H22 O4 -","- C22 H22 O4 -","1","0.5","","Akikazu Matsumoto; Toshihiro Tanaka; Takashi Tsubouchi; Kohji Tashiro; Seishi Saragai; Shinsuke Nakamoto","Crystal Engineering for Topochemical Polymerization of Muconic Esters Using Halogen-Halogen and CH/π Interactions as Weak Intermolecular Interactions","Journal of the American Chemical Society","2002","124","","8891","8902","10.1021/ja0205333","","","0.7107","MoKα","","","0.082","","","","0.13","","","","","","1.517","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114989","12.32","0.01","16.69","0.01","8.076","0.003","90.04","0.05","94.64","0.05","90.11","0.07","1655.1","1.8","298","","","","","","","","","","Local laboratory","3","P 1 21/a 1","-P 2yab","14","","","","- C21 H18 O2 -","- C21 H18 O2 -","- C84 H72 O8 -","4","1","","Ken Kokubo; Hiroshi Yamaguchi; Tatsuya Kawamoto; Takumi Oshima","Substituent Effects on the Stereochemistry in the [2 + 2] Photocycloaddition Reaction of Homobenzoquinone Derivative with Variously Substituted Alkenes and Alkynes","Journal of the American Chemical Society","2002","124","","8912","8921","10.1021/ja025593n","","","0.71073","MoK-alpha","","","0.054","","","0.057","","","","","1.215","1.215","","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114990","21.495","0.009","12.48","0.007","8.88","0.01","90","","92.5","0.06","90","","2380","3","298","","","","","","","","","","Local laboratory","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 O3 -","- C30 H28 O3 -","- C120 H112 O12 -","4","1","","Ken Kokubo; Hiroshi Yamaguchi; Tatsuya Kawamoto; Takumi Oshima","Substituent Effects on the Stereochemistry in the [2 + 2] Photocycloaddition Reaction of Homobenzoquinone Derivative with Variously Substituted Alkenes and Alkynes","Journal of the American Chemical Society","2002","124","","8912","8921","10.1021/ja025593n","","","0.71073","MoK-alpha","","","0.088","","","0.103","","","","","1.639","1.639","","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114991","10.8087","0.0005","27.45","0.002","14.9497","0.0009","90","","99.183","0.002","90","","4378.7","0.5","296.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C27 H30 O2 -","- C27 H30 O2 -","- C216 H240 O16 -","8","2","","Ken Kokubo; Hiroshi Yamaguchi; Tatsuya Kawamoto; Takumi Oshima","Substituent Effects on the Stereochemistry in the [2 + 2] Photocycloaddition Reaction of Homobenzoquinone Derivative with Variously Substituted Alkenes and Alkynes","Journal of the American Chemical Society","2002","124","","8912","8921","10.1021/ja025593n","","","0.7107","MoKα","","","0.056","","","","0.1525","","","","","","0.744","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114992","31.537","0.003","8.8546","0.0008","23.933","0.002","90","","110.637","0.002","90","","6254.4","1","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C66 H42 Eu2 F6 N12 O15 S2 -","- C66 H42 Eu2 F6 N12 O15 S2 -","- C264 H168 Eu8 F24 N48 O60 S8 -","4","0.5","","Yann Bretonnière; Marinella Mazzanti; Jacques Pécaut; Marilyn M. Olmstead","Cation-Controlled Self-Assembly of a Hexameric Europium Wheel","Journal of the American Chemical Society","2002","124","","9012","9013","10.1021/ja012177e","","","0.71073","MoKα","","0.0802","0.0385","","","0.0873","0.1106","","","","","","1.004","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114993","22.9958","0.0007","22.9958","0.0007","31.3192","0.0017","90","","90","","120","","14342.9","1","223","2","223","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C221 H150 Eu7 F27 N46 O51 S9 -","- C218.07 H120 Eu7 F15 N46.05 O45.02 S8.97 -","- C436.14 H240 Eu14 F30 N92.1 O90.04 S17.94 -","2","0.166667","","Yann Bretonnière; Marinella Mazzanti; Jacques Pécaut; Marilyn M. Olmstead","Cation-Controlled Self-Assembly of a Hexameric Europium Wheel","Journal of the American Chemical Society","2002","124","","9012","9013","10.1021/ja012177e","","","0.71073","MoKα","","0.1466","0.0607","","","0.1934","0.2288","","","","","","1.005","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114994","7.784","0.008","8.201","0.008","10.38","0.01","90","","90","","96.55","0.05","658.3","1.1","293","2","293","2","","","","","","","","3","P 1 1 21","P 2c","4","cellulose","","","- C12 H14 O10 -","- C12 H14 O10 -","- C24 H28 O20 -","2","1","","Yoshiharu Nishiyama; Paul Langan; Henri Chanzy","Crystal Structure and Hydrogen-Bonding System in Cellulose Iβ from Synchrotron X-ray and Neutron Fiber Diffraction","Journal of the American Chemical Society","2002","124","","9074","9082","10.1021/ja0257319","","","0.7208","","","0.191","0.1857","","","0.4182","0.4242","","","","","","3.999","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114995","7.784","0.008","8.201","0.008","10.38","0.01","90","","90","","96.55","0.05","658.3","1.1","293","2","293","2","","","","","","","","4","P 1 1 21","P 2c","4","","","","- C12 H14 D10 O6 -","- C12 H14 D6 O10 -","- C24 H28 D12 O20 -","2","1","","Yoshiharu Nishiyama; Paul Langan; Henri Chanzy","Crystal Structure and Hydrogen-Bonding System in Cellulose Iβ from Synchrotron X-ray and Neutron Fiber Diffraction","Journal of the American Chemical Society","2002","124","","9074","9082","10.1021/ja0257319","","","1.3058","","","0.2664","0.2095","","","0.417","0.4272","","","","","","1.332","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114996","16.1816","0.0004","15.9178","0.0004","29.4907","0.0008","90","","91.4768","0.001","90","","7593.6","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","tungsten sulfide cluster","octakis(mu!3$-sulfido)-pentakis(tert-butylpyridine)-triethylphosphine- hexa-tungsten bezene solvate","","- C68 H97 N5 P S8 W6 -","- C67.92 H96.92 N5 P S8 W6 -","- C271.68 H387.68 N20 P4 S32 W24 -","4","1","","Song Jin; Jennifer Adamchuk; Bosong Xiang; Francis J. DiSalvo","The Dean-Evans Relation in 31P NMR Spectroscopy and Its Application to the Chemistry of Octahedral Tungsten Sulfide Clusters","Journal of the American Chemical Society","2002","124","","9229","9240","","","","0.71073","MoKα","","0.1579","0.0571","","0.166","0.1122","","","","1.099","1.205","1.205","","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4114997","15.0562","0.001","16.2762","0.001","20.488","0.0013","88.98","0.002","74.256","0.002","78.297","0.002","4728.2","0.5","446","2","446","2","","","","","","","","5","P -1","-P 1","2","Tungsten sulfide cluster with mixed","octakis(mu!3$-sulfido)-mer-tris(triethylphosphine) -tris(tricyclohexylphosphine)-hexa-tungsten","","- C84 H156 P6 S8 W6 -","- C84 H156 P6 S8 W6 -","- C168 H312 P12 S16 W12 -","2","1","","Song Jin; Jennifer Adamchuk; Bosong Xiang; Francis J. DiSalvo","The Dean-Evans Relation in 31P NMR Spectroscopy and Its Application to the Chemistry of Octahedral Tungsten Sulfide Clusters","Journal of the American Chemical Society","2002","124","","9229","9240","10.1021/ja0257873","","","0.71073","MoKα","","0.1227","0.0498","","0.1122","0.078","","","","0.967","1.064","1.064","","","","","has coordinates","178920","2020-10-21","18:00:00",""
"4114998","14.8422","0.0005","12.5791","0.0005","24.829","0.001","90","","90","","90","","4635.6","0.3","296.2","","","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C21 H27 Cl N2 O6 -","- C21 H27 Cl N2 O6 -","- C168 H216 Cl8 N16 O48 -","8","2","","Shunichi Fukuzumi; Osamu Inada; Naoya Satoh; Tomoyoshi Suenobu; Hiroshi Imahori","Significant Enhancement of Electron Transfer Reduction of NAD+ Analogues by Complexation with Scandium Ion and the Detection of the Radical Intermediate-Scandium Ion Complex","Journal of the American Chemical Society","2002","124","","9181","9188","10.1021/ja0260364","","","0.7107","MoKα","","","0.0775","","","","0.1891","","","","","","1.313","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4114999","13.8859","0.0017","7.2451","0.0009","9.2462","0.0011","90","","90","","90","","930.2","0.2","90","1","90","1","","","","","","","","6","P n m a","-P 2ac 2n","62","trans-[Ru(II)(NH3)4Cl(SO2)]Cl","trans-Tetraamminechloro(sulfur dioxide)ruthenium(II) chloride","","- Cl2 H12 N4 O2 Ru S -","- Cl2 H12 N4 O2 Ru S -","- Cl8 H48 N16 O8 Ru4 S4 -","4","0.5","","Andrey Yu. Kovalevsky; Kimberly A. Bagley; Philip Coppens","The First Photocrystallographic Evidence for Light-Induced Metastable Linkage Isomers of Ruthenium Sulfur Dioxide Complexes","Journal of the American Chemical Society","2002","124","","9241","9248","10.1021/ja026045c","","","0.71073","MoKα","","0.0494","0.0353","","","0.0682","0.0734","","","","","","1.278","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115000","13.8336","0.0008","7.2918","0.0004","9.2037","0.0006","90","","90","","90","","928.39","0.1","90","1","90","1","","","","","","","","6","P n m a","-P 2ac 2n","62","trans-[Ru(II)(NH3)4Cl(SO2)]Cl","trans-Tetraamminechloro(sulfur dioxide)ruthenium(II) chloride","","- Cl2 H12 N4 O2 Ru S -","- Cl2 H12 N4 O2 Ru S -","- Cl8 H48 N16 O8 Ru4 S4 -","4","0.5","","Andrey Yu. Kovalevsky; Kimberly A. Bagley; Philip Coppens","The First Photocrystallographic Evidence for Light-Induced Metastable Linkage Isomers of Ruthenium Sulfur Dioxide Complexes","Journal of the American Chemical Society","2002","124","","9241","9248","10.1021/ja026045c","","","0.71073","MoKα","","0.0389","0.0299","","","0.0666","0.0696","","","","","","1.286","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115001","7.0137","0.0002","12.8351","0.0004","12.9606","0.0004","111.327","0.001","90.387","0.001","101.198","0.001","1062.31","0.06","90","1","90","1","","","","","","","","6","P -1","-P 1","2","trans-[Ru(II)(NH3)4(H2O)(SO2)](C6H5SO3)2","trans-Tetraammineaquo(sulfur dioxide)ruthenium(II) benzene sulfonate","","- C12 H24 N4 O9 Ru S3 -","- C12 H24 N4 O9 Ru S3 -","- C24 H48 N8 O18 Ru2 S6 -","2","1","","Andrey Yu. Kovalevsky; Kimberly A. Bagley; Philip Coppens","The First Photocrystallographic Evidence for Light-Induced Metastable Linkage Isomers of Ruthenium Sulfur Dioxide Complexes","Journal of the American Chemical Society","2002","124","","9241","9248","10.1021/ja026045c","","","0.71073","MoKα","","0.0432","0.0351","","","0.0704","0.0746","","","","","","1.149","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115002","7.0244","0.0002","12.8381","0.0003","13.0303","0.0003","111.581","0.001","90.336","0.001","101.447","0.001","1066.95","0.05","90","1","90","1","","","","","","","","6","P -1","-P 1","2","trans-[Ru(II)(NH3)4(H2O)(SO2)](C6H5SO3)2","trans-Tetraammineaquo(sulfur dioxide)ruthenium(II) benzene sulfonate","","- C12 H24 N4 O9 Ru S3 -","- C12 H23.78 N4 O9 Ru S3 -","- C24 H47.56 N8 O18 Ru2 S6 -","2","1","","Andrey Yu. Kovalevsky; Kimberly A. Bagley; Philip Coppens","The First Photocrystallographic Evidence for Light-Induced Metastable Linkage Isomers of Ruthenium Sulfur Dioxide Complexes","Journal of the American Chemical Society","2002","124","","9241","9248","10.1021/ja026045c","","","0.71073","MoKα","","0.0521","0.0406","","","0.087","0.0927","","","","","","1.333","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115003","10.1721","0.0006","24.0538","0.0015","12.9207","0.0008","90","","101.93","0.001","90","","3093.1","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19.5 H32.5 Cl9.5 N4 Zn -","- C19.5 H32.5 Cl9.5 N4 Zn -","- C78 H130 Cl38 N16 Zn4 -","4","1","","Xiangyang Liang; John A. Parkinson; Michael Weishäupl; Robert O. Gould; Stephen J. Paisey; Hye-seo Park; Tina M. Hunter; Claudia A. Blindauer; Simon Parsons; Peter J. Sadler","Structure and Dynamics of Metallomacrocycles: Recognition of Zinc Xylyl-Bicyclam by an HIV Coreceptor","Journal of the American Chemical Society","2002","124","","9105","9112","10.1021/ja0260723","","","0.71073","MoKα","","0.0549","0.0435","","","0.1261","0.1307","","","","","","1.123","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4115004","9.6516","0.0019","10.089","0.002","14.429","0.003","105.741","0.003","101.629","0.003","94.304","0.004","1312","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H74 N8 O8 Zn2 -","- C38 H74 N8 O10 Zn2 -","- C38 H74 N8 O10 Zn2 -","1","0.5","","Xiangyang Liang; John A. Parkinson; Michael Weishäupl; Robert O. Gould; Stephen J. Paisey; Hye-seo Park; Tina M. Hunter; Claudia A. Blindauer; Simon Parsons; Peter J. Sadler","Structure and Dynamics of Metallomacrocycles: Recognition of Zinc Xylyl-Bicyclam by an HIV Coreceptor","Journal of the American Chemical Society","2002","124","","9105","9112","10.1021/ja0260723","","","0.71073","MoKα","","0.0593","0.0471","","","0.1122","0.1159","","","","","","0.929","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115005","8.5829","0.001","9.7811","0.0012","11.6962","0.0014","83.521","0.002","86.559","0.002","89.682","0.002","973.9","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H34 N4 O6 Pd -","- C14 H34 N4 O6 Pd -","- C28 H68 N8 O12 Pd2 -","2","1","","Xiangyang Liang; John A. Parkinson; Michael Weishäupl; Robert O. Gould; Stephen J. Paisey; Hye-seo Park; Tina M. Hunter; Claudia A. Blindauer; Simon Parsons; Peter J. Sadler","Structure and Dynamics of Metallomacrocycles: Recognition of Zinc Xylyl-Bicyclam by an HIV Coreceptor","Journal of the American Chemical Society","2002","124","","9105","9112","10.1021/ja0260723","","","0.71073","MoKα","","0.0608","0.0428","","","0.094","0.1014","","","","","","1.038","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115006","8.7517","0.0002","11.3891","0.0002","12.1388","0.0001","72.591","0.001","79.509","0.001","75.557","0.001","1110.43","0.03","159.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H29 Ir N2 O -","- C25 H29 Ir N2 O -","- C50 H58 Ir2 N4 O2 -","2","1","","Andrew W. Holland; Robert G. Bergman","Heterocumulene Metathesis by Iridium Guanidinate and Ureylene Complexes: Catalysis Involving Reversible Insertion To Form Six-Membered Metallacycles","Journal of the American Chemical Society","2002","124","","9010","9011","10.1021/ja026178y","","","0.7107","MoKα","","","0.0222","","","","0.027","","","","","","1.1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115007","22.133","0.003","8.1435","0.0012","22.136","0.003","90","","107.488","0.003","90","","3805.4","0.9","293","2","293","2","","","","","","","","4","I 1 2 1","I 2y","5","Indene 3c","","","- C22 H12 F8 N2 -","- C22 H12 F8 N2 -","- C176 H96 F64 N16 -","8","2","","Igor V. Alabugin; Serguei V. Kovalenko","C1-C5 Photochemical Cyclization of Enediynes","Journal of the American Chemical Society","2002","124","","9052","9053","10.1021/ja026630d","","","0.71073","MoKα","","0.097","0.0551","","","0.1134","0.1314","","","","","","0.917","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115008","14.4878","0.0008","14.4878","0.0008","16.3787","0.0009","90","","90","","90","","3437.8","0.3","213","2","213","2","","","","","","","synthesis","7","P 4/n c c :2","-P 4a 2ac","130","","","","- C28 H48 B Cl F4 Mo2 N12 -","- C28 H48 B Cl F4 Mo2 N12 -","- C112 H192 B4 Cl4 F16 Mo8 N48 -","4","0.25","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Daren J. Timmons; Chad C. Wilkinson","The Extraordinary Ability of Guanidinate Derivatives to Stabilize Higher Oxidation Numbers in Dimetal Units by Modification of Redox Potentials: Structures of Mo25+ and Mo26+ Compounds","Journal of the American Chemical Society","2002","124","","9249","9256","10.1021/ja0266464","","","0.71073","MoKα","","0.0704","0.0382","","0.1353","0.0973","","","","1.161","1.112","1.112","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115009","13.561","0.011","13.561","0.011","8.533","0.0003","90","","90","","90","","1569.2","1.8","213","2","213","2","","","","","","","","5","P 4/n :2","-P 4a","85","","","","- C28 H48 Cl Mo2 N12 -","- C28 H48 Cl Mo2 N12 -","- C56 H96 Cl2 Mo4 N24 -","2","0.25","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Daren J. Timmons; Chad C. Wilkinson","The Extraordinary Ability of Guanidinate Derivatives to Stabilize Higher Oxidation Numbers in Dimetal Units by Modification of Redox Potentials: Structures of Mo25+ and Mo26+ Compounds","Journal of the American Chemical Society","2002","124","","9249","9256","10.1021/ja0266464","","","0.71073","MoKα","","0.0639","0.0531","","0.1128","0.1032","","","","1.213","1.221","1.221","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115010","13.6912","0.0008","13.6912","0.0008","20.4755","0.0012","90","","90","","90","","3838.1","0.4","213","2","213","2","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","","","- C30 H52 Cl5 Mo2 N12 -","- C30 H52 Cl5 Mo2 N12 -","- C120 H208 Cl20 Mo8 N48 -","4","0.25","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Daren J. Timmons; Chad C. Wilkinson","The Extraordinary Ability of Guanidinate Derivatives to Stabilize Higher Oxidation Numbers in Dimetal Units by Modification of Redox Potentials: Structures of Mo25+ and Mo26+ Compounds","Journal of the American Chemical Society","2002","124","","9249","9256","10.1021/ja0266464","","","0.71073","MoKα","","0.0273","0.0227","","","0.0569","0.0622","","","","","","1.107","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115011","8.66","0.006","38.787","0.026","56.28","0.037","90","","90","","90","","18904","2","129","2","129","2","","","","","","","synthetic","6","F d d d :2","-F 2uv 2vw","70","","","","- C48 H144 Cl9 N24 O24 Ru4 -","- C48 H96 Cl9.12 N24 O24.02 Ru4 -","- C384 H768 Cl72.96 N192 O192.16 Ru32 -","8","0.25","","Victor C. Lau; Louise A. Berben; Jeffrey R. Long","[(Cyclen)4Ru4(pz)4]9+: A Creutz-Taube Square","Journal of the American Chemical Society","2002","124","","9042","9043","10.1021/ja027114q","","","0.71073","MoKα","","0.1658","0.0794","","0.2486","0.1908","","","","1.019","1.186","1.186","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115012","9.7902","0.0011","10.9413","0.0013","10.6855","0.0012","90","","113.714","0.002","90","","1048","0.2","173","2","173","2","","","","","","","Prof. T. Hanusa - Vanderbilt","3","P 1 21/n 1","-P 2yn","14","00021a","","","- C26 H30 Cr -","- C26 H30 Cr -","- C52 H60 Cr2 -","2","0.5","","Erik D. Brady; Jason S. Overby; M. Brett Meredith; Adam B. Mussman; Michael A. Cohn; Timothy P. Hanusa; Gordon T. Yee; Maren Pink","Spin-State Alteration from Sterically Enforced Ligand Rotation in Bis(indenyl)chromium(II) Complexes1","Journal of the American Chemical Society","2002","124","","9556","9566","10.1021/ja012390a","","","0.71073","MoKα","","0.0677","0.0369","","0.0885","0.0833","","","","0.985","1.168","1.168","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115013","11.098","0.001","16.192","0.002","38.358","0.004","90","","92.973","0.002","90","","6883.6","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","00066","","","- C31.5 H49.5 Cr Si4 -","- C31.5 H49.5 Cr Si4 -","- C252 H396 Cr8 Si32 -","8","2","","Erik D. Brady; Jason S. Overby; M. Brett Meredith; Adam B. Mussman; Michael A. Cohn; Timothy P. Hanusa; Gordon T. Yee; Maren Pink","Spin-State Alteration from Sterically Enforced Ligand Rotation in Bis(indenyl)chromium(II) Complexes1","Journal of the American Chemical Society","2002","124","","9556","9566","10.1021/ja012390a","","","0.71073","MoKα","","0.1178","0.083","","","0.1946","0.2096","","","","","","1.072","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4115014","18.26","0.007","9.694","0.004","17.921","0.007","90","","115.893","0.006","90","","2854","2","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","00390","","","- C34 H46 Cr -","- C34 H46 Cr -","- C136 H184 Cr4 -","4","1","","Erik D. Brady; Jason S. Overby; M. Brett Meredith; Adam B. Mussman; Michael A. Cohn; Timothy P. Hanusa; Gordon T. Yee; Maren Pink","Spin-State Alteration from Sterically Enforced Ligand Rotation in Bis(indenyl)chromium(II) Complexes1","Journal of the American Chemical Society","2002","124","","9556","9566","10.1021/ja012390a","","","0.71073","MoKα","","0.0644","0.0469","","","0.116","0.1267","","","","","","0.986","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4115015","8.26","0.002","16.961","0.003","11.406","0.002","90","","90","","90","","1598","0.6","153.2","","153.2","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C10 H18 Cl4 Pt Si2 -","- C10 H18 Cl4 Pt Si2 -","- C40 H72 Cl16 Pt4 Si8 -","4","0.5","","Aroop K. Roy; Richard B. Taylor","The First Alkene-Platinum-Silyl Complexes: Lifting the Hydrosilation Mechanism Shroud with Long-Lived Precatalytic Intermediates and True Pt Catalysts","Journal of the American Chemical Society","2002","124","","9510","9524","10.1021/ja0127335","","","0.7107","MoKα","","0.0371","0.024","","0.05","","0.025","","","2.222","","","2.4","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115016","11.6938","0.001","4.3777","0.001","18.9304","0.001","90","","96.657","0.01","90","","962.6","0.2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Dysprosiumborate","Dysprosiumborate","","- B6 Dy4 O15 -","- B6 Dy4 O15 -","- B24 Dy16 O60 -","4","0.5","","Hubert Huppertz; Benjamin von der Eltz","Multianvil High-Pressure Synthesis of Dy4B6O15: The First Oxoborate with Edge-Sharing BO4 Tetrahedra","Journal of the American Chemical Society","2002","124","","9376","9377","10.1021/ja017691z","","","0.71073","MoKα","","0.0173","0.0155","","","0.0349","0.0356","","","","","","1.098","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115017","9.66","0.002","11.339","0.002","13.084","0.002","71.003","0.019","78.85","0.02","78.94","0.02","1316.6","0.4","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","1-Isopropyl-4-propyl-2,6-dioxo-5-[2-(1-propyl-2,6-diisopropyl-1-hydro -pyridin-4-ylidene)-ethylidene]-1,2,5,6-tetrahydro-pyridine-3-carbonitrile","","- C28 H39 N3 O2 -","- C28 H39 N3 O2 -","- C56 H78 N6 O4 -","2","1","","Frank Würthner; Sheng Yao; Tony Debaerdemaeker; Rüdiger Wortmann","Dimerization of Merocyanine Dyes. Structural and Energetic Characterization of Dipolar Dye Aggregates and Implications for Nonlinear Optical Materials","Journal of the American Chemical Society","2002","124","","9431","9447","10.1021/ja020168f","","","0.71073","MoKα","","0.1077","0.0522","","","0.1188","0.1371","","","","","","0.809","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115018","8.574","0.001","23.833","0.002","12.382","0.001","90","","98.27","0.01","90","","2503.9","0.4","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","(5-Ethylbutylamino-3,4-diethyl-thiophen)-2-ylmethylene-4- methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile","","","- C26 H37 N3 O2 S -","- C26 H37 N3 O2 S -","- C104 H148 N12 O8 S4 -","4","2","","Frank Würthner; Sheng Yao; Tony Debaerdemaeker; Rüdiger Wortmann","Dimerization of Merocyanine Dyes. Structural and Energetic Characterization of Dipolar Dye Aggregates and Implications for Nonlinear Optical Materials","Journal of the American Chemical Society","2002","124","","9431","9447","10.1021/ja020168f","","","0.71073","MoKα","","0.0652","0.0485","","","0.1131","0.1203","","","","","","0.934","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115019","8.4904","0.0004","15.7476","0.0007","18.1259","0.0009","91.141","0.001","96.429","0.001","94.768","0.001","2398.9","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","(dippe)Ni(eta-2-quinoline)","","","- C23 H39 N Ni P2 -","- C23 H39 N Ni P2 -","- C92 H156 N4 Ni4 P8 -","4","2","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.0741","0.0539","","","0.0995","0.1081","","","","","","1.062","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115020","8.8371","0.0012","28.489","0.005","10.6359","0.0019","90","","100.917","0.016","90","","2629.2","0.8","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(dippe)Ni(eta-2acridine)","","","- C27 H41 N Ni P2 -","- C27 H41 N Ni P2 -","- C108 H164 N4 Ni4 P8 -","4","1","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.0964","0.0553","","","0.126","0.1459","","","","","","0.877","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115021","8.138","0.0004","10.6539","0.0006","14.6552","0.0008","87.87","0.001","76.897","0.001","85.797","0.001","1233.94","0.11","193","2","193","2","","","","","","","","5","P -1","-P 1","2","(dippe)Ni(2-quinolinyl)(CN)","","","- C24 H38 N2 Ni P2 -","- C24 H38 N2 Ni P2 -","- C48 H76 N4 Ni2 P4 -","2","1","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.0352","0.0293","","","0.0832","0.0925","","","","","","0.529","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115022","17.096","0.003","17.107","0.002","17.333","0.002","90","","90","","90","","5069.2","1.2","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","(dippe)Ni(eta2-3-cyanoquinoline)","","","- C24 H38 N2 Ni P2 -","- C24 H38 N2 Ni P2 -","- C192 H304 N16 Ni8 P16 -","8","2","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.1525","0.0972","","","0.1712","0.1959","","","","","","1.101","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115023","8.02","0.0014","20.925","0.003","14.969","0.003","90","","92.023","0.009","90","","2510.5","0.8","188","2","188","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(dippe)Ni(3-quinolinyl)(CN)","","","- C24 H38 N2 Ni P2 -","- C24 H38 N2 Ni P2 -","- C96 H152 N8 Ni4 P8 -","4","1","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.057","0.0449","","","0.1073","0.1118","","","","","","1.124","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115024","20.7022","0.0013","13.5413","0.0008","16.0621","0.001","90","","93.666","0.001","90","","4493.6","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(dippe)Ni(h2-2-cyanopyridine)","","","- C20 H36 N2 Ni P2 -","- C20 H36 N2 Ni P2 -","- C160 H288 N16 Ni8 P16 -","8","2","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.1149","0.0829","","","0.1571","0.1674","","","","","","1.216","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115025","15.2478","0.0007","22.2907","0.001","29.1393","0.0014","90","","90","","90","","9904","0.8","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","((dippe)Ni(h2-1,4-dicyanobenzene)","","","- C22 H36 N2 Ni P2 -","- C22 H36 N2 Ni P2 -","- C352 H576 N32 Ni16 P32 -","16","2","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.1438","0.0705","","","0.1708","0.2097","","","","","","0.847","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115026","8.0746","0.0004","11.8545","0.0006","13.0056","0.0006","75.466","0.001","82.407","0.001","89.484","0.001","1194.12","0.1","193","2","193","2","","","","","","","","5","P -1","-P 1","2","(dippe)Ni(4-cyanophenyl)(CN)","","","- C22 H36 N2 Ni P2 -","- C22 H36 N2 Ni P2 -","- C44 H72 N4 Ni2 P4 -","2","1","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.0315","0.0275","","","0.0716","0.0734","","","","","","1.046","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115027","10.5304","0.0006","15.1549","0.0009","12.8816","0.0007","90","","91.304","0.001","90","","2055.2","0.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[(dippe)Ni]2(h2,h2-1,4-dicyanobenzene)","","","- C36 H68 N2 Ni2 P4 -","- C36 H68 N2 Ni2 P4 -","- C72 H136 N4 Ni4 P8 -","2","0.5","","Juventino J. Garcia; Nicole M. Brunkan; William D. Jones","Cleavage of Carbon-Carbon Bonds in Aromatic Nitriles Using Nickel(0)","Journal of the American Chemical Society","2002","124","","9547","9555","10.1021/ja0204933","","","0.71073","MoKα","","0.0657","0.0461","","","0.086","0.0914","","","","","","1.102","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115028","15.9601","0.0019","15.9601","0.0019","4.4494","0.0006","90","","90","","90","","1133.4","0.2","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C8 H7 Cl N3 S4 -","- C8 H8 Cl N3 S4 -","- C32 H32 Cl4 N12 S16 -","4","0.5","","Leanne Beer; Jaclyn L. Brusso; A. Wallace Cordes; Robert C. Haddon; Mikhail E. Itkis; Kristin Kirschbaum; Douglas S. MacGregor; Richard T. Oakley; A. Alan Pinkerton; Robert W. Reed","Resonance-Stabilized 1,2,3-Dithiazolo-1,2,3-dithiazolyls as Neutral π-Radical Conductors","Journal of the American Chemical Society","2002","124","","9498","9509","10.1021/ja026118s","","","0.7107","MoKα","","0.059","0.0308","","","0.0453","0.0495","","","","","","0.784","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115029","4.5386","0.0004","14.2658","0.001","14.3779","0.0011","90","","90","","90","","930.92","0.13","25","5","25","5","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H3 Cl N3 S4 -","- C6 H3 Cl N3 S4 -","- C24 H12 Cl4 N12 S16 -","4","1","","Leanne Beer; Jaclyn L. Brusso; A. Wallace Cordes; Robert C. Haddon; Mikhail E. Itkis; Kristin Kirschbaum; Douglas S. MacGregor; Richard T. Oakley; A. Alan Pinkerton; Robert W. Reed","Resonance-Stabilized 1,2,3-Dithiazolo-1,2,3-dithiazolyls as Neutral π-Radical Conductors","Journal of the American Chemical Society","2002","124","","9498","9509","10.1021/ja026118s","","","0.71073","MoKα","","0.0525","0.0493","","","0.1063","0.1075","","","","","","1.193","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115030","4.2464","0.0012","15.194","0.005","15.069","0.004","90","","90","","90","","972.2","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H3 Cl N3 S4 -","- C6 H3 Cl N3 S4 -","- C24 H12 Cl4 N12 S16 -","4","1","","Leanne Beer; Jaclyn L. Brusso; A. Wallace Cordes; Robert C. Haddon; Mikhail E. Itkis; Kristin Kirschbaum; Douglas S. MacGregor; Richard T. Oakley; A. Alan Pinkerton; Robert W. Reed","Resonance-Stabilized 1,2,3-Dithiazolo-1,2,3-dithiazolyls as Neutral π-Radical Conductors","Journal of the American Chemical Society","2002","124","","9498","9509","10.1021/ja026118s","","","0.7107","MoKα","","0.0478","0.0314","","","0.0544","0.0578","","","","","","0.834","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115031","15.886","0.004","15.886","0.004","4.1088","0.0011","90","","90","","90","","1036.9","0.5","293","2","293","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","","Leanne Beer; Jaclyn L. Brusso; A. Wallace Cordes; Robert C. Haddon; Mikhail E. Itkis; Kristin Kirschbaum; Douglas S. MacGregor; Richard T. Oakley; A. Alan Pinkerton; Robert W. Reed","Resonance-Stabilized 1,2,3-Dithiazolo-1,2,3-dithiazolyls as Neutral π-Radical Conductors","Journal of the American Chemical Society","2002","124","","9498","9509","10.1021/ja026118s","","","0.7107","MoKα","","0.0359","0.0279","","","0.0571","0.0603","","","","","","1.107","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115032","11.2935","0.0005","18.229","0.001","12.044","0.0005","90","","112.187","0.003","90","","2295.9","0.19","183.2","","183.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H38 Br P Pd -","- C24 H2 Br P Pd -","- C96 H8 Br4 P4 Pd4 -","4","1","","James P. Stambuli; Michael Bühl; John F. Hartwig","Synthesis, Characterization, and Reactivity of Monomeric, Arylpalladium Halide Complexes with a Hindered Phosphine as the Only Dative Ligand","Journal of the American Chemical Society","2002","124","","9346","9347","10.1021/ja0264394","","","0.7107","MoKalpha","","0.0679","0.0391","","0.0363","0.0325","","","","1.36","1.434","1.434","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115033","15.2945","0.0004","14.244","0.0004","20.5478","0.0005","90","","90","","90","","4476.4","0.2","183.2","","183.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H36 I P Pd -","- C20 I P Pd -","- C160 I8 P8 Pd8 -","8","1","","James P. Stambuli; Michael Bühl; John F. Hartwig","Synthesis, Characterization, and Reactivity of Monomeric, Arylpalladium Halide Complexes with a Hindered Phosphine as the Only Dative Ligand","Journal of the American Chemical Society","2002","124","","9346","9347","10.1021/ja0264394","","","0.7107","MoKα","","","0.0256","","","","0.0273","","","","","","1.264","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115034","15.452","0.001","16.887","0.001","10.5491","0.0003","104.686","0.002","108.412","0.001","62.816","0.001","2303.7","0.2","183.2","","183.2","","","","","","","","","5","P -1","-P 1","2","","","","- C55 H53 N P2 Pd -","- C55 H53 N P2 Pd -","- C110 H106 N2 P4 Pd2 -","2","1","","Darcy A. Culkin; John F. Hartwig","Synthesis, Characterization, and Reactivity of Arylpalladium Cyanoalkyl Complexes: Selection of Catalysts for the α-Arylation of Nitriles","Journal of the American Chemical Society","2002","124","","9330","9331","10.1021/ja026584h","","","0.7107","MoKalpha","","","0.0344","","","0.0409","","","","","1.996","1.996","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115035","14.3398","0.0005","16.7219","0.0004","14.9078","0.0004","90","","97.737","0.001","90","","3542.18","0.18","183.2","","183.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H55 Fe N P2 Pd -","- C36 H55 Fe N P2 Pd -","- C144 H220 Fe4 N4 P8 Pd4 -","4","1","","Darcy A. Culkin; John F. Hartwig","Synthesis, Characterization, and Reactivity of Arylpalladium Cyanoalkyl Complexes: Selection of Catalysts for the α-Arylation of Nitriles","Journal of the American Chemical Society","2002","124","","9330","9331","10.1021/ja026584h","","","0.7107","MoKalpha","","","0.0374","","","0.0477","","","","","2.305","2.305","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115036","29.992","0.001","8.635","0.0003","17.599","0.001","90","","94.839","0.002","90","","4541.6","0.3","183.2","","183.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H28 N P Pd -","- C25 H28 N P Pd -","- C200 H224 N8 P8 Pd8 -","8","1","","Darcy A. Culkin; John F. Hartwig","Synthesis, Characterization, and Reactivity of Arylpalladium Cyanoalkyl Complexes: Selection of Catalysts for the α-Arylation of Nitriles","Journal of the American Chemical Society","2002","124","","9330","9331","10.1021/ja026584h","","","0.7107","MoKalpha","","","0.0308","","","0.0309","","","","","1.568","1.568","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115037","10.601","0.002","10.91","0.002","11.259","0.002","77.88","0.03","71.68","0.03","68.17","0.03","1141.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","trimeric perfluro-ortho-phenylenemercury + acetone","","","- C21 H6 F12 Hg3 O -","- C21 H6 F12 Hg3 O -","- C42 H12 F24 Hg6 O2 -","2","1","","Julie B. King; Mason R. Haneline; Mitsukimi Tsunoda; François P. Gabbaï","Dimerization of the Trinuclear Mercury(II) Complex [(o-C6F4Hg)3.μ3-acetone] via Mercurophilic Interactions","Journal of the American Chemical Society","2002","124","","9350","9351","10.1021/ja0268534","","","0.71073","MoKα","","0.0676","0.0589","","","0.1422","0.1488","","","","","","1.031","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115038","15.3944","0.0006","8.4977","0.0003","32.326","0.001","90","","90.753","0.003","90","","4228.4","0.3","173.2","","173.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H35 N O Si W -","- C19 H35 N O Si W -","- C152 H280 N8 O8 Si8 W8 -","8","1","","Stephen H. K. Ng; Craig S. Adams; Peter Legzdins","Unusual Thermal C-H Bond Activation by a Tungsten Allene Complex1","Journal of the American Chemical Society","2002","124","","9380","9381","10.1021/ja026951p","","","0.7107","MoKα","","0.0526","0.036","","0.1071","","0.1071","","","1.597","","","1.597","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115039","9.1458","0.0005","13.65","0.0007","15.9576","0.0009","90","","98.724","0.003","90","","1969.1","0.19","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 N O P W -","- C18 H32 N O P W -","- C72 H128 N4 O4 P4 W4 -","4","1","","Stephen H. K. Ng; Craig S. Adams; Peter Legzdins","Unusual Thermal C-H Bond Activation by a Tungsten Allene Complex1","Journal of the American Chemical Society","2002","124","","9380","9381","10.1021/ja026951p","","","0.71073","MoKα","","0.0358","0.0281","","","0.0651","0.0668","","","","","","0.947","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115040","9.084","0.0002","31.013","0.0006","11.809","0.0003","90","","93.796","0.002","90","","3319.56","0.13","120","","120","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,1,3,3-Tetra-tert-butyl-2-[di-tert-butyl(methyl)silyl]- 1,3-dimethyltrisilan-2-yl","","- C27 H63 Si4 -","- C27 H63 Si4 -","- C108 H252 Si16 -","4","1","","Akira Sekiguchi; Tomohide Fukawa; Masaaki Nakamoto; Vladimir Ya. Lee; Masaaki Ichinohe","Isolable Silyl and Germyl Radicals Lacking Conjugation with π-Bonds: Synthesis, Characterization, and Reactivity","Journal of the American Chemical Society","2002","124","","9865","9869","10.1021/ja0126780","","","0.7107","MoKα","","0.0604","0.0556","","","0.1542","0.1596","","","","","","1.033","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115041","9.079","0.0002","31.095","0.0006","11.816","0.0002","90","","93.966","0.001","90","","3327.8","0.11","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tris[di-tert-butyl(methyl)silyl]germanyl","","- C27 H63 Ge Si3 -","- C27 H63 Ge Si3 -","- C108 H252 Ge4 Si12 -","4","1","","Akira Sekiguchi; Tomohide Fukawa; Masaaki Nakamoto; Vladimir Ya. Lee; Masaaki Ichinohe","Isolable Silyl and Germyl Radicals Lacking Conjugation with π-Bonds: Synthesis, Characterization, and Reactivity","Journal of the American Chemical Society","2002","124","","9865","9869","10.1021/ja0126780","","","0.7107","MoKα","","0.0356","0.0334","","","0.0919","0.0942","","","","","","1.032","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115042","27.156","0.003","26.242","0.003","13.2949","0.0016","90","","90.57","0.003","90","","9473.8","1.9","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","UCR-9","","","- C124 H106 Cd8 N8 O16 S15 -","- C124 H96 Cd8 N8 O16 S13 -","- C248 H192 Cd16 N16 O32 S26 -","2","0.25","","Nanfeng Zheng; Xianhui Bu; Pingyun Feng","Self-Assembly of Novel Dye Molecules and [Cd8(SPh)12]4+ Cubic Clusters into Three-Dimensional Photoluminescent Superlattice","Journal of the American Chemical Society","2002","124","","9688","9689","10.1021/ja020480p","","","0.71073","MoKα","","0.1071","0.074","","","0.2611","0.286","","","","","","1.108","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115043","10.0093","0.0006","15.4273","0.0009","14.009","0.0008","90","","92.758","0.001","90","","2160.7","0.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H72 Cl4 P2 Rh2 -","- C40 H72 Cl4 P2 Rh2 -","- C80 H144 Cl8 P4 Rh4 -","2","0.5","","Giuseppe Canepa; Carsten D. Brandt; Helmut Werner","An Unprecedented Dinuclear Alkylrhodium(III) Complex Built up by Two 14-Electron [RhCl2(alkyl)(PR3)] Units","Journal of the American Chemical Society","2002","124","","9666","9667","10.1021/ja020560t","","","0.71073","MoKα","","0.0349","0.0311","","","0.0709","0.0726","","","","","","1.09","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115044","36.026","0.003","5.6019","0.0004","9.484","0.0007","90","","100.27","0.01","90","","1883.3","0.3","203.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Toshihiro Tanaka; Akikazu Matsumoto","First Disyndiotactic Polymer from a 1,4-Disubstituted Butadiene by Alternate Molecular Stacking in the Crystalline State","Journal of the American Chemical Society","2002","124","","9676","9677","10.1021/ja020615r","","","0.7107","MoKα","","","0.07","","","","0.104","","","","","","1.184","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115045","35.644","0.004","5.6923","0.0004","9.7803","0.0006","90","","100.533","0.003","90","","1950.9","0.3","203.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Toshihiro Tanaka; Akikazu Matsumoto","First Disyndiotactic Polymer from a 1,4-Disubstituted Butadiene by Alternate Molecular Stacking in the Crystalline State","Journal of the American Chemical Society","2002","124","","9676","9677","10.1021/ja020615r","","","0.7107","MoKα","","","0.048","","","","0.1","","","","","","0.956","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115046","6.6919","0.0001","10.784","0.001","14.007","0.0008","107.237","0.005","99.272","0.003","93.847","0.004","945.71","0.11","203.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 O6 -","- C20 H16 O6 -","- C40 H32 O12 -","2","1","","Toshihiro Tanaka; Akikazu Matsumoto","First Disyndiotactic Polymer from a 1,4-Disubstituted Butadiene by Alternate Molecular Stacking in the Crystalline State","Journal of the American Chemical Society","2002","124","","9676","9677","10.1021/ja020615r","","","0.7107","MoKα","","","0.136","","","","0.209","","","","","","2.424","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115047","35.117","0.004","5.798","0.0006","9.436","0.001","90","","99.321","0.002","90","","1895.9","0.4","296.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Toshihiro Tanaka; Akikazu Matsumoto","First Disyndiotactic Polymer from a 1,4-Disubstituted Butadiene by Alternate Molecular Stacking in the Crystalline State","Journal of the American Chemical Society","2002","124","","9676","9677","10.1021/ja020615r","","","0.7107","MoKα","","","0.043","","","","0.071","","","","","","0.892","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115048","12.4637","0.0006","12.6975","0.0006","14.6816","0.0007","105.839","0.001","109.064","0.001","106.899","0.001","1919.5","0.16","233","2","233","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H60 O24 Pd6 S12 -","- C57 H60 O24 Pd6 S12 -","- C57 H60 O24 Pd6 S12 -","1","0.5","","Colin L. Beswick; Raquel Terroba; Mark A. Greaney; Edward I. Stiefel","[PdS2C2(COOMe)2]6n (n = 0, -1, -2, -3, -4): Hexanuclear Homoleptic Palladium Dithiolene Complexes","Journal of the American Chemical Society","2002","124","","9664","9665","10.1021/ja026079k","","","0.71073","MoKα","","0.033","0.0257","","","0.0593","0.0616","","","","","","1.03","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115049","14.306","0.002","8.6454","0.0008","16.0518","0.0013","90","","109.076","0.0009","90","","1876.3","0.3","293.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 F6 O P Se -","- C18 H15 F6 O P Se -","- C72 H60 F24 O4 P4 Se4 -","4","1","","Shohei Sase; Naokazu Kano; Takayuki Kawashima","Synthesis and Structure of the First 1,2σ5-Selenaphosphirane","Journal of the American Chemical Society","2002","124","","9706","9707","10.1021/ja026107z","","","0.7107","MoKα","","","0.033","","","","0.08","","","","","","1.133","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115050","7.8177","0.0004","14.3141","0.0009","20.5603","0.001","90","","90","","90","","2300.8","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H30 Mo N2 O -","- C27 H30 Mo N2 O -","- C108 H120 Mo4 N8 O4 -","4","1","","Kenji Wada; Craig B. Pamplin; Peter Legzdins","Parallel Modes of C-H Bond Activation Initiated by Cp*Mo(NO)(CH2CMe3)(C6H5) at Ambient Temperatures1","Journal of the American Chemical Society","2002","124","","9680","9681","10.1021/ja027080m","","","0.71073","MoKα","","0.0516","0.0345","","","0.0852","0.0902","","","","","","0.928","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115051","13.531","0.001","15.432","0.002","14.2106","0.0009","90","","95.896","0.001","90","","2951.6","0.5","93.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C39 H32 F4 N4 -","- C39 H32 F4 N4 -","- C156 H128 F16 N16 -","4","0.5","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0358","","","","0.0375","","","","","","1.153","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115052","9.8714","0.0007","11.905","0.001","13.335","0.001","90","","93.041","0.002","90","","1564.9","0.2","93.2","","","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","","- C21 H24 -","- C21 H24 -","- C84 H96 -","4","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0687","","","","0.1031","","","","","","1.461","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115053","10.8966","0.0005","21.1709","0.0007","8.808","0.0004","95.7095","0.0008","91.167","0.001","89.754","0.002","2021.42","0.15","93.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H26 N2 -","- C27 H26 N2 -","- C108 H104 N8 -","4","2","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.045","","","","0.1355","","","","","","0.9","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115054","29.5522","0.0006","9.1868","0.0002","26.3966","0.0006","90","","91.3215","0.0004","90","","7164.5","0.3","93.2","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C48 H50 N2 -","- C48 H49.85 N2 -","- C384 H398.8 N16 -","8","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0533","","","","0.1712","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115055","25.664","0.002","8.2817","0.0005","21.057","0.001","90","","144.662","0.002","90","","2588.6","0.3","93.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H24 F4 N4 -","- C33 H24 F4 N4 -","- C132 H96 F16 N16 -","4","0.5","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0414","","","","0.0765","","","","","","1.428","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115056","10.56","0.003","11.053","0.002","9.239","0.003","91.268","0.005","97.884","0.006","88.387","0.006","1067.6","0.5","93.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H24 N4 -","- C27 H23.7 N4 -","- C54 H47.4 N8 -","2","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0849","","","","0.2959","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115057","16.58","0.02","23.234","0.006","8.733","0.002","90","","90","","90","","3364","4","123.2","","","","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C24 H28 -","- C24 H28 -","- C192 H224 -","8","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0463","","","","0.0743","","","","","","1.465","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115058","9.128","0.001","7.602","0.001","13.409","0.001","90","","97.455","0.007","90","","922.6","0.17","93.2","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H30 O -","- C26 H30 O -","- C52 H60 O2 -","2","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0417","","","","0.0804","","","","","","1.245","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115059","17.125","0.003","12.93","0.01","9.045","0.002","90","","97.96","0.02","90","","1983.5","1.6","288.2","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C27 H30 O2 -","- C27 H30 O2 -","- C108 H120 O8 -","4","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0485","","","","0.1128","","","","","","0.993","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115060","31.176","0.004","8.507","0.001","15.348","0.003","90","","108.996","0.008","90","","3848.8","1","93.2","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C27 H30 O2 -","- C27 H30 O2 -","- C216 H240 O16 -","8","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.104","","","","0.293","","","","","","0.897","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115061","8.058","0.003","16.316","0.006","15.88","0.03","90","","97.632","0.005","90","","2069","4","288.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 O2 -","- C28 H32 O2 -","- C112 H128 O8 -","4","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0648","","","","0.1293","","","","","","1.894","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115062","17.4292","0.0005","30.4333","0.0008","10.3567","0.0003","90","","90.1211","0.0009","90","","5493.5","0.3","93.2","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C36 H28 F4 N4 -","- C36 H28 F4 N4 -","- C288 H224 F32 N32 -","8","2","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0594","","","","0.1134","","","","","","0.702","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115063","12.878","0.003","9.258","0.008","31.25","0.01","90","","94.7","0.02","90","","3713","4","113.2","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C27 H32 -","- C27 H32 -","- C216 H256 -","8","2","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.094","","","","0.1306","","","","","","3.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115064","13.4439","0.0005","14.3564","0.0006","19.5718","0.0009","90","","102.874","0.002","90","","3682.5","0.3","93.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C27 H28 O -","- C27 H27.5 O -","- C216 H220 O8 -","8","2","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0488","","","","0.1433","","","","","","0.969","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115065","13.2315","0.0006","8.9813","0.0004","16.1758","0.0006","90","","107.114","0.002","90","","1837.15","0.14","93.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 O -","- C27 H30 O -","- C108 H120 O4 -","4","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0409","","","","0.0646","","","","","","1.354","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115066","10.364","0.002","9.406","0.005","15.504","0.003","90","","107.08","0.02","90","","1444.7","0.9","113.2","","","","","","","","","","","3","P 1 n 1","P -2yac","7","","","","- C39 H36 N4 -","- C39 H36 N4 -","- C78 H72 N8 -","2","1","","Mikio Yasutake; Toru Koga; Youichi Sakamoto; Shingo Komatsu; Ming Zhou; Katsuya Sako; Hitoshi Tatemitsu; Satoru Onaka; Yoshio Aso; Shinobu Inoue; Teruo Shinmyozu","An Alternative Synthetic Route of [35](1,2,3,4,5)Cyclophane, and Structural Properties of Multibridged [3n]Cyclophanes and Their Charge-Transfer Complexes in the Solid State1","Journal of the American Chemical Society","2002","124","","10136","10145","10.1021/ja012363k","","","0.7107","MoKα","","","0.0434","","","","0.1192","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115067","12.432","0.003","13.006","0.003","33.338","0.007","97.952","0.01","94.198","0.011","97.345","0.014","5272","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C109 H129 B2 Cl6 N13 O4 Zn2 -","- C109 H129 B2 Cl6 N13 O4 Zn2 -","- C218 H258 B4 Cl12 N26 O8 Zn4 -","2","1","","David A. Shultz; Scot H. Bodnar; Hyoyoung Lee; Jeff W. Kampf; Christopher D. Incarvito; Arnold L. Rheingold","Singlet-Triplet Gap in Triplet Ground-State Biradicals Is Modulated by Substituent Effects","Journal of the American Chemical Society","2002","124","","10054","10061","10.1021/ja020154+","","","0.71073","MoKα","","0.2594","0.1352","","","0.2772","0.3338","","","","","","1.477","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115068","12.688","0.005","12.987","0.005","33.514","0.012","99.258","0.006","92.264","0.007","97.887","0.006","5388","4","158","2","158","2","","","","","","","","7","P -1","-P 1","2","","","","- C111 H123 B2 Cl6 N12 O4 Zn2 -","- C111 H123 B2 Cl6 N12 O4 Zn2 -","- C222 H246 B4 Cl12 N24 O8 Zn4 -","2","1","","David A. Shultz; Scot H. Bodnar; Hyoyoung Lee; Jeff W. Kampf; Christopher D. Incarvito; Arnold L. Rheingold","Singlet-Triplet Gap in Triplet Ground-State Biradicals Is Modulated by Substituent Effects","Journal of the American Chemical Society","2002","124","","10054","10061","10.1021/ja020154+","","","0.71073","MoKα","","0.1257","0.0973","","","0.2643","0.288","","","","","","1.062","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115069","12.46","0.002","13.048","0.002","33.278","0.006","97.901","0.003","95.124","0.003","97.495","0.003","5281.4","1.5","158","2","158","2","","","","","","","","7","P -1","-P 1","2","","","","- C106 H121 B2 Cl4 N13 O6 Zn2 -","- C106 H121 B2 Cl4 N13 O6 Zn2 -","- C212 H242 B4 Cl8 N26 O12 Zn4 -","2","1","","David A. Shultz; Scot H. Bodnar; Hyoyoung Lee; Jeff W. Kampf; Christopher D. Incarvito; Arnold L. Rheingold","Singlet-Triplet Gap in Triplet Ground-State Biradicals Is Modulated by Substituent Effects","Journal of the American Chemical Society","2002","124","","10054","10061","10.1021/ja020154+","","","0.71073","MoKα","","0.1359","0.1231","","","0.3197","0.3271","","","","","","1.126","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115070","13.394","0.0004","9.2276","0.0004","19.3499","0.0008","90","","90","","90","","2391.54","0.16","161","2","161","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Mn(h1-OClO3)2(phen)2","","- C24 H16 Cl2 Mn N4 O8 -","- C24 H16 Cl2 Mn N4 O8 -","- C96 H64 Cl8 Mn4 N16 O32 -","4","0.5","","Anna S. Larsen; Kun Wang; Mark A. Lockwood; Gordon L. Rice; Tae-Jin Won; Scott Lovell; Martin Sadílek; František Tureček; James M. Mayer","Hydrocarbon Oxidation by Bis-μ-oxo Manganese Dimers: Electron Transfer, Hydride Transfer, and Hydrogen Atom Transfer Mechanisms","Journal of the American Chemical Society","2002","124","","10112","10123","10.1021/ja020204a","","","0.7107","MoKα","","0.1076","0.0722","","","0.1482","0.1819","","","","","","1.131","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115071","12.9889","0.0013","9.9222","0.0011","28.22","0.0017","90","","91.463","0.005","90","","3635.8","0.6","100","1","100","1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C40 H42 F3 Fe N O3 S Sn -","- C40 H42 F3 Fe N O3 S Sn -","- C160 H168 F12 Fe4 N4 O12 S4 Sn4 -","4","1","","Thomas Baumgartner; Frieder Jäkle; Ron Rulkens; Gernot Zech; Alan J. Lough; Ian Manners","Nucleophilically Assisted and Cationic Ring-Opening Polymerization of Tin-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2002","124","","10062","10070","10.1021/ja020206v","","","0.71073","MoKα","","0.1774","0.0806","","","0.2218","0.244","","","","","","1.092","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115072","9.2052","0.0006","10.1306","0.0006","16.7175","0.0011","74.388","0.001","83.567","0.001","81.31","0.001","1480.05","0.16","100","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H50 Ni P2 -","- C31 H50 Ni P2 -","- C62 H100 Ni2 P4 -","2","1","","Daniel J. Mindiola; Gregory L. Hillhouse","Synthesis, Structure, and Reactions of a Three-Coordinate Nickel-Carbene Complex, {1,2-Bis(di-tert-butylphosphino)ethane}NiCPh2","Journal of the American Chemical Society","2002","124","","9976","9977","10.1021/ja0269183","","","0.71073","MoKα","","0.0436","0.0375","","","0.0982","0.1007","","","","","","1.002","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115073","26.4905","0.0012","26.4905","0.0012","20.5306","0.0013","90","","90","","120","","12477.1","1.1","100","2","373","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C22 H46 N2 Ni O2 P2 -","- C22 H46 N2 Ni O2 P2 -","- C396 H828 N36 Ni18 O36 P36 -","18","1","","Daniel J. Mindiola; Gregory L. Hillhouse","Synthesis, Structure, and Reactions of a Three-Coordinate Nickel-Carbene Complex, {1,2-Bis(di-tert-butylphosphino)ethane}NiCPh2","Journal of the American Chemical Society","2002","124","","9976","9977","10.1021/ja0269183","","","0.71073","MoKα","","0.0968","0.0914","","","0.2178","0.2219","","","","","","1.099","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115074","11.0813","0.0007","19.1413","0.0012","20.7297","0.0013","90","","94.054","0.001","90","","4386","0.5","100","2","373","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C49 H70 Ni O2 P2 -","- C49 H70 Ni O2 P2 -","- C196 H280 Ni4 O8 P8 -","4","1","","Daniel J. Mindiola; Gregory L. Hillhouse","Synthesis, Structure, and Reactions of a Three-Coordinate Nickel-Carbene Complex, {1,2-Bis(di-tert-butylphosphino)ethane}NiCPh2","Journal of the American Chemical Society","2002","124","","9976","9977","10.1021/ja0269183","","","0.71073","MoKα","","0.0818","0.0636","","","0.1634","0.1723","","","","","","1.073","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115075","28.5875","0.0018","16.3013","0.001","16.8591","0.0011","90","","120.309","0.001","90","","6782.7","0.7","100","2","373","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H50 Ni O2 P2 S -","- C31 H50 Ni O2 P2 S -","- C248 H400 Ni8 O16 P16 S8 -","8","1","","Daniel J. Mindiola; Gregory L. Hillhouse","Synthesis, Structure, and Reactions of a Three-Coordinate Nickel-Carbene Complex, {1,2-Bis(di-tert-butylphosphino)ethane}NiCPh2","Journal of the American Chemical Society","2002","124","","9976","9977","10.1021/ja0269183","","","0.71073","MoKα","","0.0563","0.0503","","","0.1338","0.1379","","","","","","1.087","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115076","11.294","0.002","18.588","0.004","16.301","0.003","90","","91.2","0.03","90","","3421.4","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H28 N2 O3 -","- C14 H28 N2 O3 -","- C112 H224 N16 O24 -","8","2","","Dan Yang; Yu-Hui Zhang; Nian-Yong Zhu","β2,2-Aminoxy Acids: A New Building Block for Turns and Helices","Journal of the American Chemical Society","2002","124","","9966","9967","10.1021/ja026966n","","","0.71069","MoKα","","0.0982","0.0573","","","0.14","0.1605","","","","","","0.896","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115077","5.765","0.0012","19.431","0.004","10.821","0.002","90","","99.26","0.03","90","","1196.4","0.4","301","2","301","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H39 N3 O5 -","- C21 H39 N3 O5 -","- C42 H78 N6 O10 -","2","1","","Dan Yang; Yu-Hui Zhang; Nian-Yong Zhu","β2,2-Aminoxy Acids: A New Building Block for Turns and Helices","Journal of the American Chemical Society","2002","124","","9966","9967","10.1021/ja026966n","","","0.71069","MoKα","","0.0556","0.0509","","","0.1478","0.152","","","","","","1.012","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115078","24.24","0.02","8.25","0.006","11.5","0.008","90","","91.38","0.01","90","","2299","3","293.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H12 Cu S12 -","- C16 H12 Cu S12 -","- C64 H48 Cu4 S48 -","4","0.5","","Hisashi Tanaka; Hayao Kobayashi; Akiko Kobayashi","A Conducting Crystal Based on A Single-Component Paramagnetic Molecule, [Cu(dmdt)2] (dmdt = Dimethyltetrathiafulvalenedithiolate)","Journal of the American Chemical Society","2002","124","","10002","10003","10.1021/ja027024l","","","0.7107","MoKα","","","0.0554","","","","0.0949","","","","","","0.924","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115079","14.198","0.002","18.045","0.003","13.036","0.002","106.539","0.002","92.307","0.002","110.798","0.003","2955.6","0.8","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H84 Cu N2 S12 -","- C48 H84 Cu N2 S12 -","- C96 H168 Cu2 N4 S24 -","2","1","","Hisashi Tanaka; Hayao Kobayashi; Akiko Kobayashi","A Conducting Crystal Based on A Single-Component Paramagnetic Molecule, [Cu(dmdt)2] (dmdt = Dimethyltetrathiafulvalenedithiolate)","Journal of the American Chemical Society","2002","124","","10002","10003","10.1021/ja027024l","","","0.7107","MoKα","","","0.0701","","","","0.0835","","","","","","1.913","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115080","9.8197","0.0004","10.9602","0.0005","19.5248","0.0008","81.884","0.001","88.318","0.001","66.148","0.001","1901.76","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H37 Cl P2 Ru -","- C48 H44 Cl P2 Ru -","- C96 H88 Cl2 P4 Ru2 -","2","1","","Masami Kamigaito; Yasuhiro Watanabe; Tsuyoshi Ando; Mitsuo Sawamoto","A New Ruthenium Complex with an Electron-Donating Aminoindenyl Ligand for Fast Metal-Mediated Living Radical Polymerizations","Journal of the American Chemical Society","2002","124","","9994","9995","10.1021/ja0270470","","","0.71073","MoKα","","0.0388","0.0364","","","0.0961","0.1002","","","","","","0.789","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115081","10.0011","0.0004","12.5728","0.0005","17.8807","0.0008","88.991","0.001","75.315","0.001","70.12","0.001","2039.48","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H42 Cl N P2 Ru -","- C48 H44 Cl3 N P2 Ru -","- C96 H88 Cl6 N2 P4 Ru2 -","2","1","","Masami Kamigaito; Yasuhiro Watanabe; Tsuyoshi Ando; Mitsuo Sawamoto","A New Ruthenium Complex with an Electron-Donating Aminoindenyl Ligand for Fast Metal-Mediated Living Radical Polymerizations","Journal of the American Chemical Society","2002","124","","9994","9995","10.1021/ja0270470","","","0.71073","MoKα","","0.0325","0.0285","","","0.0746","0.0793","","","","","","1.035","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115082","7.6096","0.0006","8.7046","0.0007","21.8164","0.0018","90","","90","","90","","1445.1","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H27 N O2 -","- C16 H27 N O2 -","- C64 H108 N4 O8 -","4","1","","Aaron Wrobleski; Kiran Sahasrabudhe; Jeffrey Aubé","Asymmetric Total Synthesis of Dendrobatid Alkaloid 251F","Journal of the American Chemical Society","2002","124","","9974","9975","10.1021/ja027113y","","","0.71073","MoKα","","0.0466","0.0419","","","0.1015","0.1047","","","","","","1.047","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115083","14.6173","0.0002","14.6257","0.0003","17.0537","0.0002","89.7437","0.0008","67.8568","0.001","78.8226","0.0006","3303.47","0.09","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C27.5 H48 Cl N5 O5.5 S Zn -","- C27.5 H48 Cl N5 O5.5 S Zn -","- C110 H192 Cl4 N20 O22 S4 Zn4 -","4","2","","Dewain K. Garner; Sarah B. Fitch; Lenore H. McAlexander; Lisa M. Bezold; Atta M. Arif; Lisa M. Berreau","Mononuclear Nitrogen/Sulfur-Ligated Zinc Methoxide and Hydroxide Complexes: Investigating Ligand Effects on the Hydrolytic Stability of Zinc Alkoxide Species","Journal of the American Chemical Society","2002","124","","9970","9971","10.1021/ja0271274","","","0.71073","MoKα","","0.0538","0.0365","","","0.0842","0.0931","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115084","10.415","0.0002","14.4189","0.0003","21.0052","0.0004","90","","103.71","0.0007","90","","3064.54","0.1","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H44 Cl N5 O5 S Zn -","- C26 H44 Cl N5 O5 S Zn -","- C104 H176 Cl4 N20 O20 S4 Zn4 -","4","1","","Dewain K. Garner; Sarah B. Fitch; Lenore H. McAlexander; Lisa M. Bezold; Atta M. Arif; Lisa M. Berreau","Mononuclear Nitrogen/Sulfur-Ligated Zinc Methoxide and Hydroxide Complexes: Investigating Ligand Effects on the Hydrolytic Stability of Zinc Alkoxide Species","Journal of the American Chemical Society","2002","124","","9970","9971","10.1021/ja0271274","","","0.71073","MoKα","","0.0617","0.0459","","","0.1142","0.1245","","","","","","1.031","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115085","14.0608","0.0012","13.8902","0.0012","19.0465","0.0016","90","","98.487","0.002","90","","3679.2","0.5","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H38 Cu2 N2 O20 S4 -","- C24 H36 Cu2 N2 O20 S4 -","- C96 H144 Cu8 N8 O80 S16 -","4","1","","Heba Abourahma; Brian Moulton; Victor Kravtsov; Michael J. Zaworotko","Supramolecular Isomerism in Coordination Compounds: Nanoscale Molecular Hexagons and Chains","Journal of the American Chemical Society","2002","124","","9990","9991","10.1021/ja027371v","","","0.71073","MoKα","","0.0799","0.0512","","","0.1072","0.1176","","","","","","0.964","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115086","35.023","0.004","35.023","0.004","9.9711","0.0013","90","","90","","120","","10592","2","200","2","200","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C41 H40 Cu N6 O9 S0.08 -","- C17.25 H15.75 Cu1.5 N1.5 O15 S1.5 -","- C207 H189 Cu18 N18 O180 S18 -","12","1.33333","","Heba Abourahma; Brian Moulton; Victor Kravtsov; Michael J. Zaworotko","Supramolecular Isomerism in Coordination Compounds: Nanoscale Molecular Hexagons and Chains","Journal of the American Chemical Society","2002","124","","9990","9991","10.1021/ja027371v","","","0.71073","MoKα","","0.121","0.095","","","0.2176","0.2357","","","","","","0.992","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115087","8.231","0.0012","9.6048","0.0012","17.243","0.002","75.61","0.01","78.168","0.01","64.983","0.01","1188.8","0.3","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H22 Cl2 O4 -","- C27 H22 Cl2 O4 -","- C54 H44 Cl4 O8 -","2","1","","Udo Verkerk; Megumi Fujita; Trevor L. Dzwiniel; Robert McDonald; Jeffrey M. Stryker","Tetrakis(2-hydroxyphenyl)ethene and Derivatives. A Structurally Preorganized Tetradentate Ligand System for Polymetallic Coordination Chemistry and Catalysis","Journal of the American Chemical Society","2002","124","","9988","9989","10.1021/ja027436u","","","1.54178","CuKa","","0.1162","0.0831","","0.2511","0.21","","","","1.046","1.132","1.132","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115088","12.981","0.0015","12.9035","0.0015","17.957","0.002","90","","101.965","0.002","90","","2942.5","0.6","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H35 Mo O4.5 -","- C38 H35 Mo O4.5 -","- C152 H140 Mo4 O18 -","4","1","","Udo Verkerk; Megumi Fujita; Trevor L. Dzwiniel; Robert McDonald; Jeffrey M. Stryker","Tetrakis(2-hydroxyphenyl)ethene and Derivatives. A Structurally Preorganized Tetradentate Ligand System for Polymetallic Coordination Chemistry and Catalysis","Journal of the American Chemical Society","2002","124","","9988","9989","10.1021/ja027436u","","","0.71073","MoKα","","0.0851","0.0591","","","0.144","0.1576","","","","","","1.03","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115089","12.7113","0.0005","17.9077","0.0007","20.9008","0.0009","78.881","0.003","74.132","0.003","83.404","0.003","4480.7","0.3","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C45.5 H60 Al4 O4 -","- C45.5 H56 Al4 O4 -","- C182 H224 Al16 O16 -","4","2","","Udo Verkerk; Megumi Fujita; Trevor L. Dzwiniel; Robert McDonald; Jeffrey M. Stryker","Tetrakis(2-hydroxyphenyl)ethene and Derivatives. A Structurally Preorganized Tetradentate Ligand System for Polymetallic Coordination Chemistry and Catalysis","Journal of the American Chemical Society","2002","124","","9988","9989","10.1021/ja027436u","","","1.54178","CuKa","","0.1129","0.0858","","0.2456","0.215","","","","1.049","1.079","1.079","","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115090","9.9804","0.0016","10.1025","0.0016","10.7724","0.0018","90","","107.403","0.003","90","","1036.4","0.3","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 B F3 O2 -","- C10 H10 B F3 O2 -","- C40 H40 B4 F12 O8 -","4","1","","Do Hyun Ryu; Thomas W. Lee; E. J. Corey","Broad-Spectrum Enantioselective Diels-Alder Catalysis by Chiral, Cationic Oxazaborolidines","Journal of the American Chemical Society","2002","124","","9992","9993","10.1021/ja027468h","","","0.71073","MoKα","","0.0531","0.0473","","","0.1361","0.142","","","","","","1.065","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115091","7.4487","0.0017","17.747","0.004","7.8625","0.0018","90","","104.66","0.005","90","","1005.5","0.4","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 B F3 O -","- C10 H10 B F3 O -","- C40 H40 B4 F12 O4 -","4","1","","Do Hyun Ryu; Thomas W. Lee; E. J. Corey","Broad-Spectrum Enantioselective Diels-Alder Catalysis by Chiral, Cationic Oxazaborolidines","Journal of the American Chemical Society","2002","124","","9992","9993","10.1021/ja027468h","","","0.71073","MoKα","","0.0628","0.0382","","","0.0936","0.0992","","","","","","1.062","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115092","9.777","0.0012","10.1641","0.0012","11.5487","0.0014","112.035","0.002","93.937","0.002","115.123","0.002","927","0.2","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 B Cl2 F3 O -","- C18 H16 B Cl2 F3 O -","- C36 H32 B2 Cl4 F6 O2 -","2","1","","Do Hyun Ryu; Thomas W. Lee; E. J. Corey","Broad-Spectrum Enantioselective Diels-Alder Catalysis by Chiral, Cationic Oxazaborolidines","Journal of the American Chemical Society","2002","124","","9992","9993","10.1021/ja027468h","","","0.71073","MoKα","","0.0874","0.0741","","","0.1549","0.1625","","","","","","1.13","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115093","15.265","0.002","15.265","0.002","24.461","0.005","90","","90","","120","","4936.3","1.4","293","2","293","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- K6 Na6 O92 Sb2 W18 Zn3 -","- K6 Na6 O92 Sb2 W18 Zn3 -","- K12 Na12 O184 Sb4 W36 Zn6 -","2","0.0833333","","Dirk Volkmer; Björn Bredenkötter; Jörg Tellenbröker; Paul Kögerler; Dirk G. Kurth; Pit Lehmann; Heimo Schnablegger; Dietmar Schwahn; Markus Piepenbrink; Bernt Krebs","Structure and Properties of the Dendron-Encapsulated Polyoxometalate (C52H60NO12)12[(Mn(H2O))3(SbW9O33)2], a First Generation Dendrizyme","Journal of the American Chemical Society","2002","124","","10489","10496","10.1021/ja017613b","","","0.71073","MoKα","","0.0512","0.0488","","","0.1278","0.1294","","","","","","1.227","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115094","14.7937","0.0006","17.889","0.0007","18.2308","0.0008","87.653","0.002","71.1","0.002","83.745","0.002","4537.3","0.3","117","2","117","2","","","","","","","synthetic","5","P -1","-P 1","2","","","","- C94 H62 Br8 N8 O16 -","- C94 H62 Br8 N8 O16 -","- C188 H124 Br16 N16 O32 -","2","1","","Patrick Amrhein; Alexander Shivanyuk; Darren W. Johnson; Julius Rebek","Metal-Switching and Self-Inclusion of Functional Cavitands","Journal of the American Chemical Society","2002","124","","10349","10358","10.1021/ja0204269","","","1.5418","CuKα","","0.1145","0.1012","","","0.2716","0.2815","","","","","","1.041","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115095","19.817","0.004","29.334","0.006","17.757","0.004","90","","102.94","0.03","90","","10060","4","119","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C94.25 H48 N8 O25.6 P2 -","- C94.28 H48 N8 O25.6 P2 -","- C377.12 H192 N32 O102.4 P8 -","4","0.5","","Patrick Amrhein; Alexander Shivanyuk; Darren W. Johnson; Julius Rebek","Metal-Switching and Self-Inclusion of Functional Cavitands","Journal of the American Chemical Society","2002","124","","10349","10358","10.1021/ja0204269","","","1.5418","CuKα","","0.1515","0.1418","","","0.4085","0.4256","","","","","","2.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115096","10.7288","0.0006","11.5841","0.0006","23.331","0.002","90","","95.678","0.002","90","","2885.4","0.3","193","2","193","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C25 H31 Br2 N O8 S -","- C25 H31 Br2 N O8 S -","- C100 H124 Br8 N4 O32 S4 -","4","2","","Bernhard J. Paul; Jerremey Willis; Theodore A. Martinot; Ion Ghiviriga; Khalil A. Abboud; Tomas Hudlicky","Synthesis, Structure, and Biological Evaluation of Novel N- and O-Linked Diinositols","Journal of the American Chemical Society","2002","124","","10416","10426","10.1021/ja0205378","","","0.71073","MoKα","","0.1237","0.0437","","","0.0561","0.0683","","","","","","0.814","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115097","13.397","0.001","13.501","0.001","14.046","0.001","70.564","0.001","63.203","0.001","82.918","0.001","2137.4","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","1","","","- C48 H60 N2 Na O6 Ta -","- C48 H60 N2 Na O6 Ta -","- C96 H120 N4 Na2 O12 Ta2 -","2","1","","William W. Brennessel; John E. Ellis; Marie K. Pomije; Victor J. Sussman; Eugenijus Urnezius; Victor G. Young","Tris(η4-naphthalene)- and Tris(1-4-η4-anthracene)tantalate(1-): First Homoleptic Arene Complexes of Anionic Tantalum1","Journal of the American Chemical Society","2002","124","","10258","10259","10.1021/ja020725y","","","0.71073","MoKα","","0.0517","0.0361","","","0.0676","0.0719","","","","","","0.992","","","","has coordinates,has disorder","178921","2020-10-21","18:00:00",""
"4115098","13.361","0.006","14.95","0.006","15.172","0.007","118.511","0.006","105.512","0.007","95.155","0.007","2479.9","1.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","2","","","- C60 H66 N2 Na O6 Ta -","- C60 H66 N2 Na O6 Ta -","- C120 H132 N4 Na2 O12 Ta2 -","2","1","","William W. Brennessel; John E. Ellis; Marie K. Pomije; Victor J. Sussman; Eugenijus Urnezius; Victor G. Young","Tris(η4-naphthalene)- and Tris(1-4-η4-anthracene)tantalate(1-): First Homoleptic Arene Complexes of Anionic Tantalum1","Journal of the American Chemical Society","2002","124","","10258","10259","10.1021/ja020725y","","","0.71073","MoKα","","0.066","0.047","","","0.1051","0.1133","","","","","","1.016","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115099","12.383","0.002","16.693","0.002","19.026","0.002","90","","94.706","0.002","90","","3919.6","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","3","","","- C42 H60 N2 Na O6 Ta -","- C42 H60 N2 Na O6 Ta -","- C168 H240 N8 Na4 O24 Ta4 -","4","1","","William W. Brennessel; John E. Ellis; Marie K. Pomije; Victor J. Sussman; Eugenijus Urnezius; Victor G. Young","Tris(η4-naphthalene)- and Tris(1-4-η4-anthracene)tantalate(1-): First Homoleptic Arene Complexes of Anionic Tantalum1","Journal of the American Chemical Society","2002","124","","10258","10259","10.1021/ja020725y","","","0.71073","MoKα","","0.0614","0.0377","","","0.0787","0.0829","","","","","","0.978","","","","has coordinates","178921","2020-10-21","18:00:00",""
"4115100","24.597","0.006","24.597","0.006","44.088","0.015","90","","90","","90","","26674","13","293","2","293","2","","","","","","","","2","I 41/a :2","-I 4ad","88","UCR-15","","","- In44 S72 -","- In44 S72 -","- In176 S288 -","4","0.25","","Cheng Wang; Xianhui Bu; Nanfeng Zheng; Pingyun Feng","Nanocluster with One Missing Core Atom: A Three-Dimensional Hybrid Superlattice Built from Dual-Sized Supertetrahedral Clusters","Journal of the American Chemical Society","2002","124","","10268","10269","10.1021/ja020735z","","","0.71073","MoKα","","0.1887","0.0769","","","0.2082","0.2517","","","","","","1.062","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115101","21.277","0.001","7.3744","0.0004","10.5498","0.0006","90","","94.884","0.002","90","","1649.31","0.15","160","1","160","1","","","","","","","","3","C 1 2 1","C 2y","5","","(1R)-2-exo-[(1S,2R,3S,4R)-3-methyl-bicyclo[2.2.1]hept-5-en-2- ylcarbonyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol","","- C19 H28 O2 -","- C19 H28 O2 -","- C76 H112 O8 -","4","1","","Claudio Palomo; Mikel Oiarbide; Jesús M. García; Alberto González; Ainara Lecumberri; Anthony Linden","A Chiral Acrylate Equivalent for Metal-Free Diels-Alder Reactions: endo-2-Acryloylisoborneol","Journal of the American Chemical Society","2002","124","","10288","10289","10.1021/ja025906e","","","0.71073","MoKα","","0.0754","0.0457","","0.0466","0.043","0.043","","","1.551","","","1.684","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115102","10.524","0.0002","7.1324","0.0002","20.2579","0.0005","90","","90.699","0.001","90","","1520.47","0.06","160","1","160","1","","","","","","","","3","P 1 21 1","P 2yb","4","","(1R)-2-endo-[(1R,2R,4R)-bicyclo[2.2.1]hept-5-en-2-ylcarbonyl]-1,7,7- trimethylbicyclo[2.2.1]heptan-2-ol","","- C18 H26 O2 -","- C18 H26 O2 -","- C72 H104 O8 -","4","2","","Palomo, Claudio; Oiarbide, Mikel; García, Jesús M.; González, Alberto; Lecumberri, Ainara; Linden, Anthony","A Chiral Acrylate Equivalent for Metal-Free Diels-Alder Reactions: endo-2-Acryloylisoborneol","Journal of the American Chemical Society","2002","124","","10288","10289","10.1021/ja025906e","","","0.71073","MoKα","","0.0551","0.0453","","0.047","0.0462","0.0462","","","2.393","","","2.517","","","","has coordinates","209437","2020-10-21","18:00:00",""
"4115103","10.4081","0.0004","7.2528","0.0004","20.396","0.001","90","","96.562","0.002","90","","1529.56","0.13","160","1","160","1","","","","","","","","3","P 1 21 1","P 2yb","4","(1R)-2-exo-[(1S,2R,4S)-bicyclo[2.2.1]hept-5-en-2-ylcarbonyl]-1,7,7- trimethylbicyclo[2.2.1]heptan-2-ol","","","- C18 H26 O2 -","- C18 H26 O2 -","- C72 H104 O8 -","4","2","","Claudio Palomo; Mikel Oiarbide; Jesús M. García; Alberto González; Ainara Lecumberri; Anthony Linden","A Chiral Acrylate Equivalent for Metal-Free Diels-Alder Reactions: endo-2-Acryloylisoborneol","Journal of the American Chemical Society","2002","124","","10288","10289","10.1021/ja025906e","","","0.71073","MoKα","","0.088","0.0606","","0.0626","0.0596","0.0596","","","2.088","","","2.246","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115104","10.8142","0.0001","7.4436","0.0001","10.9707","0.0002","90","","109.102","0.0005","90","","834.48","0.02","160","1","160","1","","","","","","","","3","P 1 21 1","P 2yb","4","","(1R)-2-endo-[(1R,2R,3S,4S)-3-methyl-bicyclo[2.2.1]hept-5-en-2- ylcarbonyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol","","- C19 H28 O2 -","- C19 H28 O2 -","- C38 H56 O4 -","2","1","","Claudio Palomo; Mikel Oiarbide; Jesús M. García; Alberto González; Ainara Lecumberri; Anthony Linden","A Chiral Acrylate Equivalent for Metal-Free Diels-Alder Reactions: endo-2-Acryloylisoborneol","Journal of the American Chemical Society","2002","124","","10288","10289","10.1021/ja025906e","","","0.71073","MoKα","","0.0516","0.0413","","0.0422","0.0411","0.0411","","","2.002","","","2.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115105","7.4939","0.0004","13.3721","0.0012","15.766","0.0009","90","","103.781","0.005","90","","1534.42","0.19","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 N O2 -","- C16 H23 N O2 -","- C64 H92 N4 O8 -","4","1","","Ramon Rios; Ciril Jimeno; Patrick J. Carroll; Patrick J. Walsh","Kinetic Resolution of Atropisomeric Amides","Journal of the American Chemical Society","2002","124","","10272","10273","10.1021/ja026436r","","","0.71069","MoKα","","0.0989","0.0897","","0.2134","0.207","","","","1.198","1.238","1.238","","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115106","10.3976","0.0002","8.2455","0.0003","18.8852","0.0005","90","","94.255","0.002","90","","1614.63","0.08","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 N O4 -","- C16 H25 N O4 -","- C64 H100 N4 O16 -","4","1","","Ramon Rios; Ciril Jimeno; Patrick J. Carroll; Patrick J. Walsh","Kinetic Resolution of Atropisomeric Amides","Journal of the American Chemical Society","2002","124","","10272","10273","10.1021/ja026436r","","","0.71069","MoKα","","0.0509","0.0467","","0.1146","0.1116","","","","1.098","1.113","1.113","","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115107","11.649","0.0006","26.0118","0.0011","16.281","0.009","90","","105.335","0.003","90","","4758","3","183.2","","183.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H51 B F4 Ir N3 P2 -","- C53 H51 B F4 Ir N3 P2 -","- C212 H204 B4 F16 Ir4 N12 P8 -","4","1","","Stephan Gründemann; Anes Kovacevic; Martin Albrecht; Jack W. Faller; Robert H. Crabtree","Abnormal Ligand Binding and Reversible Ring Hydrogenation in the Reaction of Imidazolium Salts with IrH5(PPh3)2","Journal of the American Chemical Society","2002","124","","10473","10481","10.1021/ja026735g","","","0.7107","MoKα","","0.1423","0.033","","0.071","","0.033","","","0.913","","","0.75","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115108","14.101","0.0006","14.2829","0.0007","14.4166","0.0005","79.144","0.003","64.676","0.003","88.336","0.003","2573.2","0.2","183.2","","183.2","","","","","","","","","8","P -1","-P 1","2","","","","- C55 H52 B Cl3 F4 Ir N3 P2 -","- C55 H52 B Cl3 F4 Ir N3 P2 -","- C110 H104 B2 Cl6 F8 Ir2 N6 P4 -","2","1","","Stephan Gründemann; Anes Kovacevic; Martin Albrecht; Jack W. Faller; Robert H. Crabtree","Abnormal Ligand Binding and Reversible Ring Hydrogenation in the Reaction of Imidazolium Salts with IrH5(PPh3)2","Journal of the American Chemical Society","2002","124","","10473","10481","10.1021/ja026735g","","","0.7107","MoKα","","0.0382","0.038","","0.046","","0.046","","","1.182","","","1.18","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115109","9.4493","0.0002","20.6687","0.0006","22.0865","0.0006","90","","90.16","0.002","90","","4313.58","0.19","183.2","","183.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H47 B F4 Ir N3 P2 -","- C48 H47 B F4 Ir N3 P2 -","- C192 H188 B4 F16 Ir4 N12 P8 -","4","1","","Stephan Gründemann; Anes Kovacevic; Martin Albrecht; Jack W. Faller; Robert H. Crabtree","Abnormal Ligand Binding and Reversible Ring Hydrogenation in the Reaction of Imidazolium Salts with IrH5(PPh3)2","Journal of the American Chemical Society","2002","124","","10473","10481","10.1021/ja026735g","","","0.7107","MoKα","","0.0773","0.033","","0.05","","0.035","","","0.905","","","0.88","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115110","10.7855","0.0004","22.7449","0.0011","11.3115","0.0004","90","","101.571","0.003","90","","2718.49","0.19","183.2","","183.2","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C53 H49 B Cl6 F4 Ir N3 P2 -","- C53 H49 B Cl6 F4 Ir N3 P2 -","- C106 H98 B2 Cl12 F8 Ir2 N6 P4 -","2","0.5","","Stephan Gründemann; Anes Kovacevic; Martin Albrecht; Jack W. Faller; Robert H. Crabtree","Abnormal Ligand Binding and Reversible Ring Hydrogenation in the Reaction of Imidazolium Salts with IrH5(PPh3)2","Journal of the American Chemical Society","2002","124","","10473","10481","10.1021/ja026735g","","","0.7107","MoKα","","0.0389","0.039","","0.041","","0.041","","","1.01","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115111","8.782","0.0003","15.8777","0.0006","19.9676","0.0008","71.202","0.001","80.106","0.001","88.804","0.001","2594.75","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H43 B3 O2 Ru2 -","- C24 H43 B3 O2 Ru2 -","- C96 H172 B12 O8 Ru8 -","4","2","","Hong Yan; Alicia M. Beatty; Thomas P. Fehlner","Facile Hydrometalation of Alkynes by nido-1,2-(Cp*RuH)2B3H7 Yielding Novel Ru-B Edge-Bridging Alkylidenes. Stepwise Conversion of HC\τbCC(O)OMe into nido-1,2-(Cp*RuH)2-3-HOB-4-MeC-5-MeOC-BH3, Cp* = η5-C5Me5","Journal of the American Chemical Society","2002","124","","10280","10281","10.1021/ja026738t","","","0.71073","MoKα","","0.0289","0.0254","","","0.0606","0.0624","","","","","","1.032","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115112","8.8737","0.0005","17.6413","0.0009","33.5339","0.0018","90","","90","","90","","5249.5","0.5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H43 B3 O2 Ru2 -","- C24 H43 B3 O2 Ru2 -","- C192 H344 B24 O16 Ru16 -","8","1","","Hong Yan; Alicia M. Beatty; Thomas P. Fehlner","Facile Hydrometalation of Alkynes by nido-1,2-(Cp*RuH)2B3H7 Yielding Novel Ru-B Edge-Bridging Alkylidenes. Stepwise Conversion of HC\τbCC(O)OMe into nido-1,2-(Cp*RuH)2-3-HOB-4-MeC-5-MeOC-BH3, Cp* = η5-C5Me5","Journal of the American Chemical Society","2002","124","","10280","10281","10.1021/ja026738t","","","0.71073","MoKα","","0.0311","0.0304","","","0.0751","0.0756","","","","","","1.103","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115113","11.4297","0.0007","14.8019","0.0009","15.4447","0.0009","90","","93.053","0.001","90","","2609.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H43 B3 O2 Ru2 -","- C24 H43 B3 O2 Ru2 -","- C96 H172 B12 O8 Ru8 -","4","1","","Hong Yan; Alicia M. Beatty; Thomas P. Fehlner","Facile Hydrometalation of Alkynes by nido-1,2-(Cp*RuH)2B3H7 Yielding Novel Ru-B Edge-Bridging Alkylidenes. Stepwise Conversion of HC\τbCC(O)OMe into nido-1,2-(Cp*RuH)2-3-HOB-4-MeC-5-MeOC-BH3, Cp* = η5-C5Me5","Journal of the American Chemical Society","2002","124","","10280","10281","10.1021/ja026738t","","","0.71073","MoKα","","0.0449","0.0337","","","0.0804","0.084","","","","","","1.001","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115114","8.508","0.0004","13.903","0.0006","21.8889","0.0009","90","","92.213","0.001","90","","2587.2","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H42 B2 O2 Ru2 -","- C24 H42 B2 O2 Ru2 -","- C96 H168 B8 O8 Ru8 -","4","1","","Hong Yan; Alicia M. Beatty; Thomas P. Fehlner","Facile Hydrometalation of Alkynes by nido-1,2-(Cp*RuH)2B3H7 Yielding Novel Ru-B Edge-Bridging Alkylidenes. Stepwise Conversion of HC\τbCC(O)OMe into nido-1,2-(Cp*RuH)2-3-HOB-4-MeC-5-MeOC-BH3, Cp* = η5-C5Me5","Journal of the American Chemical Society","2002","124","","10280","10281","10.1021/ja026738t","","","0.71073","MoKα","","0.0304","0.0268","","","0.0642","0.066","","","","","","1.056","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115115","6.9799","0.001","9.5144","0.0013","12.3951","0.0018","105.365","0.002","97.975","0.002","103.545","0.003","753.74","0.19","193","2","193","2","","","","","","","","6","P -1","-P 1","2","Au2{S2P(OMe)2}2","","","- C4 H12 Au2 O4 P2 S4 -","- C4 H12 Au2 O4 P2 S4 -","- C8 H24 Au4 O8 P4 S8 -","2","1","","Young-A Lee; James E. McGarrah; Rene J. Lachicotte; Richard Eisenberg","Multiple Emissions and Brilliant White Luminescence from Gold(I) O,O'-Di(alkyl)dithiophosphate Dimers","Journal of the American Chemical Society","2002","124","","10662","10663","10.1021/ja0267876","","","0.71073","MoKα","","0.0677","0.0652","","","0.1785","0.181","","","","","","1.2","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115116","8.3143","0.0007","9.4747","0.0008","24.851","0.002","100.182","0.002","90.635","0.002","95.133","0.002","1918.4","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","Au2{S2P(OEt)2}2","","","- C16 H40 Au4 O8 P4 S8 -","- C16 H40 Au4 O8 P4 S8 -","- C32 H80 Au8 O16 P8 S16 -","2","1","","Young-A Lee; James E. McGarrah; Rene J. Lachicotte; Richard Eisenberg","Multiple Emissions and Brilliant White Luminescence from Gold(I) O,O'-Di(alkyl)dithiophosphate Dimers","Journal of the American Chemical Society","2002","124","","10662","10663","10.1021/ja0267876","","","0.71073","MoKα","","0.0737","0.0696","","","0.1747","0.1773","","","","","","1.17","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115117","20.183","0.0004","20.183","0.0004","4.459","0.0001","90","","90","","90","","1816.39","0.07","200","2","200","2","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- C6 H6 Te2 -","- C7 H6 Te2 -","- C56 H48 Te16 -","8","0.5","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.0777","0.0454","","","0.0976","0.1176","","","","","","1.091","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115118","20.559","0.0002","20.559","0.0002","9.9385","0.0002","90","","90","","120","","3637.94","0.09","200","2","200","2","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","","","- C18 H24 S6 -","- C21 H24 S6 -","- C126 H144 S36 -","6","0.333333","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.0315","0.028","","","0.0838","0.0865","","","","","","1.219","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115119","24.0134","0.0001","24.0134","0.0001","9.8698","0.0001","90","","90","","120","","4928.86","0.06","200","2","200","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C27 H30 S6 -","- C32.09 H30 S6 -","- C192.54 H180 S36 -","6","0.333333","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.0662","0.0379","","","0.0928","0.1031","","","","","","1.031","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115120","9.6703","0.0001","14.3531","0.0001","14.6377","0.0002","114.018","0.001","102.792","0.001","102.077","0.001","1704.47","0.04","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H38 S6 -","- C34 H38 S6 -","- C68 H76 S12 -","2","1","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.0887","0.0531","","","0.1307","0.1453","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115121","24.0399","0.0006","24.0399","0.0006","10.2535","0.0004","90","","90","","120","","5131.8","0.3","200","2","200","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C27 H30 Se6 -","- C33.39 H30 Se6 -","- C200.34 H180 Se36 -","6","0.333333","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.0589","0.0337","","","0.0786","0.087","","","","","","1.029","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115122","9.8742","0.0002","14.3502","0.0004","14.4637","0.0004","111.956","0.001","102.84","0.001","103.67","0.001","1733.81","0.08","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H38 Se6 -","- C34 H38 Se6 -","- C68 H76 Se12 -","2","1","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.1182","0.0735","","","0.1843","0.2088","","","","","","1.025","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115123","24.5349","0.0005","24.5349","0.0005","10.0177","0.0003","90","","90","","120","","5222.4","0.2","200","2","200","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C33 H35 Cl Se6 -","- C32.94 H34.95 Cl0.99 Se6 -","- C197.64 H209.7 Cl5.94 Se36 -","6","0.333333","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.0467","0.0318","","","0.0811","0.0872","","","","","","1.071","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115124","9.7177","0.0005","14.7028","0.0008","14.9561","0.0008","114.526","0.002","103.21","0.001","101.399","0.001","1786.45","0.17","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C35 H40 Se6 -","- C35 H40 Se6 -","- C70 H80 Se12 -","2","1","","Daniel B. Werz; Rolf Gleiter; Frank Rominger","Nanotube Formation Favored by Chalcogen-Chalcogen Interactions","Journal of the American Chemical Society","2002","124","","10638","10639","10.1021/ja027146d","","","0.71073","MoKα","","0.1158","0.049","","","0.0743","0.0897","","","","","","0.959","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115125","26.0198","0.0019","26.0198","0.0019","40.147","0.006","90","","90","","120","","23539","4","173","2","173","2","","","","","","","Elizabeth Lewis","7","R -3 :H","-R 3","148","02148","L1Cu(O)2CuL2","","- C37 H59 Cu2 F3 N4 O5 S -","- C37 H59 Cu2 F3 N4 O5 S -","- C666 H1062 Cu36 F54 N72 O90 S18 -","18","1","","Nermeen W. Aboelella; Elizabeth A. Lewis; Anne M. Reynolds; William W. Brennessel; Christopher J. Cramer; William B. Tolman","Snapshots of Dioxygen Activation by Copper: The Structure of a 1:1 Cu/O2 Adduct and Its Use in Syntheses of Asymmetric Bis(μ-oxo) Complexes","Journal of the American Chemical Society","2002","124","","10660","10661","10.1021/ja027164v","","","0.71073","MoKα","","0.065","0.0409","","","0.0982","0.1049","","","","","","0.973","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115126","15.464","0.004","17.324","0.004","8.763","0.002","90","","90","","90","","2347.6","1","173","2","173","2","","","","","","","Nermeen W. Aboelella","5","I m m 2","I 2 -2","44","02073","(tbu)2LiPrCu(O2)","","- C47 H77 Cu N2 O5 -","- C35 H55 Cu N2 O2 -","- C70 H110 Cu2 N4 O4 -","2","0.25","","Nermeen W. Aboelella; Elizabeth A. Lewis; Anne M. Reynolds; William W. Brennessel; Christopher J. Cramer; William B. Tolman","Snapshots of Dioxygen Activation by Copper: The Structure of a 1:1 Cu/O2 Adduct and Its Use in Syntheses of Asymmetric Bis(μ-oxo) Complexes","Journal of the American Chemical Society","2002","124","","10660","10661","10.1021/ja027164v","","","0.71073","MoKα","","0.1083","0.0867","","","0.1853","0.1988","","","","","","1.016","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115127","18.299","0.003","24.192","0.004","23.679","0.004","90","","110.002","0.003","90","","9850","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C91 H101 Cl16 N10 O14 -","- C90.999 H101 Cl16 N10 O14 -","- C363.996 H404 Cl64 N40 O56 -","4","1","","Jerry L. Atwood; Agnieszka Szumna","Hydrogen Bonds Seal Single-Molecule Capsules","Journal of the American Chemical Society","2002","124","","10646","10647","10.1021/ja027191l","","","0.71073","MoKα","","0.129","0.0694","","","0.1857","0.2286","","","","","","1.028","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115128","13.171","0.002","20.108","0.003","15.371","0.002","90","","100.137","0.003","90","","4007.3","1","173","2","173","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C82 H100 Cl2.39 N9 O14 -","- C82 H100 Cl2.29 N9 O14 -","- C164 H200 Cl4.58 N18 O28 -","2","0.5","","Jerry L. Atwood; Agnieszka Szumna","Hydrogen Bonds Seal Single-Molecule Capsules","Journal of the American Chemical Society","2002","124","","10646","10647","10.1021/ja027191l","","","0.71073","MoKα","","0.1799","0.0926","","","0.2594","0.3359","","","","","","1.037","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115129","9.912","0.004","7.252","0.002","13.582","0.004","90","","114.32","0.05","90","1","889.7","0.6","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N2 O4 -","- C20 H18 N2 O4 -","- C40 H36 N4 O8 -","2","0.5","","Tram Hoang; Joseph W. Lauher; Frank W. Fowler","The Topochemical 1,6-Polymerization of a Triene","Journal of the American Chemical Society","2002","124","","10656","10657","10.1021/ja027444a","","","","","","0.0712","0.071","","0.0519","","0.052","","","2.401","","","2.4","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4115130","11.183","0.004","7.204","0.002","11.683","0.004","90","","113.89","0.02","90","","860.6","0.5","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N2 O4 -","- C20 H18 N2 O4 -","- C40 H36 N4 O8 -","2","0.5","","Tram Hoang; Joseph W. Lauher; Frank W. Fowler","The Topochemical 1,6-Polymerization of a Triene","Journal of the American Chemical Society","2002","124","","10656","10657","10.1021/ja027444a","","","","","","0.0874","0.087","","0.0477","","0.048","","","3.121","","","3.12","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4115131","8.9122","0.0019","17.462","0.002","14.988","0.002","90","","97.694","0.015","90","","2311.5","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H28 F12 N5 Ni O P2 -","- C13 H26 F12 N5 Ni O P2 -","- C52 H104 F48 N20 Ni4 O4 P8 -","4","1","","Myunghyun Paik Suh; Jung Woo Ko; Hye Jin Choi","A Metal-Organic Bilayer Open Framework with a Dynamic Component: Single-Crystal-to-Single-Crystal Transformations","Journal of the American Chemical Society","2002","124","","10976","10977","10.1021/ja017560y","","","0.71073","MoKα","","0.1164","0.0776","","","0.1876","0.2064","","","","","","0.927","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115132","16.505","","19.945","0.001","20.664","0.001","73.003","0.001","68.24","0.001","76.073","0.003","5974.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H135 N18 Ni3 O30 -","- C72 H99 N18 Ni3 O30 -","- C144 H198 N36 Ni6 O60 -","2","1","","Myunghyun Paik Suh; Jung Woo Ko; Hye Jin Choi","A Metal-Organic Bilayer Open Framework with a Dynamic Component: Single-Crystal-to-Single-Crystal Transformations","Journal of the American Chemical Society","2002","124","","10976","10977","10.1021/ja017560y","","","0.71073","MoKα","","0.2077","0.0899","","","0.2488","0.3034","","","","","","0.943","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115133","16.42","0.001","19.817","0.002","20.439","0.002","70.322","0.004","68.554","0.005","76.193","0.005","5777.9","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H114 N15 Ni3 O27 -","- C57 H84 N15 Ni3 O27 -","- C114 H168 N30 Ni6 O54 -","2","1","","Myunghyun Paik Suh; Jung Woo Ko; Hye Jin Choi","A Metal-Organic Bilayer Open Framework with a Dynamic Component: Single-Crystal-to-Single-Crystal Transformations","Journal of the American Chemical Society","2002","124","","10976","10977","10.1021/ja017560y","","","0.71073","MoKα","","0.3566","0.1839","","","0.4194","0.5211","","","","","","1.304","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115134","12.382","0.002","16.375","0.003","19.952","0.004","74.505","0.007","89.255","0.009","84.184","0.005","3877.9","1.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C114 H184 N30 Ni6 O28 -","- C114 H166 N30 Ni6 O28 -","- C114 H166 N30 Ni6 O28 -","1","1","","Myunghyun Paik Suh; Jung Woo Ko; Hye Jin Choi","A Metal-Organic Bilayer Open Framework with a Dynamic Component: Single-Crystal-to-Single-Crystal Transformations","Journal of the American Chemical Society","2002","124","","10976","10977","10.1021/ja017560y","","","0.71073","MoKα","","0.2965","0.1491","","","0.3791","0.4548","","","","","","1.299","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115135","16.467","","20.134","0.001","20.72","0.001","72.532","0.001","67.939","0.001","75.042","0.002","5990.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C107 H141 N25 Ni3 O15 -","- C107 H135 N25 Ni3 O15 -","- C214 H270 N50 Ni6 O30 -","2","1","","Myunghyun Paik Suh; Jung Woo Ko; Hye Jin Choi","A Metal-Organic Bilayer Open Framework with a Dynamic Component: Single-Crystal-to-Single-Crystal Transformations","Journal of the American Chemical Society","2002","124","","10976","10977","10.1021/ja017560y","","","0.71073","MoKα","","0.2819","0.1279","","","0.3551","0.4201","","","","","","1.108","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115136","16.46","0.005","19.849","0.005","20.419","0.005","70.498","0.005","71.084","0.005","76.297","0.005","5887","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C99 H145 N15 Ni3 O21.5 -","- C99 H126 N15 Ni3 O21.5 -","- C198 H252 N30 Ni6 O43 -","2","1","","Myunghyun Paik Suh; Jung Woo Ko; Hye Jin Choi","A Metal-Organic Bilayer Open Framework with a Dynamic Component: Single-Crystal-to-Single-Crystal Transformations","Journal of the American Chemical Society","2002","124","","10976","10977","10.1021/ja017560y","","","0.71073","MoKα","","0.4091","0.1299","","","0.3464","0.4543","","","","","","0.943","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115137","16.65","0.001","8.338","0.001","10.177","0.001","90","","101.84","0.01","90","","1382.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4b-Hydroxy-4b,6,7,8,10,11-hexahydro-5H-8,11a-diaza- cyclonona[a]indene-9,12-dione, C14 H16 N2 O3","","- C14 H18 N2 O4 -","- C14 H18 N2 O4 -","- C56 H72 N8 O16 -","4","1","","Axel G. Griesbeck; Thomas Heinrich; Michael Oelgemöller; Johann Lex; Arne Molis","A Photochemical Route for Efficient Cyclopeptide Formation with a Minimum of Protection and Activation Chemistry","Journal of the American Chemical Society","2002","124","","10972","10973","10.1021/ja025804o","","","0.71073","MoKα","","0.0599","0.0396","","","0.0902","0.0994","","","","","","1.012","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115138","19.081","0.001","11.196","0.001","13.965","0.001","90","","111.48","0.01","90","","2776.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4b-Hydroxy-4b,6,7,8,9,10-hexahydro-5H-10,12a-diaza- cyclodeca[a]indene-11,13-dione, C15 H18 N2 O3","","- C15 H18 N2 O3 -","- C15 H18 N2 O3 -","- C120 H144 N16 O24 -","8","2","","Axel G. Griesbeck; Thomas Heinrich; Michael Oelgemöller; Johann Lex; Arne Molis","A Photochemical Route for Efficient Cyclopeptide Formation with a Minimum of Protection and Activation Chemistry","Journal of the American Chemical Society","2002","124","","10972","10973","10.1021/ja025804o","","","0.71073","MoKα","","0.1377","0.0653","","","0.1534","0.2027","","","","","","1.1","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115139","10.0591","0.0008","11.8948","0.0009","14.9672","0.0012","112.01","0.01","90.94","0.02","105.35","0.02","1587.6","0.3","203","2","203","2","","","","","","","","6","P -1","-P 1","2","[Me4C2Cp2CrCO][HB(C6F5)3]","","","- C35 H21 B Cr F15 O -","- C35 H21 B Cr F15 O -","- C70 H42 B2 Cr2 F30 O2 -","2","1","","Piet-Jan Sinnema; Pamela J. Shapiro; David Min Jin Foo; Brendan Twamley","Zwitterionic Ring-Borylatedansa-Chromocene Complexes","Journal of the American Chemical Society","2002","124","","10996","10997","10.1021/ja026633q","","","0.71073","MoKα","","0.0642","0.0467","","","0.1169","0.1258","","","","","","1.042","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115140","11.078","0.0011","12.1571","0.0012","16.0434","0.0016","106.75","0.01","101.15","0.01","108.26","0.01","1866.8","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","Me4C2Cp2Cr(CO)(H)B(C6F5)3","","","- C42 H28 B Cr F15 O -","- C42 H28 B Cr F15 O -","- C84 H56 B2 Cr2 F30 O2 -","2","1","","Piet-Jan Sinnema; Pamela J. Shapiro; David Min Jin Foo; Brendan Twamley","Zwitterionic Ring-Borylatedansa-Chromocene Complexes","Journal of the American Chemical Society","2002","124","","10996","10997","10.1021/ja026633q","","","0.71073","MoKα","","0.0837","0.0671","","","0.1259","0.1317","","","","","","1.227","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115141","15.952","0.003","8.9873","0.0015","21.434","0.004","90","","102.47","0.03","90","","3000.4","1","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(F5C6)3BCp2CrC2Me4","","","- C34 H19 B Cr F15 -","- C34 H19 B Cr F15 -","- C136 H76 B4 Cr4 F60 -","4","1","","Piet-Jan Sinnema; Pamela J. Shapiro; David Min Jin Foo; Brendan Twamley","Zwitterionic Ring-Borylatedansa-Chromocene Complexes","Journal of the American Chemical Society","2002","124","","10996","10997","10.1021/ja026633q","","","0.71073","MoKα","","0.1724","0.0651","","","0.1116","0.1455","","","","","","0.958","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115142","15.246","0.002","47.223","0.007","26.657","0.004","90","","98.373","0.003","90","","18987","5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Rb-2,2,2-crypt)6[Ge9=Ge9=Ge9].3en","","- C114 H240 Ge27 N18 O36 Rb6 -","- C114 H240.06 Ge27 N18 O36 Rb6 -","- C456 H960.24 Ge108 N72 O144 Rb24 -","4","1","","Angel Ugrinov; Slavi C. Sevov","[Ge9Ge9Ge9]6-: A Linear Trimer of 27 Germanium Atoms","Journal of the American Chemical Society","2002","124","","10990","10991","10.1021/ja026679j","","","0.71073","MoKα","","0.1448","0.0728","","","0.1878","0.2274","","","","","","1.017","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115143","17.5069","0.0006","31.2182","0.0011","16.0615","0.0006","90","","90","","90","","8778.2","0.5","243","2","243","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C15 H22 Cl Co N5 O10 P -","- C15 H18 Cl Co N5 O10 P -","- C240 H288 Cl16 Co16 N80 O160 P16 -","16","1","","Jik Chin; Suhman Chung; Dong H. Kim","Synergistic Effect between Metal Coordination and Hydrogen Bonding in Phosphate and Halide Recognition","Journal of the American Chemical Society","2002","124","","10948","10949","10.1021/ja026920u","","","0.71073","MoKα","","0.0734","0.0653","","","0.1597","0.1654","","","","","","1.107","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115144","6.5279","0.0013","12.935","0.003","12.849","0.003","90","","90","","90","","1084.9","0.4","293","2","293","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C4 H18 Cl3 N3 O -","- C4 H18 Cl3 N3 O -","- C16 H72 Cl12 N12 O4 -","4","0.5","","Colin A. Bremner; Michael Simpson; William T. A. Harrison","New Molecular Perovskites: Cubic C4N2H12.NH4Cl3.H2O and 2-H Hexagonal C6N2H14.NH4Cl3","Journal of the American Chemical Society","2002","124","","10960","10961","10.1021/ja027484e","","","0.71073","MoKα","","0.05","0.0307","","","0.0758","0.0817","","","","","","0.938","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115145","16.1616","0.0002","16.1616","0.0002","22.3496","0.0004","90","","90","","120","","5055.56","0.13","120","2","120","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- C6 H18 Cl3 N3 -","- C6 H14 Cl3 N3 -","- C108 H252 Cl54 N54 -","18","1.5","","Colin A. Bremner; Michael Simpson; William T. A. Harrison","New Molecular Perovskites: Cubic C4N2H12.NH4Cl3.H2O and 2-H Hexagonal C6N2H14.NH4Cl3","Journal of the American Chemical Society","2002","124","","10960","10961","10.1021/ja027484e","","","0.71073","MoKα","","0.1348","0.0676","","","0.2188","0.2603","","","","","","1.167","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115146","20.048","0.004","13.737","0.003","20.285","0.004","90","","90","","90","","5586","2","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C28 H28 Cl2 N O P2 Re -","- C28 H28 Cl2 N O P2 Re -","- C224 H224 Cl16 N8 O8 P16 Re8 -","8","1","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Francesco Tisato; Fiorenzo Refosco; Aldo Cagnolini; Adriano Duatti; Sushumna Prakash; Giuliano Bandoli; Andrea Vittadini","Chemistry of the Strong Electrophilic Metal Fragment [99Tc(N)(PXP)]2+ (PXP = Diphosphine Ligand). A Novel Tool for the Selective Labeling of Small Molecules","Journal of the American Chemical Society","2002","124","","11468","11479","10.1021/ja0200239","","","0.71073","MoKα","","0.0932","0.0636","","","0.1611","0.1877","","","","","","1.008","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115147","13.365","0.003","18.259","0.004","14.294","0.003","90","","116.63","0.03","90","","3118.2","1.4","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C31 H35 Cl2 N2 O P2 Re -","- C31 H35 Cl2 N2 O P2 Re -","- C124 H140 Cl8 N8 O4 P8 Re4 -","4","1","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Francesco Tisato; Fiorenzo Refosco; Aldo Cagnolini; Adriano Duatti; Sushumna Prakash; Giuliano Bandoli; Andrea Vittadini","Chemistry of the Strong Electrophilic Metal Fragment [99Tc(N)(PXP)]2+ (PXP = Diphosphine Ligand). A Novel Tool for the Selective Labeling of Small Molecules","Journal of the American Chemical Society","2002","124","","11468","11479","10.1021/ja0200239","","","0.71073","MoKα","","0.031","0.0273","","","0.0627","0.0646","","","","","","1.024","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115148","16.405","0.003","15.042","0.003","15.228","0.003","90","","97.39","0.03","90","","3726.5","1.3","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C33 H40 B F4 N3 O2 P2 S2 Tc -","- C32.5 H34 B F4 N3 O1.25 P2 S2 Tc -","- C130 H136 B4 F16 N12 O5 P8 S8 Tc4 -","4","1","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Francesco Tisato; Fiorenzo Refosco; Aldo Cagnolini; Adriano Duatti; Sushumna Prakash; Giuliano Bandoli; Andrea Vittadini","Chemistry of the Strong Electrophilic Metal Fragment [99Tc(N)(PXP)]2+ (PXP = Diphosphine Ligand). A Novel Tool for the Selective Labeling of Small Molecules","Journal of the American Chemical Society","2002","124","","11468","11479","10.1021/ja0200239","","","0.71073","MoKα","","0.0619","0.0443","","","0.11","0.1211","","","","","","1.049","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115149","15.065","0.003","14.705","0.003","16.318","0.003","90","","108.31","0.03","90","","3431.9","1.3","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C31 H35 B F4 N3 O P2 Re S2 -","- C31 H34 B F4 N3 O P2 Re S2 -","- C124 H136 B4 F16 N12 O4 P8 Re4 S8 -","4","1","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Francesco Tisato; Fiorenzo Refosco; Aldo Cagnolini; Adriano Duatti; Sushumna Prakash; Giuliano Bandoli; Andrea Vittadini","Chemistry of the Strong Electrophilic Metal Fragment [99Tc(N)(PXP)]2+ (PXP = Diphosphine Ligand). A Novel Tool for the Selective Labeling of Small Molecules","Journal of the American Chemical Society","2002","124","","11468","11479","10.1021/ja0200239","","","0.71073","MoKα","","0.0791","0.0577","","","0.1578","0.1789","","","","","","0.986","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115150","11.389","0.002","11.056","0.002","29.871","0.006","90","","93.1","0.03","90","","3755.8","1.2","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C34 H43 B F4 N4 O P2 S2 Tc -","- C34 H41 B F4 N4 O P2 S2 Tc -","- C136 H164 B4 F16 N16 O4 P8 S8 Tc4 -","4","1","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Francesco Tisato; Fiorenzo Refosco; Aldo Cagnolini; Adriano Duatti; Sushumna Prakash; Giuliano Bandoli; Andrea Vittadini","Chemistry of the Strong Electrophilic Metal Fragment [99Tc(N)(PXP)]2+ (PXP = Diphosphine Ligand). A Novel Tool for the Selective Labeling of Small Molecules","Journal of the American Chemical Society","2002","124","","11468","11479","10.1021/ja0200239","","","0.71073","MoKα","","0.1234","0.0939","","","0.1984","0.2142","","","","","","1.169","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115151","20.88","0.005","3.928","0.001","8.61","0.002","90","","90","","90","","706.2","0.3","203","2","203","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(E)-2-Butenoic acid 4-amino-4-oxo ethyl ester","","- C6 H9 N O3 -","- C6 H9 N O3 -","- C24 H36 N4 O12 -","4","1","","Paul W. Baures; Alicia M. Beatty; Muthu Dhanasekaran; Brian A. Helfrich; Waleska Pérez-Segarra; John Desper","Solution and Solid-State Models of Peptide CH...O Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","11315","11323","10.1021/ja0257366","","","0.71073","MoKα","","0.0299","0.0257","","","0.0625","0.0646","","","","","","1.104","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115152","17.632","0.004","14.097","0.003","4.9199","0.001","90","","90","","90","","1222.9","0.5","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","N-benzyl fumaric hemiamide ethyl ester","(E)-2-Butenoic acid 4-oxo-4[(phenylmethyl)amino] ethyl ester","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","1","","Paul W. Baures; Alicia M. Beatty; Muthu Dhanasekaran; Brian A. Helfrich; Waleska Pérez-Segarra; John Desper","Solution and Solid-State Models of Peptide CH...O Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","11315","11323","10.1021/ja0257366","","","0.71073","MoKα","","0.1144","0.0436","","","0.0729","0.0818","","","","","","1.105","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115153","9.9748","0.0018","12.13","0.002","9.5533","0.0016","90","","90","","90","","1155.9","0.3","203","2","203","2","","","","","","","","4","P n a 21","P 2c -2n","33","","N-(phenylacetyl)glycine ethyl ester","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","1","","Paul W. Baures; Alicia M. Beatty; Muthu Dhanasekaran; Brian A. Helfrich; Waleska Pérez-Segarra; John Desper","Solution and Solid-State Models of Peptide CH...O Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","11315","11323","10.1021/ja0257366","","","0.71073","MoKα","","0.0487","0.0333","","","0.0688","0.0732","","","","","","1.079","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115154","13.514","0.006","4.7974","0.0019","21.238","0.01","90","","97.137","0.007","90","","1366.2","1","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","N-cinnamoyl alanine amide","(S)-Valine-N-[(2E)-1-oxo-3-phenyl-2-propenyl) amide","","- C14 H18 N2 O2 -","- C14 H18 N2 O2 -","- C56 H72 N8 O8 -","4","1","","Paul W. Baures; Alicia M. Beatty; Muthu Dhanasekaran; Brian A. Helfrich; Waleska Pérez-Segarra; John Desper","Solution and Solid-State Models of Peptide CH...O Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","11315","11323","10.1021/ja0257366","","","0.71073","MoKα","","0.0648","0.04","","","0.0805","0.1031","","","","","","1.128","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115155","14.44","0.005","4.852","0.002","27.377","0.011","90","","90","","90","","1918.1","1.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","fumaric acid bis(leucine methyl ester) amide","(S)-Leucine-N,N'-[(2E)-1,4-dioxo-2-butene-1,4-diyl)bis-dimethyl ester","","- C18 H30 N2 O6 -","- C18 H30 N2 O6 -","- C72 H120 N8 O24 -","4","1","","Paul W. Baures; Alicia M. Beatty; Muthu Dhanasekaran; Brian A. Helfrich; Waleska Pérez-Segarra; John Desper","Solution and Solid-State Models of Peptide CH...O Hydrogen Bonds","Journal of the American Chemical Society","2002","124","","11315","11323","10.1021/ja0257366","","","0.71073","MoKα","","0.1556","0.0687","","","0.1676","0.2035","","","","","","0.977","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115156","12.8215","0.0001","18.7191","0.0001","19.8293","0.0004","90","","90","","90","","4759.17","0.11","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H84 Al4 N2 P2 Ti2 -","- C36 H84 Al4 N2 P2 Ti2 -","- C144 H336 Al16 N8 P8 Ti8 -","4","1","","James E. Kickham; Frédéric Guérin; Douglas W. Stephan","Divergent Pathways of C-H Bond Activation: Reactions of (t-Bu3PN)2TiMe2 with Trimethylaluminum","Journal of the American Chemical Society","2002","124","","11486","11494","10.1021/ja0260972","","","0.71073","MoKα","","0.1055","0.0629","","","0.1458","0.1684","","","","","","0.964","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115157","12.5077","0.0014","16.875","0.002","20.575","0.002","90","","94.063","0.002","90","","4331.8","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H79 Al3 N2 P2 Ti -","- C33 H79 Al3 N2 P2 Ti -","- C132 H316 Al12 N8 P8 Ti4 -","4","1","","James E. Kickham; Frédéric Guérin; Douglas W. Stephan","Divergent Pathways of C-H Bond Activation: Reactions of (t-Bu3PN)2TiMe2 with Trimethylaluminum","Journal of the American Chemical Society","2002","124","","11486","11494","10.1021/ja0260972","","","0.71073","MoKα","","0.1479","0.0561","","","0.1147","0.1375","","","","","","0.798","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115158","17.736","0.014","9.716","0.005","19.601","0.013","90","","93.014","0.019","90","","3373","4","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H27 Mg N -","- C17 H27 Mg N -","- C136 H216 Mg8 N8 -","8","1","","Aibing Xia; Mary Jane Heeg; Charles H. Winter","Intramolecular and Intermolecular N-H...C5H5-Hydrogen Bonding in Magnesocene Adducts of Alkylamines. Implications for Chemical Vapor Deposition Using Cyclopentadienyl Source Compounds","Journal of the American Chemical Society","2002","124","","11264","11265","10.1021/ja026199s","","","0.71073","MoKα","","0.1864","0.044","","","0.1031","0.1432","","","","","","0.787","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115159","12.019","0.003","11.515","0.003","26.124","0.004","90","","90","","90","","3615.5","1.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-phtaloyl-cis-1-aminocyclohexane-4-carboxylate tert-butyl perester","","- C19 H23 N O5 -","- C19 H23 N O5 -","- C152 H184 N8 O40 -","8","1","","Sabrina Antonello; Marco Crisma; Fernando Formaggio; Alessandro Moretto; Ferdinando Taddei; Claudio Toniolo; Flavio Maran","Insights into the Free-Energy Dependence of Intramolecular Dissociative Electron Transfers","Journal of the American Chemical Society","2002","124","","11503","11513","10.1021/ja0263644","","","1.54178","CuKα","","0.047","0.0429","","","0.1295","0.1329","","","","","","1.109","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115160","14.256","0.003","11.009","0.003","24.814","0.005","90","","106.28","0.04","90","","3738.3","1.7","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-(3-fluorophtaloyl)-cis-1-aminocyclohexane-4-carboxylate tert-butyl perester","","- C19 H22 F N O5 -","- C19 H22 F N O5 -","- C152 H176 F8 N8 O40 -","8","2","","Sabrina Antonello; Marco Crisma; Fernando Formaggio; Alessandro Moretto; Ferdinando Taddei; Claudio Toniolo; Flavio Maran","Insights into the Free-Energy Dependence of Intramolecular Dissociative Electron Transfers","Journal of the American Chemical Society","2002","124","","11503","11513","10.1021/ja0263644","","","1.54178","CuKα","","0.0697","0.0649","","","0.1834","0.1877","","","","","","1.037","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115161","13.489","0.002","6.048","0.001","24.052","0.004","90","","102.52","0.08","90","","1915.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(3,6-difluorophtaloyl)-cis-1-aminocyclohexane-4-carboxylate tert-butyl perester","","- C19 H21 F2 N O5 -","- C19 H21 F2 N O5 -","- C76 H84 F8 N4 O20 -","4","1","","Sabrina Antonello; Marco Crisma; Fernando Formaggio; Alessandro Moretto; Ferdinando Taddei; Claudio Toniolo; Flavio Maran","Insights into the Free-Energy Dependence of Intramolecular Dissociative Electron Transfers","Journal of the American Chemical Society","2002","124","","11503","11513","10.1021/ja0263644","","","1.54178","CuKα","","0.0972","0.0775","","","0.2271","0.2435","","","","","","1.031","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115162","11.961","0.003","10.926","0.003","22.229","0.006","90","","102.837","0.007","90","","2832.4","1.3","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Methyl-2-N,N-bis(t-butyldimethylsilyloxy)amino-3-trimethylsilyloxy-pent-1-ene","","- C21 H49 N O3 Si3 -","- C21 H49 N O3 Si3 -","- C84 H196 N4 O12 Si12 -","4","1","","Alexander A. Tishkov; Alexander D. Dilman; Valery I. Faustov; Arsenij A. Birukov; Konstantin S. Lysenko; Paul A. Belyakov; Sema L. Ioffe; Yury A. Strelenko; Michael Yu. Antipin","Structure and Stereodynamics of N,N-Bis(silyloxy)enamines","Journal of the American Chemical Society","2002","124","","11358","11367","10.1021/ja026548i","","","0.71073","MoKα","","0.0763","0.0528","","","0.1293","0.1457","","","","","","0.984","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115163","12.149","0.004","14.155","0.004","14.586","0.005","90","","100.34","0.03","90","","2467.6","1.4","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Methyl-2-N,N-bis(t-butyldimethylsilyloxy)amino-3-trimethylsilyloxy-pent-1-ene","","- C20 H36 N2 O4 Si2 -","- C20 H36 N2 O4 Si2 -","- C80 H144 N8 O16 Si8 -","4","1","","Alexander A. Tishkov; Alexander D. Dilman; Valery I. Faustov; Arsenij A. Birukov; Konstantin S. Lysenko; Paul A. Belyakov; Sema L. Ioffe; Yury A. Strelenko; Michael Yu. Antipin","Structure and Stereodynamics of N,N-Bis(silyloxy)enamines","Journal of the American Chemical Society","2002","124","","11358","11367","10.1021/ja026548i","","","0.71073","MoKα","","0.0977","0.0463","","","0.1042","0.1117","","","","","","0.852","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115164","9.234","0.002","9.254","0.002","12.706","0.003","73.199","0.004","76.044","0.005","70.494","0.004","967.1","0.4","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","b-N,N-(Dimethylamino)-4-nitrostyrene","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","2","","Alexander A. Tishkov; Alexander D. Dilman; Valery I. Faustov; Arsenij A. Birukov; Konstantin S. Lysenko; Paul A. Belyakov; Sema L. Ioffe; Yury A. Strelenko; Michael Yu. Antipin","Structure and Stereodynamics of N,N-Bis(silyloxy)enamines","Journal of the American Chemical Society","2002","124","","11358","11367","10.1021/ja026548i","","","0.71073","MoKα","","0.085","0.0758","","","0.1885","0.1986","","","","","","1.105","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115165","14.1174","0.0011","14.3252","0.0011","22.3306","0.0018","90","","96.206","0.001","90","","4489.6","0.6","96","2","96","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H51 B Co N P3 -","- C55 H51 B Co N P3 -","- C220 H204 B4 Co4 N4 P12 -","4","1","","David M. Jenkins; Theodore A. Betley; Jonas C. Peters","Oxidative Group Transfer to Co(I) Affords a Terminal Co(III) Imido Complex","Journal of the American Chemical Society","2002","124","","11238","11239","10.1021/ja026852b","","","0.71073","MoKα","","0.0709","0.0415","","","0.0797","0.0844","","","","","","1.67","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115166","13.1284","0.0008","16.5975","0.0011","21.8205","0.0014","90","","97.168","0.001","90","","4717.5","0.5","98","2","98","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H51 B Co N2 P3 -","- C58 H51 B Co N2 P3 -","- C232 H204 B4 Co4 N8 P12 -","4","1","","David M. Jenkins; Theodore A. Betley; Jonas C. Peters","Oxidative Group Transfer to Co(I) Affords a Terminal Co(III) Imido Complex","Journal of the American Chemical Society","2002","124","","11238","11239","10.1021/ja026852b","","","0.71073","MoKα","","0.0826","0.0466","","","0.0693","0.0736","","","","","","1.572","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115167","37.276","0.005","37.276","0.005","12.423","0.002","90","","90","","90","","17262","4","98","2","98","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C53 H47 B Co O2 P3 -","- C53 H47 B Co O2 P3 -","- C848 H752 B16 Co16 O32 P48 -","16","1","","David M. Jenkins; Theodore A. Betley; Jonas C. Peters","Oxidative Group Transfer to Co(I) Affords a Terminal Co(III) Imido Complex","Journal of the American Chemical Society","2002","124","","11238","11239","10.1021/ja026852b","","","0.71073","MoKα","","0.1815","0.0724","","","0.097","0.1072","","","","","","1.348","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115168","16.472","0.005","18.028","0.005","24.398","0.005","69.036","0.005","76.52","0.005","73.183","0.005","6408","3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Phil Gale","","- C124 H180 Cl8 N16 O8 -","- C124 H180 Cl8 N16 O8 -","- C248 H360 Cl16 N32 O16 -","2","1","","Philip A. Gale; Korakot Navakhun; Salvatore Camiolo; Mark E. Light; Michael B. Hursthouse","Anion-Anion Assembly: A New Class of Anionic Supramolecular Polymer Containing 3,4-Dichloro-2,5-diamido-substituted Pyrrole Anion Dimers","Journal of the American Chemical Society","2002","124","","11228","11229","10.1021/ja027118v","","","0.71069","MoKα","","0.2051","0.1107","","","0.2954","0.3389","","","","","","0.992","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115169","13.3899","0.0003","16.3267","0.0003","28.0813","0.0007","90","","90","","90","","6138.9","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C62 H90 Cl4 N8 O4 -","- C62 H90 Cl4 N8 O4 -","- C248 H360 Cl16 N32 O16 -","4","1","","Philip A. Gale; Korakot Navakhun; Salvatore Camiolo; Mark E. Light; Michael B. Hursthouse","Anion-Anion Assembly: A New Class of Anionic Supramolecular Polymer Containing 3,4-Dichloro-2,5-diamido-substituted Pyrrole Anion Dimers","Journal of the American Chemical Society","2002","124","","11228","11229","10.1021/ja027118v","","","0.71073","MoKα","","0.1866","0.1119","","","0.2814","0.3306","","","","","","1.064","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4115170","30.043","0.003","17.1273","0.0018","35.197","0.004","90","","97.659","0.002","90","","17949","3","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C146 H206 Cu10 N8 O33 S12 -","- C146 H134 Cu10 N8 O33 S12 -","- C584 H536 Cu40 N32 O132 S48 -","4","0.5","","Takashi Kajiwara; Noriyoshi Kon; Shuichi Yokozawa; Tasuku Ito; Nobuhiko Iki; Sotaro Miyano","Synthesis, Structure, and Ferromagnetic Behavior of Decacopper(II) Cluster Complex Supported by Hexaanionic p-tert-Butylthiacalix[6]arene","Journal of the American Chemical Society","2002","124","","11274","11275","10.1021/ja0273391","","","0.71073","MoKα","","0.0958","0.0573","","","0.1635","0.1803","","","","","","0.934","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115171","28.918","0.007","28.918","0.007","30.428","0.011","90","","90","","90","","25445","13","113","2","113","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C172 H224 Fe4 N48 O80 Pd6 -","- C172 Fe4 N42 O105 Pd6 -","- C688 Fe16 N168 O420 Pd24 -","4","0.5","","Wei-Yin Sun; Takahiro Kusukawa; Makoto Fujita","Electrochemically Driven Clathration/Declathration of Ferrocene and Its Derivatives by a Nanometer-Sized Coordination Cage","Journal of the American Chemical Society","2002","124","","11570","11571","10.1021/ja0206285","","","0.71073","MoKα","","0.1443","0.113","","","0.2739","0.3007","","","","","","2.185","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115172","11.88","0.002","15.941","0.002","12.802","0.001","90","","107.25","0.0009","90","","2315.4","0.5","123.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H31 Ge Li O Si2 -","- C16 H39 Ge Li O Si2 -","- C64 H156 Ge4 Li4 O4 Si8 -","4","1","","Takeaki Iwamoto; Junichiro Okita; Chizuko Kabuto; Mitsuo Kira","Sila-metalation Route to Hydrido(trialkylsilyl)silyllithiums","Journal of the American Chemical Society","2002","124","","11604","11605","10.1021/ja026705d","","","0.7107","MoKα","","","0.0448","","","","0.1217","","","","","","0.906","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115173","11.8427","0.0004","15.943","0.001","12.77","0.0004","90","","107.467","0.004","90","","2299.91","0.19","150.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H78 Li2 O2 Si6 -","- C32 H78 Li2 O2 Si6 -","- C64 H156 Li4 O4 Si12 -","2","0.5","","Takeaki Iwamoto; Junichiro Okita; Chizuko Kabuto; Mitsuo Kira","Sila-metalation Route to Hydrido(trialkylsilyl)silyllithiums","Journal of the American Chemical Society","2002","124","","11604","11605","10.1021/ja026705d","","","0.71069","MoKα","","0.0743","0.0548","","","0.1456","0.1615","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115174","12.6609","0.0003","31.2622","0.0008","8.5488","0.0002","90","","107.715","0.001","90","","3223.24","0.14","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H50 Ag1.05 Br Li1.95 N4 -","- C30 H50 Ag1.0512 Br Li1.9488 N4 -","- C120 H200 Ag4.2048 Br4 Li7.7952 N16 -","4","1","","Claudia M. P. Kronenburg; Johann T. B. H. Jastrzebski; Jaap Boersma; Martin Lutz; Anthony L. Spek; Gerard van Koten","The First Homologous Series of Self-Assembled Aryl Bromo- and Aryl Cyanocuprates, -Argentates, and -Aurates; MLi~2~XAr~2~ (M = CuI, AgI, AuI; X = Br, C\τbN; Ar = [C~6~H~4~CH~2~N(Et)CH~2~CH~2~NEt~2~]-2)","Journal of the American Chemical Society","2002","124","","11675","11683","10.1021/ja026945t","","","0.71073","MoKα","","0.0734","0.0448","","","0.0938","0.1056","","","","","","1.045","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115175","12.6266","0.0005","31.1512","0.0011","8.6751","0.0004","90","","109.306","0.0007","90","","3220.3","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H50 Br Cu1.13 Li1.87 N4 -","- C30 H50 Br Cu1.13 Li1.87 N4 -","- C120 H200 Br4 Cu4.52 Li7.48 N16 -","4","1","","Claudia M. P. Kronenburg; Johann T. B. H. Jastrzebski; Jaap Boersma; Martin Lutz; Anthony L. Spek; Gerard van Koten","The First Homologous Series of Self-Assembled Aryl Bromo- and Aryl Cyanocuprates, -Argentates, and -Aurates; MLi~2~XAr~2~ (M = CuI, AgI, AuI; X = Br, C\τbN; Ar = [C~6~H~4~CH~2~N(Et)CH~2~CH~2~NEt~2~]-2)","Journal of the American Chemical Society","2002","124","","11675","11683","10.1021/ja026945t","","","0.71073","MoKα","","0.0594","0.0445","","","0.1127","0.1305","","","","","","1.085","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115176","14.6762","0.0001","17.796","0.0002","28.7932","0.0003","90","","100.36","0.0005","90","","7397.54","0.12","150","1","150","1","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C99 H92 O6 -","- C99 H92 O6 -","- C396 H368 O24 -","4","1","","Ken-Tsung Wong; Yuh-Yih Chien; Ruei-Tang Chen; Chung-Feng Wang; Yu-Ting Lin; Huo-Hsien Chiang; Ping-Yuan Hsieh; Chung-Chih Wu; Chung Hsien Chou; Yuhlong Oliver Su; Gene-Hsiang Lee; Shie-Ming Peng","Ter(9,9-diarylfluorene)s: Highly Efficient Blue Emitter with Promising Electrochemical and Thermal Stability","Journal of the American Chemical Society","2002","124","","11576","11577","10.1021/ja0269587","","","0.71073","MoKα","","0.1212","0.0752","","","0.1824","0.2157","","","","","","1.038","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115177","13.7219","0.0011","13.7219","0.0011","7.1949","0.0008","90","","90","","120","","1173.23","0.19","293","2","160","2","","","","","","","synthetic","4","R 3 :H","R 3","146","","","","- C15 H24 Cr N3 -","- C15 H24 Cr N3 -","- C45 H72 Cr3 N9 -","3","0.333333","","Louise A. Berben; Jeffrey R. Long","Synthesis and Alkali Metal Ion-Binding Properties of a Chromium(III) Triacetylide Complex","Journal of the American Chemical Society","2002","124","","11588","11589","10.1021/ja027309y","","","0.71073","MoKα","","0.0247","0.0238","","0.0607","0.0601","","","","1.045","1.046","1.046","","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115178","12.2852","0.0008","20.4722","0.0013","14.9007","0.0009","90","","90.54","","90","","3747.4","0.4","160","2","160","2","","","","","","","synthetic","8","P 1 21/c 1","-P 2ybc","14","","","","- C31 H48 Cr2 F3 K N6 O3 S -","- C31 H48 Cr2 F3 K N6 O3 S -","- C124 H192 Cr8 F12 K4 N24 O12 S4 -","4","1","","Louise A. Berben; Jeffrey R. Long","Synthesis and Alkali Metal Ion-Binding Properties of a Chromium(III) Triacetylide Complex","Journal of the American Chemical Society","2002","124","","11588","11589","10.1021/ja027309y","","","0.71073","MoKα","","0.0815","0.0519","","0.1415","0.1253","","","","1.044","1.109","1.109","","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115179","16.142","0.0009","16.142","0.0009","11.8364","0.0009","90","","90","","120","","2670.9","0.3","120","2","120","2","","","","","","","synthetic","7","P 63/m","-P 6c","176","","","","- C45 H76 Br Cr3 Cs N9 O2 -","- C45 H63 Br Cr3 Cs N9 O2 -","- C90 H126 Br2 Cr6 Cs2 N18 O4 -","2","0.166667","","Louise A. Berben; Jeffrey R. Long","Synthesis and Alkali Metal Ion-Binding Properties of a Chromium(III) Triacetylide Complex","Journal of the American Chemical Society","2002","124","","11588","11589","10.1021/ja027309y","","","0.71073","MoKα","","0.0641","0.0481","","0.1356","0.1238","","","","1.078","1.112","1.112","","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115180","6.7645","0.0002","6.99","0.0002","8.2325","0.0003","74.416","0.002","78.265","0.002","65.748","0.002","339.94","0.02","150","2","150","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C14 H6 Mn2 O6 -","- C14 H6 Mn2 O6 -","- C14 H6 Mn2 O6 -","1","0.5","","Simon C. Jones; Tony Hascall; Stephen Barlow; Dermot O'Hare","Pentalene Complexes of Group 7 Metal Carbonyls: An Organometallic Mixed-Valence System with Very Large Metal-Metal Electronic Coupling","Journal of the American Chemical Society","2002","124","","11610","11611","10.1021/ja027705g","","x-ray","0.71073","MoKα","","0.0218","0.0204","","","0.0503","0.0511","","","","","","1.111","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115181","6.7877","0.0001","9.1754","0.0002","12.5631","0.0003","70.36","","79.29","","71.29","","695.29","0.02","150","2","150","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C14 H6 O6 Re2 -","- C14 H6 O6 Re2 -","- C28 H12 O12 Re4 -","2","1","","Simon C. Jones; Tony Hascall; Stephen Barlow; Dermot O'Hare","Pentalene Complexes of Group 7 Metal Carbonyls: An Organometallic Mixed-Valence System with Very Large Metal-Metal Electronic Coupling","Journal of the American Chemical Society","2002","124","","11610","11611","10.1021/ja027705g","","x-ray","0.71073","MoKα","","0.0242","0.0225","","","0.0522","0.053","","","","","","1.187","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115182","24.6924","0.0019","9.6945","0.0007","20.2514","0.0016","90","","101.676","0.0015","90","","4747.5","0.6","193","2","193","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C28 H22 I O4 P -","- C28 H22 I O4 P -","- C224 H176 I8 O32 P8 -","8","1","","Viktor V. Zhdankin; Olena Maydanovych; Jon Herschbach; Robert McDonald; Rik R. Tykwinski","Preparation, Structure, and Unexpected Chemistry of Phosphoranyl-Derived Benziodoxoles","Journal of the American Chemical Society","2002","124","","11614","11615","10.1021/ja0277780","","","0.71073","MoKα","","0.045","0.0333","","","0.0768","0.0812","","","","","","1.04","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115183","10.2285","0.0009","29.139","0.003","17.8515","0.0017","90","","101.895","0.002","90","","5206.4","0.9","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H48 Cl I2 N O6 P2 -","- C58 H48 Cl I2 N O6 P2 -","- C232 H192 Cl4 I8 N4 O24 P8 -","4","1","","Viktor V. Zhdankin; Olena Maydanovych; Jon Herschbach; Robert McDonald; Rik R. Tykwinski","Preparation, Structure, and Unexpected Chemistry of Phosphoranyl-Derived Benziodoxoles","Journal of the American Chemical Society","2002","124","","11614","11615","10.1021/ja0277780","","","0.71073","MoKα","","0.2138","0.0826","","","0.1314","0.1865","","","","","","0.946","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115184","6.8502","0.0003","12.676","0.004","14.0451","0.0003","90","","90","","90","","1219.6","0.4","273.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C52 H52 N4 O12 -","4","1","","Barry M. Trost; Oliver R. Thiel; Hon-Chung Tsui","DYKAT of Baylis-Hillman Adducts: Concise Total Synthesis of Furaquinocin E","Journal of the American Chemical Society","2002","124","","11616","11617","10.1021/ja0277834","","","0.7107","MoKα","","","0.041","","","","0.098","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115185","19.369","0.009","16.082","0.007","17.955","0.008","90","","90","","90","","5593","4","218","2","218","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C33 H34 Cr O3 -","- C33 H34 Cr O3 -","- C264 H272 Cr8 O24 -","8","1","","Reginald H. Mitchell; Zinka Brkic; David J. Berg; Tosha M. Barclay","Effective Aromaticity of Tricarbonylchromiumbenzene, about 25 Enhanced over that of Benzene: Structural Evidence from a Complexed Benzannulene","Journal of the American Chemical Society","2002","124","","11983","11988","10.1021/ja0269542","","","0.71073","MoKα","","0.0986","0.0524","","","0.121","0.1404","","","","","","1.04","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115186","8.573","0.003","8.613","0.003","21.722","0.007","87.52","0.01","92.459","0.009","98.35","0.02","1584.4","0.9","296.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H18 O3 -","- C18 H18 O3 -","- C72 H72 O12 -","4","2","","Yoshiaki Nishibayashi; Masato Yoshikawa; Youichi Inada; Masanobu Hidai; Sakae Uemura","Ruthenium-Catalyzed Propargylation of Aromatic Compounds with Propargylic Alcohols","Journal of the American Chemical Society","2002","124","","11846","11847","10.1021/ja027023t","","","0.7107","MoKα","","","0.108","","","","0.085","","","","","","5.424","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115187","10.3547","0.0015","13.057","0.002","26.794","0.004","90","","90.973","0.003","90","","3622.1","0.9","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H47 Cl F6 N2 P Rh -","- C35 H47 Cl F6 N2 P Rh -","- C140 H188 Cl4 F24 N8 P4 Rh4 -","4","1","","Emmanuelle Despagnet; Karinne Miqueu; Heinz Gornitzka; Philip W. Dyer; Didier Bourissou; Guy Bertrand","Stable (Aryl)(phosphino)carbenes: New Ligands for Transition Metals","Journal of the American Chemical Society","2002","124","","11834","11835","10.1021/ja027201i","","","0.71073","MoKα","","0.1024","0.0611","","","0.1182","0.1328","","","","","","1.04","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115188","8.984","0.002","15.374","0.003","17.95","0.002","90","","92.62","0.01","90","","2476.7","0.8","286.2","","286.2","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C31 H24 N2 Si -","- C31 H24 N Si -","- C124 H96 N4 Si4 -","4","2","","Shin Kamijo; Yoshinori Yamamoto","Synthesis of Allyl Cyanamides and N-Cyanoindoles via the Palladium-Catalyzed Three-Component Coupling Reaction","Journal of the American Chemical Society","2002","124","","11940","11945","10.1021/ja0272742","","","0.7107","MoKα","","0.0548","0.0539","","","0.0515","0.0521","","","","","","1.271","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115189","13.6548","0.001","8.8146","0.0007","13.7395","0.0011","90","","99.57","0.001","90","","1630.7","0.2","238","2","238","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 N O2 -","- C18 H25 N O2 -","- C72 H100 N4 O8 -","4","1","","Brian D. Dangel; Kamil Godula; So Won Youn; Bengü Sezen; Dalibor Sames","C-C Bond Formation via C-H Bond Activation: Synthesis of the Core of Teleocidin B4","Journal of the American Chemical Society","2002","124","","11856","11857","10.1021/ja027311p","","","0.71073","MoKα","","0.0557","0.0439","","","0.1203","0.1268","","","","","","1.073","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115190","30.635","0.004","7.7786","0.001","30.476","0.004","90","","90","","90","","7262.4","1.6","193","2","193","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","3,5-diethynyl-N-(1-oxy-2,2,6,6-tetramethyl-piperidine-4-yl)-benzamide","","- C20 H23 N2 O2 -","- C20 H23 N2 O2 -","- C320 H368 N32 O32 -","16","2","","Kenji Matsuda; Matthew T. Stone; Jeffrey S. Moore","Helical Pitch of m-Phenylene Ethynylene Foldamers by Double Spin Labeling","Journal of the American Chemical Society","2002","124","","11836","11837","10.1021/ja027437m","","","0.71073","MoKα","","0.1559","0.0736","","","0.1632","0.1917","","","","","","0.952","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115191","17.479","0.003","12.0607","0.0019","18.368","0.003","90","","110.8","0.003","90","","3619.8","1","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C74 H106 Mn2 N6 Si2 -","- C74 H106 Mn2 N6 Si2 -","- C148 H212 Mn4 N12 Si4 -","2","0.5","","Hiroyasu Sugiyama; Ghazar Aharonian; Sandro Gambarotta; Glenn P. A. Yap; Peter H. M. Budzelaar","Participation of the α,α'-Diiminopyridine Ligand System in Reduction of the Metal Center during Alkylation","Journal of the American Chemical Society","2002","124","","12268","12274","10.1021/ja020485m","","","0.71073","MoKα","","0.1481","0.0818","","","0.1541","0.1849","","","","","","1.088","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115192","23.5634","0.001","18.8452","0.0007","21.9494","0.0008","90","","111.424","0.001","90","","9073.3","0.6","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C101 H122 Cr2 N6 -","- C101 H122 Cr2 N6 -","- C404 H488 Cr8 N24 -","4","0.5","","Hiroyasu Sugiyama; Ghazar Aharonian; Sandro Gambarotta; Glenn P. A. Yap; Peter H. M. Budzelaar","Participation of the α,α'-Diiminopyridine Ligand System in Reduction of the Metal Center during Alkylation","Journal of the American Chemical Society","2002","124","","12268","12274","10.1021/ja020485m","","","0.71073","MoKα","","0.0809","0.0677","","","0.1765","0.1909","","","","","","1.044","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115193","17.9682","0.0016","14.7152","0.0013","19.7117","0.0018","90","","90","","90","","5211.9","0.8","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C46 H69 Al2 Cl2 Cr N3 -","- C46 H69 Al2 Cl2 Cr N3 -","- C184 H276 Al8 Cl8 Cr4 N12 -","4","0.5","","Hiroyasu Sugiyama; Ghazar Aharonian; Sandro Gambarotta; Glenn P. A. Yap; Peter H. M. Budzelaar","Participation of the α,α'-Diiminopyridine Ligand System in Reduction of the Metal Center during Alkylation","Journal of the American Chemical Society","2002","124","","12268","12274","10.1021/ja020485m","","","0.71073","MoKα","","0.1153","0.0868","","","0.2663","0.3065","","","","","","1.049","","","","has coordinates,has disorder","178922","2020-10-21","18:00:00",""
"4115194","18.124","0.002","16.44","0.001","37.861","0.003","90","","95.932","0.002","90","","11220.6","1.7","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34.33 H45.67 Cl5.67 Cr N3 -","- C34.3333 H45.6667 Cl5.66667 Cr N3 -","- C412 H548 Cl68 Cr12 N36 -","12","3","","Hiroyasu Sugiyama; Ghazar Aharonian; Sandro Gambarotta; Glenn P. A. Yap; Peter H. M. Budzelaar","Participation of the α,α'-Diiminopyridine Ligand System in Reduction of the Metal Center during Alkylation","Journal of the American Chemical Society","2002","124","","12268","12274","10.1021/ja020485m","","","0.71073","MoKα","","0.1164","0.0702","","","0.2064","0.2434","","","","","","1.022","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115195","12.9031","0.0006","13.3823","0.0007","13.8935","0.0007","117.851","0.001","117.374","0.001","91.063","0.001","1798.51","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H84 Al2 Cl14 N4 Pd2 -","- C58 H84 Al2 Cl14 N4 Pd2 -","- C58 H84 Al2 Cl14 N4 Pd2 -","1","0.5","","Myeongsoon Kang; Ayusman Sen; Lev Zakharov; Arnold L. Rheingold","Diametrically Opposite Trends in Alkene Insertion in Late and Early Transition Metal Compounds: Relevance to Transition-Metal-Catalyzed Polymerization of Polar Vinyl Monomers","Journal of the American Chemical Society","2002","124","","12080","12081","10.1021/ja026550+","","","0.71073","MoKα","","0.0447","0.0338","","","0.0724","0.0763","","","","","","1.034","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115196","13.6284","0.0008","13.8525","0.0008","22.8234","0.0013","89.906","0.001","78.302","0.001","61.571","0.001","3687.9","0.4","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- Co4 H128 Na16 O174 P4 W30 -","- Co4 Na16 O174 P4 W30 -","- Co4 Na16 O174 P4 W30 -","1","0.5","","Shaoqin Liu; Dirk G. Kurth; Bjoern Bredenkötter; Dirk Volkmer","The Structure of Self-Assembled Multilayers with Polyoxometalate Nanoclusters","Journal of the American Chemical Society","2002","124","","12279","12287","10.1021/ja026946l","","","0.71073","MoKα","","0.0478","0.0355","","","0.0896","0.0945","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115197","13.986","0.001","11.69","0.001","19.815","0.002","90","","97.94","0.01","90","","3208.6","0.5","173","1","173","1","","","","","","","Synthesized in the laboratory of F. Ladipo","5","P 1 n 1","P -2yac","7","","","","- C72 H94 O5 Si Ti -","- C72 H94 O5 Si Ti -","- C144 H188 O10 Si2 Ti2 -","2","1","","Jesudoss V. Kingston; Oleg V. Ozerov; Sean Parkin; Carolyn P. Brock; Folami T. Ladipo","Mechanistic Insight into Fragmentation Reactions of Titanapinacolate Complexes","Journal of the American Chemical Society","2002","124","","12217","12224","10.1021/ja0271577","","","0.71073","MoKα","","0.053","0.047","","","0.109","0.113","","","","","","1.08","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115198","11.242","0.002","13.483","0.003","25.368","0.005","79.35","0.01","84.9","0.01","76.4","0.01","3668.8","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C81 H100 O5 Si3 Ti -","- C81 H100 O5 Si3 Ti -","- C162 H200 O10 Si6 Ti2 -","2","1","","Jesudoss V. Kingston; Oleg V. Ozerov; Sean Parkin; Carolyn P. Brock; Folami T. Ladipo","Mechanistic Insight into Fragmentation Reactions of Titanapinacolate Complexes","Journal of the American Chemical Society","2002","124","","12217","12224","10.1021/ja0271577","","","0.7107","MoKα","","0.1071","0.097","","","0.2522","0.2558","","","","","","1.195","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115199","9.893","0.0013","33.172","0.004","11.4474","0.0015","90","","102.41","0.002","90","","3668.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H21.5 N6.39 O12.92 Pt2 -","- C4 H18 N6.39 O12.921 Pt2 -","- C32 H144 N51.12 O103.368 Pt16 -","8","2","","Ken Sakai; Eri Ishigami; Yosuke Konno; Takashi Kajiwara; Tasuku Ito","New Partially Oxidized 1-D Platinum Chain Complexes Consisting of Carboxylate-Bridged cis-Diammineplatinum Dimer Cations","Journal of the American Chemical Society","2002","124","","12088","12089","10.1021/ja0275461","","","0.71073","MoKα","","0.0894","0.047","","","0.0963","0.1086","","","","","","1.023","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4115200","9.4102","0.0008","10.0776","0.0008","11.4257","0.0009","101.489","0.002","103.882","0.002","99.534","0.002","1004.53","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H25.68 Cl0.35 N5.81 O12.67 Pt2 -","- C6 Cl0.347 N5.812 O12.664 Pt2 -","- C12 Cl0.694 N11.624 O25.328 Pt4 -","2","1","","Ken Sakai; Eri Ishigami; Yosuke Konno; Takashi Kajiwara; Tasuku Ito","New Partially Oxidized 1-D Platinum Chain Complexes Consisting of Carboxylate-Bridged cis-Diammineplatinum Dimer Cations","Journal of the American Chemical Society","2002","124","","12088","12089","10.1021/ja0275461","","","0.71073","MoKα","","0.061","0.0519","","","0.139","0.1455","","","","","","1.049","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115201","11.404","0.003","7.941","0.002","12.843","0.003","90","","105.643","0.005","90","","1120","0.5","293","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H27 N O4 -","- C24 H27 N O4 -","- C48 H54 N2 O8 -","2","1","","Yujiro Hayashi; Mitsuru Shoji; Junichiro Yamaguchi; Kenji Sato; Shinpei Yamaguchi; Takasuke Mukaiyama; Ken Sakai; Yukihiro Asami; Hideaki Kakeya; Hiroyuki Osada","Asymmetric Total Synthesis of (-)-Azaspirene, a Novel Angiogenesis Inhibitor","Journal of the American Chemical Society","2002","124","","12078","12079","10.1021/ja0276826","","","0.71073","MoKα","","0.0961","0.0698","","","0.1566","0.1713","","","","","","1.072","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115202","10.746","0.002","13.136","0.002","17.475","0.003","73.88","0.02","79.511","0.014","78.031","0.01","2297.8","0.7","261","2","261","2","","","","","","","","7","P -1","-P 1","2","","","","- C47 H41 F6 N2 O3.5 P3 Re -","- C47 H36 F6 N2 O3.5 P3 Re -","- C94 H72 F12 N4 O7 P6 Re2 -","2","1","","Rory Melenkivitz; Joel S. Southern; Gregory L. Hillhouse; Thomas E. Concolino; Louise M. Liable-Sands; Arnold L. Rheingold","A New Route to Coordination Complexes of Nitroxyl (HNO) via Insertion Reactions of Nitrosonium Triflate with Transition-Metal Hydrides","Journal of the American Chemical Society","2002","124","","12068","12069","10.1021/ja0277475","","","0.71073","MoKα","","0.0589","0.0423","","","0.1004","0.1091","","","","","","0.986","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115203","14.1156","0.0008","15.2352","0.0009","19.1117","0.001","74.306","0.001","70.329","0.001","82.55","0.001","3722.5","0.4","203","2","203","2","","","","","","","","8","P -1","-P 1","2","","","","- C136 H120 B2 F68 N4 O2 P4 Pt2 -","- C140 H98 B2 F67.92 O2 P4 Pt2 -","- C140 H98 B2 F67.92 O2 P4 Pt2 -","1","0.5","","Wayde V. Konze; Brian L. Scott; Gregory J. Kubas","C-H Activation and C-C Coupling of Arenes by Cationic Pt(II) Complexes","Journal of the American Chemical Society","2002","124","","12550","12556","10.1021/ja020798h","","","0.71073","MoKα","","0.0709","0.0603","","","0.1687","0.1792","","","","","","1.178","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115204","13.0443","0.0006","18.1546","0.0009","24.8574","0.0011","110.108","0.001","98.902","0.001","98.738","0.001","5326","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H82 B2 F48 P4 Pt2 -","- C96 H77 B2 F48 P4 Pt2 -","- C192 H154 B4 F96 P8 Pt4 -","2","1","","Wayde V. Konze; Brian L. Scott; Gregory J. Kubas","C-H Activation and C-C Coupling of Arenes by Cationic Pt(II) Complexes","Journal of the American Chemical Society","2002","124","","12550","12556","10.1021/ja020798h","","","0.71073","MoKα","","0.0876","0.0657","","","0.1714","0.1856","","","","","","1.277","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115205","8.866","0.002","14.024","0.002","15.393","0.001","90","","99.34","0.01","90","","1888.5","0.5","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H19 N O2 -","- C25 H19 N O2 -","- C100 H76 N4 O8 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.046","","","","0.08","","","","","","0.981","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115206","8.913","0.002","13.957","0.002","15.099","0.003","90","","100.47","0.01","90","","1847","0.6","295.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 Cl3 N O2 -","- C20 H14 Cl2.99 N O2 -","- C80 H56 Cl11.96 N4 O8 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.056","","","","0.1","","","","","","1.268","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115207","8.874","0.002","13.998","0.002","15.604","0.001","90","","97.48","0.009","90","","1921.8","0.5","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24.5 H20 N O3 -","- C25.5 H13 N O2 -","- C102 H52 N4 O8 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.081","","","","0.138","","","","","","1.704","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115208","8.986","0.004","14.01","0.003","15.591","0.003","90","","99.6","0.03","90","","1935.3","1","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H19 N O3 -","- C25 H18 N O3 -","- C100 H72 N4 O12 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.054","","","","0.094","","","","","","1.187","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115209","9.127","0.002","13.96","0.001","15.169","0.002","90","","101.02","0.01","90","","1897.1","0.5","295.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 Cl3 N O3 -","- C20 H13 Cl3 N O3 -","- C80 H52 Cl12 N4 O12 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.057","","","","0.096","","","","","","1.2","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115210","9.004","0.002","14.001","0.002","15.273","0.002","90","","100.16","0.02","90","","1895.2","0.6","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22.5 H18 N O3.5 -","- C22.5 H12 N O3.5 -","- C90 H48 N4 O14 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.072","","","","0.115","","","","","","1.457","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115211","8.923","0.005","13.966","0.003","15.197","0.004","90","","100.84","0.03","90","","1860","1.2","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N O5 -","- C20 H12 N O5 -","- C80 H48 N4 O20 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.075","","","","0.126","","","","","","1.578","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115212","9.315","0.005","14.04","0.004","14.713","0.003","90","","101.91","0.02","90","","1882.8","1.2","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 N O5 -","- C25 H12 N O3 -","- C100 H48 N4 O12 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.082","","","","0.13","","","","","","1.617","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115213","7.431","0.004","9.034","0.007","21.104","0.004","90","","92.42","0.03","90","","1415.5","1.4","295.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 N O3 -","- C19 H13 N O3 -","- C76 H52 N4 O12 -","4","1","","Toshihiro Tanaka; Takashi Tasaki; Yasuhiro Aoyama","Acridinylresorcinol as a Self-Complementary Building Block of Robust Hydrogen-Bonded 2D Nets with Coordinative Saturation. Preservation of Crystal Structures upon Guest Alteration, Guest Removal, and Host Modification","Journal of the American Chemical Society","2002","124","","12453","12462","10.1021/ja026704l","","","0.7107","MoKα","","","0.074","","","","0.109","","","","","","1.36","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115214","7.7075","0.0003","7.7075","0.0003","44.782","0.001","90","","90","","120","","2303.89","0.14","103.2","","","","","","","","","","","4","P 32","P 32","145","","","","- C15 H19 N O7 -","- C15 H19 N O7 -","- C90 H114 N6 O42 -","6","2","","Kentaro Tanaka; Atsushi Tengeiji; Tatsuhisa Kato; Namiki Toyama; Motoo Shiro; Mitsuhiko Shionoya","Efficient Incorporation of a Copper Hydroxypyridone Base Pair in DNA","Journal of the American Chemical Society","2002","124","","12494","12498","10.1021/ja027175o","","","0.7107","MoKα","","","0.0386","","","","0.0947","","","","","","1.157","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115215","11.56","0.002","12.839","0.003","13.468","0.004","64.55","0.02","71.1","0.02","75.691","0.018","1693.9","0.8","180","2","180","2","","","","","","","","5","P -1","-P 1","2","Bis(bis(triphenylphosphiniminium))hexaazidosilicate","Bis(bis(P,P,P-triphenylphosphinimidato-κN)phosphor(1+)) hexaazidosilicate(2-)","","- C72 H60 N20 P4 Si -","- C72 H60 N20 P4 Si -","- C72 H60 N20 P4 Si -","1","0.5","","Alexander C. Filippou; Peter Portius; Gregor Schnakenburg","The Hexaazidosilicate(IV) Ion: Synthesis, Properties, and Molecular Structure","Journal of the American Chemical Society","2002","124","","12396","12397","10.1021/ja0273187","","","0.71073","MoKα","","0.0419","0.033","","","0.0814","0.0887","","","","","","1.044","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115216","10.3605","0.0009","19.9645","0.0017","35.428","0.003","90","","92.76","0.002","90","","7319.5","1.1","290","2","290","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","bis-ethylene-dithiotetrathiafulvalene pyridine gallium salt","bis-ethylene-dithiotetrathiafulvalene pyridine gallium salt","","- C51 H40 Ga N O13 S32 -","- C51.04 H40.04 Ga N0.96 O13 S32 -","- C204.16 H160.16 Ga4 N3.84 O52 S128 -","4","0.5","","Hiroki Akutsu; Akane Akutsu-Sato; Scott S. Turner; Delphine Le Pevelen; Peter Day; Vladimir Laukhin; Anne-Katrin Klehe; John Singleton; Derek A. Tocher; Michael R. Probert; Judith A. K. Howard","Effect of Included Guest Molecules on the Normal State Conductivity and Superconductivity of β''-(ET)4[(H3O)Ga(C2O4)3].G (G = Pyridine, Nitrobenzene)","Journal of the American Chemical Society","2002","124","","12430","12431","10.1021/ja0273849","","","0.71073","MoKα","","0.1184","0.0498","","","0.1185","0.1358","","","","","","0.84","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115217","10.2588","0.0001","19.7015","0.0001","34.9512","0.0003","90","","93.3665","0.0004","90","","7051.93","0.1","120","","120","","","","","","","","","5","C 1 2 1","C 2y","5","","bis-ethylene-dithiotetrathiafulvalene pyridine gallium salt","","- C52 H24 Ga O13 S32 -","- C52 H24 Ga O13 S32 -","- C208 H96 Ga4 O52 S128 -","4","1","","Hiroki Akutsu; Akane Akutsu-Sato; Scott S. Turner; Delphine Le Pevelen; Peter Day; Vladimir Laukhin; Anne-Katrin Klehe; John Singleton; Derek A. Tocher; Michael R. Probert; Judith A. K. Howard","Effect of Included Guest Molecules on the Normal State Conductivity and Superconductivity of β''-(ET)4[(H3O)Ga(C2O4)3].G (G = Pyridine, Nitrobenzene)","Journal of the American Chemical Society","2002","124","","12430","12431","10.1021/ja0273849","","","0.71073","MoKα","","","0.055","","","","0.0506","","","","","","1.1752","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115218","10.3547","0.0004","20.1508","0.0007","35.5424","0.0012","90","","92.571","0.001","90","","7408.7","0.5","290","2","290","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","bis-ethylene-dithiotetrathiafulvalene nitrobenzene gallium salt","bis-ethylene-dithiotetrathiafulvalene nitrobenzene gallium salt","","- C52 H40 Ga N O15 S32 -","- C52 H40 Ga N O15 S32 -","- C208 H160 Ga4 N4 O60 S128 -","4","0.5","","Hiroki Akutsu; Akane Akutsu-Sato; Scott S. Turner; Delphine Le Pevelen; Peter Day; Vladimir Laukhin; Anne-Katrin Klehe; John Singleton; Derek A. Tocher; Michael R. Probert; Judith A. K. Howard","Effect of Included Guest Molecules on the Normal State Conductivity and Superconductivity of β''-(ET)4[(H3O)Ga(C2O4)3].G (G = Pyridine, Nitrobenzene)","Journal of the American Chemical Society","2002","124","","12430","12431","10.1021/ja0273849","","","0.71073","MoKα","","0.1488","0.0636","","","0.1319","0.1637","","","","","","0.966","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115219","10.2782","0.0003","19.8733","0.0006","35.0431","0.0011","90","","93.423","0.001","90","","7145.2","0.4","100","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","bis-ethylene-dithiotetrathiafulvalene nitrobenz gallium salt","bis-ethylene-dithiotetrathiafulvalene nitrobenz gallium salt","","- C52 H40 Ga N O15 S32 -","- C52 H40 Ga N O15 S32 -","- C208 H160 Ga4 N4 O60 S128 -","4","0.5","","Hiroki Akutsu; Akane Akutsu-Sato; Scott S. Turner; Delphine Le Pevelen; Peter Day; Vladimir Laukhin; Anne-Katrin Klehe; John Singleton; Derek A. Tocher; Michael R. Probert; Judith A. K. Howard","Effect of Included Guest Molecules on the Normal State Conductivity and Superconductivity of β''-(ET)4[(H3O)Ga(C2O4)3].G (G = Pyridine, Nitrobenzene)","Journal of the American Chemical Society","2002","124","","12430","12431","10.1021/ja0273849","","","0.71073","MoKα","","0.0839","0.0414","","","0.0811","0.0924","","","","","","0.901","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115220","31.929","0.001","17.606","0.0005","13.816","0.0003","90","","111.289","0.001","90","","7236.6","0.3","158.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H38 Cl2 Cu2 N4 O8 S2 -","- C32 H38 Cl2 Cu2 N4 O8 S2 -","- C256 H304 Cl16 Cu16 N32 O64 S16 -","8","1","","Yoshiki Ueno; Yoshimitsu Tachi; Shinobu Itoh","Interconversion between Bis(μ-thiolato)dicopper(II) and Disulfide-Bridged Dicopper(I) Complexes Mediated by Chloride Ion","Journal of the American Chemical Society","2002","124","","12428","12429","10.1021/ja027397m","","","0.7107","MoKα","","","0.059","","","","0.088","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115221","16.009","0.001","11.4204","0.0005","22.914","0.002","90","","111.72","0.002","90","","3891.9","0.5","296.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C38 H50 Cl2 Cu2 N4 O2 S2 -","- C38 H50 Cl2 Cu2 N4 O2 S2 -","- C152 H200 Cl8 Cu8 N16 O8 S8 -","4","0.5","","Yoshiki Ueno; Yoshimitsu Tachi; Shinobu Itoh","Interconversion between Bis(μ-thiolato)dicopper(II) and Disulfide-Bridged Dicopper(I) Complexes Mediated by Chloride Ion","Journal of the American Chemical Society","2002","124","","12428","12429","10.1021/ja027397m","","","0.7107","MoKα","","","0.027","","","","0.041","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115222","12.166","0.0003","12.6181","0.0003","12.7139","0.0001","60.945","0.005","64.953","0.001","67.459","0.002","1506.24","0.08","153.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H38 Cl3 Cu3 N4 S2 -","- C24 H38 Cl3 Cu3 N4 S2 -","- C48 H76 Cl6 Cu6 N8 S4 -","2","1","","Yoshiki Ueno; Yoshimitsu Tachi; Shinobu Itoh","Interconversion between Bis(μ-thiolato)dicopper(II) and Disulfide-Bridged Dicopper(I) Complexes Mediated by Chloride Ion","Journal of the American Chemical Society","2002","124","","12428","12429","10.1021/ja027397m","","","0.7107","MoKα","","","0.035","","","","0.06","","","","","","0.988","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115223","14.73","0.02","18.51","0.02","21.25","0.03","100.249","0.01","106.678","0.01","101.871","0.01","5255","12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C111 H131.5 Cl N5 O13.5 -","- C111 H130 Cl N5 O13.5 -","- C222 H260 Cl2 N10 O27 -","2","1","","James A. Wisner; Paul D. Beer; Michael G. B. Drew; Mark R. Sambrook","Anion-Templated Rotaxane Formation","Journal of the American Chemical Society","2002","124","","12469","12476","10.1021/ja027519a","","","0.71073","MoKα","","0.3247","0.1133","","","0.2856","0.344","","","","","","0.882","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115224","14.771","0.003","5.0353","0.0008","26.11","0.004","90","","98.8","0.005","90","","1919.1","0.6","100","","100","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C19 H23 Br N O4 -","- C19 H19 Br N O4 -","- C76 H76 Br4 N4 O16 -","4","1","","Douglass F. Taber; Timothy D. Neubert; Arnold L. Rheingold","Synthesis of (-)-Morphine","Journal of the American Chemical Society","2002","124","","12416","12417","10.1021/ja027882h","","","0.71073","MoKα","","0.0716","0.0553","","","0.1298","0.1357","","","","","","0.949","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115225","11.201","0.001","19.401","0.002","40.438","0.006","90","","90","","90","","8787.6","1.8","253.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C76 H130 N12 O19 S -","- C76 H130 N12 O19 S -","- C304 H520 N48 O76 S4 -","4","1","","Keiichi Yamada; Masafumi Unno; Kyoko Kobayashi; Hiroyuki Oku; Hatsuo Yamamura; Shuki Araki; Hideyuki Matsumoto; Ryoichi Katakai; Masao Kawai","Stereochemistry of Protected Ornithine Side Chains of Gramicidin S Derivatives: X-ray Crystal Structure of the Bis-Boc-tetra-N-methyl Derivative of Gramicidin S","Journal of the American Chemical Society","2002","124","","12684","12688","10.1021/ja020307t","","","0.7092","MoKα","","","0.0877","","","","0.244","","","","","","1.464","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115226","21.14","0.003","15.975","0.001","18.6212","0.0004","90","","98.0586","0.0004","90","","6226.5","1","293.2","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H64 Cl2 Mn2 N10 Ni O14 -","- C62 H62 Cl2 Mn2 N10 Ni O14 -","- C248 H248 Cl8 Mn8 N40 Ni4 O56 -","4","0.5","","Rodolphe Clérac; Hitoshi Miyasaka; Masahiro Yamashita; Claude Coulon","Evidence for Single-Chain Magnet Behavior in a MnIII-NiII Chain Designed with High Spin Magnetic Units: A Route to High Temperature Metastable Magnets","Journal of the American Chemical Society","2002","124","","12837","12844","10.1021/ja0203115","","","0.7107","MoKα","","","0.0573","","","","0.157","","","","","","1.734","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115227","11.4255","0.0017","19.727","0.003","11.9028","0.0018","90","","93.776","0.004","90","","2677","0.7","100","","100","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H80 Eu N7 O21 -","- C44 H80 Eu N7 O21 -","- C88 H160 Eu2 N14 O42 -","2","1","","Rachel S. Dickins; Silvio Aime; Andrei S. Batsanov; Andrew Beeby; Mauro Botta; James I. Bruce; Judith A. K. Howard; Christine S. Love; David Parker; Robert D. Peacock; Horst Puschmann","Structural, Luminescence, and NMR Studies of the Reversible Binding of Acetate, Lactate, Citrate, and Selected Amino Acids to Chiral Diaqua Ytterbium, Gadolinium, and Europium Complexes","Journal of the American Chemical Society","2002","124","","12697","12705","10.1021/ja020836x","","","0.71073","MoKα","","0.0374","0.0304","","","0.0675","0.0705","","","","","","1.018","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115228","12.277","0.004","16.04","0.004","13.227","0.004","90","","102.2","0.02","90","","2545.9","1.3","120","2","120","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C42 H62 F6 N7 O14 S2 Yb -","- C42 H62 F6 N7 O14 S2 Yb -","- C84 H124 F12 N14 O28 S4 Yb2 -","2","1","","Rachel S. Dickins; Silvio Aime; Andrei S. Batsanov; Andrew Beeby; Mauro Botta; James I. Bruce; Judith A. K. Howard; Christine S. Love; David Parker; Robert D. Peacock; Horst Puschmann","Structural, Luminescence, and NMR Studies of the Reversible Binding of Acetate, Lactate, Citrate, and Selected Amino Acids to Chiral Diaqua Ytterbium, Gadolinium, and Europium Complexes","Journal of the American Chemical Society","2002","124","","12697","12705","10.1021/ja020836x","","","0.71073","MoKα","","0.0248","0.0234","","","0.0566","0.0574","","","","","","1.075","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115229","11.392","0.002","11.591","0.002","12.421","0.002","64.3","0.01","78.19","0.01","63.07","0.01","1317.6","0.4","120","2","120","2","","","","","","","","7","P 1","P 1","1","","","","- C43 H65 F6 N8 O14 S2 Yb -","- C43 H65 F6 N8 O14 S2 Yb -","- C43 H65 F6 N8 O14 S2 Yb -","1","1","","Rachel S. Dickins; Silvio Aime; Andrei S. Batsanov; Andrew Beeby; Mauro Botta; James I. Bruce; Judith A. K. Howard; Christine S. Love; David Parker; Robert D. Peacock; Horst Puschmann","Structural, Luminescence, and NMR Studies of the Reversible Binding of Acetate, Lactate, Citrate, and Selected Amino Acids to Chiral Diaqua Ytterbium, Gadolinium, and Europium Complexes","Journal of the American Chemical Society","2002","124","","12697","12705","10.1021/ja020836x","","","0.71073","MoKα","","0.0225","0.0225","","","0.0497","0.0497","","","","","","1.015","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115230","11.288","0.002","11.981","0.002","12.454","0.002","64.7","0.01","76.53","0.01","62.42","0.01","1348.4","0.4","120","2","120","2","","","","","","","","7","P 1","P 1","1","","","","- C44 H66 F6 N8 O15 S2 Yb -","- C44 H66 F6 N8 O15 S2 Yb -","- C44 H66 F6 N8 O15 S2 Yb -","1","1","","Rachel S. Dickins; Silvio Aime; Andrei S. Batsanov; Andrew Beeby; Mauro Botta; James I. Bruce; Judith A. K. Howard; Christine S. Love; David Parker; Robert D. Peacock; Horst Puschmann","Structural, Luminescence, and NMR Studies of the Reversible Binding of Acetate, Lactate, Citrate, and Selected Amino Acids to Chiral Diaqua Ytterbium, Gadolinium, and Europium Complexes","Journal of the American Chemical Society","2002","124","","12697","12705","10.1021/ja020836x","","","0.71073","MoKα","","0.0253","0.0253","","","0.0634","0.0634","","","","","","1.022","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115231","27.615","0.009","27.648","0.009","28.548","0.009","90","","112.761","0.006","90","","20099","11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","UCR-16","","","- C84.5 H182 Cu5 In30 N13 S54 -","- C2 Cu5.26 In29.74 S54 -","- C8 Cu21.04 In118.96 S216 -","4","0.5","","Xianhui Bu; Nanfeng Zheng; Yuqi Li; Pingyun Feng","Pushing Up the Size Limit of Chalcogenide Supertetrahedral Clusters: Two- and Three-Dimensional Photoluminescent Open Frameworks from (Cu5In30S54)13- Clusters","Journal of the American Chemical Society","2002","124","","12646","12647","10.1021/ja021009z","","","0.71073","MoKα","","0.2302","0.0944","","","0.2944","0.3506","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115232","43.266","0.006","43.467","0.006","53.721","0.007","90","","90","","90","","101030","2","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","UCR-17","","","- C84.5 H182 Cu5 In30 N13 S54 -","- Cu4.74 In30.22 S54 -","- Cu75.84 In483.52 S864 -","16","0.5","","Xianhui Bu; Nanfeng Zheng; Yuqi Li; Pingyun Feng","Pushing Up the Size Limit of Chalcogenide Supertetrahedral Clusters: Two- and Three-Dimensional Photoluminescent Open Frameworks from (Cu5In30S54)13- Clusters","Journal of the American Chemical Society","2002","124","","12646","12647","10.1021/ja021009z","","","0.71073","MoKα","","0.1539","0.0735","","","0.2776","0.3123","","","","","","1.577","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115233","10.4824","0.0009","25.322","0.002","13.754","0.0012","90","","104.515","0.002","90","","3534.3","0.5","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H45 Mo N3 O6 -","- C34 H37 Mo N3 O5 -","- C136 H148 Mo4 N12 O20 -","4","2","","Shane W. Krska; David L. Hughes; Robert A. Reamer; David J. Mathre; Yongkui Sun; Barry M. Trost","The Unusual Role of CO Transfer in Molybdenum-Catalyzed Asymmetric Alkylations","Journal of the American Chemical Society","2002","124","","12656","12657","10.1021/ja028035h","","","0.71073","MoKα","","0.0627","0.0547","","","0.1525","0.1555","","","","","","1.05","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115234","10.1293","0.0006","10.428","0.001","13.195","0.001","90","","90","","90","","1393.77","0.19","299","","299","","","","","","","","local laboratory","4","P 21 21 21","P 2ac 2ab","19","","α-1-ammmonium-2(3-indolyl)-cyclohexanecarboxylate monohydrate","","- C15 H20 N2 O3 -","- C15 H20 N2 O3 -","- C60 H80 N8 O12 -","4","1","","Bo Liu; Reema K. Thalji; Paul D. Adams; Frank R. Fronczek; Mark L. McLaughlin; Mary D. Barkley","Fluorescence ofcis-1-Amino-2-(3-indolyl)cyclohexane-1-carboxylic Acid: A Single Tryptophan χ1Rotamer Model","Journal of the American Chemical Society","2002","124","","13329","13338","10.1021/ja016542d","","","1.54184","Cu-Kα","","0.032","0.03","","0.038","0.038","","","","1.639","1.636","1.636","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4115235","9.852","0.002","15.148","0.004","9.04","0.009","96.52","0.05","92.57","0.04","107.19","0.02","1276.1","1.4","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H33 N3 O9 S -","- C23 H33 N3 O9 S -","- C46 H66 N6 O18 S2 -","2","1","","Rui Tamura; Daisuke Fujimoto; Zsolt Lepp; Kentaro Misaki; Hideyuki Miura; Hiroki Takahashi; Takanori Ushio; Tadashi Nakai; Ken Hirotsu","Mechanism of Preferential Enrichment, an Unusual Enantiomeric Resolution Phenomenon Caused by Polymorphic Transition during Crystallization of Mixed Crystals Composed of Two Enantiomers","Journal of the American Chemical Society","2002","124","","13139","13153","10.1021/ja020454r","","","1.5418","CuKα","","0.0617","0.0617","","","0.1204","0.1204","","","","","","1.878","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115236","9.4967","0.0013","14.947","0.003","9.0688","0.0013","99.301","0.007","102.637","0.01","89.263","0.009","1239.3","0.4","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H34 N2 O7 S -","- C23 H33 N2 O7 S -","- C46 H66 N4 O14 S2 -","2","1","","Rui Tamura; Daisuke Fujimoto; Zsolt Lepp; Kentaro Misaki; Hideyuki Miura; Hiroki Takahashi; Takanori Ushio; Tadashi Nakai; Ken Hirotsu","Mechanism of Preferential Enrichment, an Unusual Enantiomeric Resolution Phenomenon Caused by Polymorphic Transition during Crystallization of Mixed Crystals Composed of Two Enantiomers","Journal of the American Chemical Society","2002","124","","13139","13153","10.1021/ja020454r","","","0.7107","MoKα","","","0.091","","","","0.157","","","","","","1.462","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115237","9.337","0.002","16.2932","0.0007","9.338","0.003","100.57","0.02","103.63","0.01","80.88","0.01","1347.2","0.5","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H35 N3 O9 S -","- C24 H32 N3 O9 S -","- C48 H64 N6 O18 S2 -","2","1","","Rui Tamura; Daisuke Fujimoto; Zsolt Lepp; Kentaro Misaki; Hideyuki Miura; Hiroki Takahashi; Takanori Ushio; Tadashi Nakai; Ken Hirotsu","Mechanism of Preferential Enrichment, an Unusual Enantiomeric Resolution Phenomenon Caused by Polymorphic Transition during Crystallization of Mixed Crystals Composed of Two Enantiomers","Journal of the American Chemical Society","2002","124","","13139","13153","10.1021/ja020454r","","","1.5418","CuKα","","","0.065","","","","0.089","","","","","","1.143","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115238","6.5805","0.0004","13.1199","0.0012","16.299","0.002","76.31","0.004","83.043","0.005","80.41","0.005","1343.2","0.2","296.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H34 N2 O7 S -","- C24 H34 N3 O8 S -","- C48 H68 N6 O16 S2 -","2","1","","Rui Tamura; Daisuke Fujimoto; Zsolt Lepp; Kentaro Misaki; Hideyuki Miura; Hiroki Takahashi; Takanori Ushio; Tadashi Nakai; Ken Hirotsu","Mechanism of Preferential Enrichment, an Unusual Enantiomeric Resolution Phenomenon Caused by Polymorphic Transition during Crystallization of Mixed Crystals Composed of Two Enantiomers","Journal of the American Chemical Society","2002","124","","13139","13153","10.1021/ja020454r","","","0.7107","MoKα","","","0.049","","","","0.077","","","","","","0.927","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115239","12.376","0.0007","12.6209","0.0007","24.2159","0.0014","77.939","0.001","86.699","0.001","67.087","0.001","3405.9","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C34 H68 F12 N6 O25 P4 Ru2 S6 -","- C34 H64 F12 N6 O25.86 P4 Ru2 S5.625 -","- C68 H128 F24 N12 O51.72 P8 Ru4 S11.25 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.0868","0.0691","","","0.2059","0.2244","","","","","","1.043","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115240","12.354","0.003","14.255","0.004","18.387","0.005","90","","96.553","0.005","90","","3216.9","1.5","293","2","293","2","","","","","","","","8","P 1 n 1","P -2yac","7","","","","- C32 H60 F12 N6 O24 P4 Ru2 S6 -","- C32 H60 F12 N6 O24 P4 Ru2 S6 -","- C64 H120 F24 N12 O48 P8 Ru4 S12 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.0882","0.0684","","","0.182","0.2029","","","","","","0.992","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115241","11.9505","0.0014","12.4584","0.0015","26.732","0.003","87.759","0.003","89.973","0.003","62.913","0.002","3540","0.7","124","2","124","2","","","","","","","","8","P -1","-P 1","2","","","","- C38 H70 F12 N6 O27 P4 Ru2 S6 -","- C38 H70 F12 N6 O27 P4 Ru2 S6 -","- C76 H140 F24 N12 O54 P8 Ru4 S12 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.259","0.0893","","","0.1902","0.255","","","","","","0.868","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115242","12.554","0.003","13.37","0.003","23.69","0.005","75.364","0.004","82.408","0.004","70.574","0.004","3623.2","1.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C38 H67 F12 N7 O25 P4 Ru2 S6 -","- C38 H58 F12 N7 O25 P4 Ru2 S6 -","- C76 H116 F24 N14 O50 P8 Ru4 S12 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.1965","0.09","","","0.2284","0.2865","","","","","","0.923","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115243","12.4374","0.001","13.4864","0.0011","19.6247","0.0016","104.868","0.001","93.109","0.002","93.599","0.002","3166.8","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H58 F12 N6 O25 P4 Ru2 S6 -","- C31 H58 F12 N6 O25 P4 Ru2 S6 -","- C62 H116 F24 N12 O50 P8 Ru4 S12 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.1363","0.1105","","","0.3356","0.3626","","","","","","1.455","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115244","12.48","0.006","34.563","0.016","15.179","0.007","90","","95.785","0.01","90","","6514","5","124","2","124","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C35 H62 F12 N6 O25 P4 Ru2 S6 -","- C35 H62 F12 N6 O25 P4 Ru2 S6 -","- C140 H248 F48 N24 O100 P16 Ru8 S24 -","4","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.338","0.1132","","","0.2492","0.3338","","","","","","0.867","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115245","13.0023","0.0008","14.5983","0.0009","15.9613","0.001","83.442","0.001","87.359","0.001","85.903","0.001","2999.9","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H57 F9 N6 O22 P4 Ru2 S5 -","- C31 H54 F9 N6 O22 P4 Ru2 S5 -","- C62 H108 F18 N12 O44 P8 Ru4 S10 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.1675","0.0994","","","0.265","0.312","","","","","","1.001","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115246","12.5969","0.0011","13.7742","0.0012","18.7252","0.0017","90.962","0.002","90.459","0.002","107.41","0.002","3099.5","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C33 H61 F9 N6 O22 P4 Ru2 S5 -","- C33.04 H37 F9 N6 O22 P4 Ru2 S5 -","- C66.08 H74 F18 N12 O44 P8 Ru4 S10 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.0991","0.0871","","","0.2122","0.2226","","","","","","1.033","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115247","13.089","0.006","16.069","0.007","17.022","0.007","88.661","0.009","87.729","0.01","78.099","0.009","3500","3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H64 F12 N6 O24 P4 Ru2 S6 -","- C36 H64 F12 N6 O24 P4 Ru2 S6 -","- C72 H128 F24 N12 O48 P8 Ru4 S12 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.2888","0.1009","","","0.2473","0.3472","","","","","","0.804","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115248","12.132","0.005","12.597","0.005","26.036","0.01","100.335","0.007","92.309","0.007","115.124","0.007","3514","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C35 H65 F12 N5 O25 P4 Ru2 S6 -","- C35 H56 F12 N5 O25 P4 Ru2 S6 -","- C70 H112 F24 N10 O50 P8 Ru4 S12 -","2","1","","Kazuko Matsumoto; Yoshihiro Moriya; Hiroyasu Sugiyama; Md. Munkir Hossain; Yong-Shou Lin","Dehydration Reaction of Hydroxyl Substituted Alkenes and Alkynes on the Ru2S2 Complex","Journal of the American Chemical Society","2002","124","","13106","13113","10.1021/ja020660z","","","0.71073","MoKα","","0.1847","0.1167","","","0.3366","0.3877","","","","","","1.287","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115249","17.995","0.002","13.483","0.001","18.008","0.002","90","","90.06","0.008","90","","4369.2","0.8","130","","130","1","","","","","","","see text","5","P 1 2/c 1","-P 2yc","13","","","","- C52 H66 B O2 Ti -","- C208 H259.104 B4 O8 Ti4 -","- C208 H259.104 B4 O8 Ti4 -","1","0.25","","Marco W. Bouwkamp; Jeanette de Wolf; Isabel del Hierro Morales; Jeroen Gercama; Auke Meetsma; Sergei I. Troyanov; Bart Hessen; Jan H. Teuben","Structure of the Decamethyl Titanocene Cation, a Metallocene with Two Agostic C-H Bonds, and Its Interaction with Fluorocarbons","Journal of the American Chemical Society","2002","124","","12956","12957","10.1021/ja027617w","","","0.71073","MoKα","","","0.1322","","","0.0535","","","","","","","1.025","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115250","11.992","0.001","13.649","0.002","14.883","0.001","90.95","0.01","109.499","0.008","90.865","0.009","2295.5","0.4","130","","130","1","","","","","","","see text","5","P -1","-P 1","2","","","","- C56 H60 B F2 Ti -","- C56 H60 B F2 Ti -","- C112 H120 B2 F4 Ti2 -","2","1","","Marco W. Bouwkamp; Jeanette de Wolf; Isabel del Hierro Morales; Jeroen Gercama; Auke Meetsma; Sergei I. Troyanov; Bart Hessen; Jan H. Teuben","Structure of the Decamethyl Titanocene Cation, a Metallocene with Two Agostic C-H Bonds, and Its Interaction with Fluorocarbons","Journal of the American Chemical Society","2002","124","","12956","12957","10.1021/ja027617w","","","0.71073","MoKα","","","0.0536","","","0.1407","","","","","","","1.115","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115251","13.3636","0.0007","15.06","0.0007","17.7873","0.0009","97.131","0.001","90.604","0.001","91.97","0.001","3549.6","0.3","100","1","100","1","","","","","","","see text","4","P -1","-P 1","2","","","","- C44 H50 B Ti -","- C44 H50 B Ti -","- C176 H200 B4 Ti4 -","4","2","","Marco W. Bouwkamp; Jeanette de Wolf; Isabel del Hierro Morales; Jeroen Gercama; Auke Meetsma; Sergei I. Troyanov; Bart Hessen; Jan H. Teuben","Structure of the Decamethyl Titanocene Cation, a Metallocene with Two Agostic C-H Bonds, and Its Interaction with Fluorocarbons","Journal of the American Chemical Society","2002","124","","12956","12957","10.1021/ja027617w","","","0.71073","MoKα","","0.1079","0.0532","","","0.1074","0.1265","","","","","","0.986","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115252","19.623","0.003","19.623","0.003","24.818","0.005","90","","90","","90","","9556","3","143","2","143","2","","","","","","","","7","P 42/n m c :2","-P 4ac 2a","137","","","","- C62 H165 Cd6 In28 N12 O14 S61 -","- Cd6 In28 S54 -","- Cd12 In56 S108 -","2","0.125","","Weiping Su; Xiaoying Huang; Jing Li; Huaxiang Fu","Crystal of Semiconducting Quantum Dots Built on Covalently Bonded T5 [In28Cd6S54]-12: The Largest Supertetrahedral Cluster in Solid State","Journal of the American Chemical Society","2002","124","","12944","12945","10.1021/ja027830s","","","0.71073","MoKα","","0.1278","0.098","","","0.1866","0.1976","","","","","","1.459","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115253","9.155","0.004","10.436","0.004","14.964","0.007","92.53","0.04","93.83","0.02","100.34","0.03","1401","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H27 I2 O P2 Rh -","- C28 H27 I2 O P2 Rh -","- C56 H54 I4 O2 P4 Rh2 -","2","1","","Luca Gonsalvi; Harry Adams; Glenn J. Sunley; Evert Ditzel; Anthony Haynes","Steric and Electronic Effects on the Reactivity of Rh and Ir Complexes Containing P-S, P-P, and P-O Ligands. Implications for the Effects of Chelate Ligands in Catalysis","Journal of the American Chemical Society","2002","124","","13597","13612","10.1021/ja0176191","","","0.71073","MoKα","","0.0653","0.0456","","0.1659","0.1117","","","","1.101","1.125","1.125","","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115254","10.2276","0.001","16.9486","0.0017","17.2942","0.0016","90","","102.196","0.002","90","","2930.2","0.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H27 I2 Ir O P2 S -","- C28 H27 I2 Ir O P2 S -","- C112 H108 I8 Ir4 O4 P8 S4 -","4","1","","Luca Gonsalvi; Harry Adams; Glenn J. Sunley; Evert Ditzel; Anthony Haynes","Steric and Electronic Effects on the Reactivity of Rh and Ir Complexes Containing P-S, P-P, and P-O Ligands. Implications for the Effects of Chelate Ligands in Catalysis","Journal of the American Chemical Society","2002","124","","13597","13612","10.1021/ja0176191","","","0.71073","MoKα","","0.0477","0.0405","","","0.1001","0.1074","","","","","","1.079","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115255","10.7366","0.0009","15.6551","0.0013","20.1261","0.0016","90","","94.248","0.002","90","","3373.6","0.5","150","2","150","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C29 H27 Cl2 F3 I Ir O4 P2 S2 -","- C29 H27 Cl2 F3 I Ir O4 P2 S2 -","- C116 H108 Cl8 F12 I4 Ir4 O16 P8 S8 -","4","1","","Luca Gonsalvi; Harry Adams; Glenn J. Sunley; Evert Ditzel; Anthony Haynes","Steric and Electronic Effects on the Reactivity of Rh and Ir Complexes Containing P-S, P-P, and P-O Ligands. Implications for the Effects of Chelate Ligands in Catalysis","Journal of the American Chemical Society","2002","124","","13597","13612","10.1021/ja0176191","","","0.71073","MoKα","","0.0554","0.0413","","","0.0974","0.1098","","","","","","1.066","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115256","10.096","0.002","14.489","0.003","20.967","0.004","90","","99.76","0.03","90","","3022.7","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 I2 N O2 P2 Rh -","- C29 H28 I2 N O2 P2 Rh -","- C116 H112 I8 N4 O8 P8 Rh4 -","4","1","","Luca Gonsalvi; Harry Adams; Glenn J. Sunley; Evert Ditzel; Anthony Haynes","Steric and Electronic Effects on the Reactivity of Rh and Ir Complexes Containing P-S, P-P, and P-O Ligands. Implications for the Effects of Chelate Ligands in Catalysis","Journal of the American Chemical Society","2002","124","","13597","13612","10.1021/ja0176191","","","0.71073","MoKα","","0.1479","0.074","","","0.1576","0.1899","","","","","","1.04","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115257","3.8762","0.0001","27.0486","0.0007","11.6628","0.0003","90","","97.646","0.0016","90","","1211.92","0.05","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1Z)-naphthalene-1,2-dione 1-[(4-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0539","0.0403","","","0.0998","0.1105","","","","","","1.051","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115258","3.8978","0.0001","27.0734","0.0008","11.6656","0.0003","90","","97.558","0.0019","90","","1220.34","0.06","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1Z)-naphthalene-1,2-dione 1-[(4-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0565","0.043","","","0.1027","0.1138","","","","","","1.069","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115259","3.9237","0.0001","27.1083","0.0008","11.669","0.0002","90","","97.52","0.0013","90","","1230.5","0.05","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1Z)-naphthalene-1,2-dione 1-[(4-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0599","0.0423","","","0.1012","0.1139","","","","","","1.044","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115260","3.9825","0.0001","27.1459","0.001","11.6686","0.0004","90","","97.598","0.002","90","","1250.4","0.07","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1Z)-naphtthalene-1,2-dione 1-[(4-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0695","0.0482","","","0.1096","0.1253","","","","","","1.124","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115261","23.6288","0.0006","7.2487","0.0002","7.1894","0.0002","90","","90","","90","","1231.39","0.06","100","","100","","","","","","","","","5","P c a 21","P 2c -2ac","29","","(1Z)-naphthalene-1,2-dione 1-[(2-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0435","0.0357","","","0.0769","0.0805","","","","","","1.07","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115262","23.6614","0.0007","7.258","0.0002","7.2182","0.0002","90","","90","","90","","1239.61","0.06","150","","150","","","","","","","","","5","P c a 21","P 2c -2ac","29","","(1Z)-naphthalene-1,2-dione 1-[(2-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0574","0.0394","","","0.0789","0.0862","","","","","","1.059","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115263","23.7049","0.0009","7.2711","0.0003","7.2535","0.0003","90","","90","","90","","1250.22","0.09","200","","200","","","","","","","","","5","P c a 21","P 2c -2ac","29","","(1Z)-naphthalene-1,2-dione 1-[(2-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0468","0.0385","","","0.0846","0.091","","","","","","1.129","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115264","23.78","0.001","7.2962","0.0004","7.3283","0.0005","90","","90","","90","","1271.49","0.12","295","","295","","","","","","","","","5","P c a 21","P 2c -2ac","29","","(1Z)-naphthalene-1,2-dione 1-[(2-fluorophenyl)hydrazone]","","- C16 H11 F N2 O -","- C16 H11 F N2 O -","- C64 H44 F4 N8 O4 -","4","1","","Paola Gilli; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Gastone Gilli","The Nature of Solid-State N-H...O/O-H...N Tautomeric Competition in Resonant Systems. Intramolecular Proton Transfer in Low-Barrier Hydrogen Bonds Formed by the ...OC-CN-NH... <‒> ...HO-CC-NN... Ketohydrazone-Azoenol System. A Variable-Temperature X-ray Crystallographic and DFT Computational Study","Journal of the American Chemical Society","2002","124","","13554","13567","10.1021/ja020589x","","","0.7107","MoKα","","0.0618","0.0482","","","0.0991","0.1071","","","","","","1.226","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115265","14.3791","0.0011","11.7604","0.0009","11.723","0.0009","90","","91.02","0.02","90","","1982.1","0.3","203","2","203","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","Bis(tBu)dihydrodimethylpyrene","","","- C26 H32 -","- C26 H32 -","- C104 H128 -","4","0.5","","Richard Vaughan Williams; John R. Armantrout; Brendan Twamley; Reginald H. Mitchell; Timothy R. Ward; Subhajit Bandyopadhyay","A Theoretical and Experimental Scale of Aromaticity. The First Nucleus-Independent Chemical Shifts (NICS) Study of the Dimethyldihydropyrene Nucleus","Journal of the American Chemical Society","2002","124","","13495","13505","10.1021/ja020595t","","","0.71073","MoKα","","0.0637","0.0419","","","0.1007","0.1124","","","","","","1.016","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115266","12.701","0.009","9.569","0.007","38.07","0.03","90","","90","","90","","4627","6","203","2","203","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","Phenyl-bis(tBu)dihydrodimethylpyrene","","","- C30 H34 -","- C30 H34 -","- C240 H272 -","8","1","","Richard Vaughan Williams; John R. Armantrout; Brendan Twamley; Reginald H. Mitchell; Timothy R. Ward; Subhajit Bandyopadhyay","A Theoretical and Experimental Scale of Aromaticity. The First Nucleus-Independent Chemical Shifts (NICS) Study of the Dimethyldihydropyrene Nucleus","Journal of the American Chemical Society","2002","124","","13495","13505","10.1021/ja020595t","","","0.71073","MoKα","","0.134","0.0629","","","0.1383","0.1657","","","","","","1.023","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115267","10.13","0.002","15.444","0.003","11.761","0.003","90","","114.03","0.004","90","","1680.5","0.6","158","2","158","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C33 H43 N O7 S -","- C33 H43 N O7 S -","- C66 H86 N2 O14 S2 -","2","1","","Joseph P. Marino; Maria B. Rubio; Ganfeng Cao; Alfonso de Dios","Total Synthesis of (+)-Aspidospermidine: A New Strategy for the Enantiospecific Synthesis of Aspidosperma Alkaloids","Journal of the American Chemical Society","2002","124","","13398","13399","10.1021/ja026357f","","","0.71073","MoKα","","0.0821","0.0704","","","0.1819","0.1908","","","","","","1.103","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115268","11.871","0.0001","14.7773","0.0001","15.1011","0.0002","98.764","0.001","113.107","0.001","113.387","0.001","2082.06","0.05","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C81 H62 Cl18 N12 O4 -","- C74 H54 Cl18 N12 O4 -","- C74 H54 Cl18 N12 O4 -","1","0.5","","Jonathan L. Sessler; Hiromitsu Maeda; Toshihisa Mizuno; Vincent M. Lynch; Hiroyuki Furuta","Quinoxaline-Bridged Porphyrinoids","Journal of the American Chemical Society","2002","124","","13474","13479","10.1021/ja0273750","","","0.71073","MoKα","","0.0899","0.064","","","0.1363","0.1413","","","","","","2.41","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115269","11.3486","0.0002","11.4566","0.0002","15.2482","0.0003","112.061","0.001","95.776","0.001","102.885","0.001","1753.4","0.06","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H52 Cl12 N12 O4 -","- C72 H52 Cl12 N12 O4 -","- C72 H52 Cl12 N12 O4 -","1","0.5","","Jonathan L. Sessler; Hiromitsu Maeda; Toshihisa Mizuno; Vincent M. Lynch; Hiroyuki Furuta","Quinoxaline-Bridged Porphyrinoids","Journal of the American Chemical Society","2002","124","","13474","13479","10.1021/ja0273750","","","0.71073","MoKα","","0.1791","0.0797","","","0.1079","0.137","","","","","","1.037","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115270","7.488","0.0003","15.8282","0.0006","18.6874","0.0008","103.797","0.002","92.751","0.002","102.723","0.002","2086.29","0.15","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H62 Cl18 N12 O4 -","- C76 H60 Cl12 N12 O4 -","- C76 H60 Cl12 N12 O4 -","1","0.5","","Jonathan L. Sessler; Hiromitsu Maeda; Toshihisa Mizuno; Vincent M. Lynch; Hiroyuki Furuta","Quinoxaline-Bridged Porphyrinoids","Journal of the American Chemical Society","2002","124","","13474","13479","10.1021/ja0273750","","","0.71073","MoKα","","0.1577","0.0866","","","0.1544","0.1668","","","","","","1.606","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115271","14.2","0.001","9.8919","0.0007","23.384","0.002","90","","92.757","0.002","90","","3280.8","0.4","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H31 Cl3 O2 -","- C38 H31 Cl3 O2 -","- C152 H124 Cl12 O8 -","4","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.1345","","","","0.2132","","","","","","4.382","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115272","7.601","0.006","9.651","0.004","26.999","0.004","90","","95.76","0.03","90","","1970.6","1.8","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 Cl N O4 -","- C21 H20 Cl N O4 -","- C84 H80 Cl4 N4 O16 -","4","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0555","","","","0.1747","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115273","10.499","0.003","13.601","0.003","13.298","0.002","90","","108.39","0.02","90","","1801.9","0.7","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 Cl N O4 -","- C19 H18 Cl N O4 -","- C76 H72 Cl4 N4 O16 -","4","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0721","","","","0.0781","","","","","","2.333","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115274","11.656","0.002","12.003","0.002","7.257","0.003","92.12","0.02","101.38","0.02","91.17","0.02","994.3","0.5","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H21 N O4 -","- C23 H21 N O4 -","- C46 H42 N2 O8 -","2","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0467","","","","0.1778","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115275","10.421","0.002","12.772","0.002","10.248","0.001","91.75","0.01","110.754","0.009","106.06","0.01","1213.1","0.3","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H22 N2 O8 -","- C26 H22 N2 O8 -","- C52 H44 N4 O16 -","2","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0443","","","","0.1562","","","","","","0.988","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115276","23.703","0.002","23.703","0.002","10.2725","0.0007","90","","90","","90","","5771.4","0.8","296.2","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C17 H18 O2 -","- C17 H18 O2 -","- C272 H288 O32 -","16","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0361","","","","0.0783","","","","","","0.658","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115277","16.063","0.002","16.375","0.002","5.6664","0.0009","90","","96.211","0.004","90","","1481.7","0.3","296.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C17 H22 O2 -","- C17 H22 O2 -","- C68 H88 O8 -","4","1","","Makoto Yasuda; Kay Hirata; Mitsuyoshi Nishino; Akihiro Yamamoto; Akio Baba","Diastereoselective Addition of γ-Substituted Allylic Nucleophiles to Ketones: Highly Stereoselective Synthesis of Tertiary Homoallylic Alcohols Using an Allylic Tributylstannane/Stannous Chloride System","Journal of the American Chemical Society","2002","124","","13442","13447","10.1021/ja0274047","","","0.7107","MoKα","","","0.0651","","","","0.1462","","","","","","2.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115278","12.4234","0.0006","12.3944","0.0006","7.8787","0.0003","90","","90.012","0.001","90","","1213.17","0.09","301","2","301","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 Br Cl F I -","- C10 H12 Br Cl F I -","- C40 H48 Br4 Cl4 F4 I4 -","4","1","","Peter R. Schreiner; Andrey A. Fokin; Oliver Lauenstein; Yoshio Okamoto; Tsuneki Wakita; Christopher Rinderspacher; Gregory H. Robinson; Jason K. Vohs; Charles F. Campana","Pseudotetrahedral Polyhaloadamantanes as Chirality Probes: Synthesis, Separation, and Absolute Configuration","Journal of the American Chemical Society","2002","124","","13348","13349","10.1021/ja0274195","","","0.71073","MoKα","","0.0957","0.0879","","","0.2187","0.2226","","","","","","1.321","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115279","6.971","0.003","8.667","0.002","15.737","0.002","80.81","0.01","88.21","0.02","66.44","0.02","859.8","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H33 Br N -","- C15 H33 Br N -","- C30 H66 Br2 N2 -","2","1","","Damien Berthier; Thierry Buffeteau; Jean-Michel Léger; Reiko Oda; Ivan Huc","From Chiral Counterions to Twisted Membranes","Journal of the American Chemical Society","2002","124","","13486","13494","10.1021/ja027660j","","","1.54178","CuKα","","0.0503","0.0471","","0.1442","0.1384","","","","1.034","1.043","1.043","","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115280","8.241","0.001","9.356","0.001","14.281","0.001","74.423","0.01","85.333","0.01","71.042","0.01","1003.11","0.19","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H37 Br N2 O3 -","- C17 H33 Br N O2.85 -","- C34 H66 Br2 N2 O5.7 -","2","1","","Damien Berthier; Thierry Buffeteau; Jean-Michel Léger; Reiko Oda; Ivan Huc","From Chiral Counterions to Twisted Membranes","Journal of the American Chemical Society","2002","124","","13486","13494","10.1021/ja027660j","","","1.5418","CuKα","","0.2056","0.1121","","","0.2584","0.3217","","","","","","1.036","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115281","33.922","0.002","10.165","0.001","19.071","0.002","90","","90.268","0.008","90","","6575.9","1","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C35 H31 N11 -","- C35 H31 N11 -","- C280 H248 N88 -","8","1","","David B. Kimball; Timothy J. R. Weakley; Rainer Herges; Michael M. Haley","Deciphering the Mechanistic Dichotomy in the Cyclization of 1-(2-Ethynylphenyl)-3,3-dialkyltriazenes: Competition between Pericyclic and Pseudocoarctate Pathways","Journal of the American Chemical Society","2002","124","","13463","13473","10.1021/ja027809r","","","0.71073","MoKα","","0.066","0.051","","0.102","","0.05","","","1.62","","","1.85","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115282","8.503","0.002","14.849","0.002","16.74","0.002","90","","100.59","0.02","90","","2077.6","0.6","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H25 N3 -","- C25 H25 N3 -","- C100 H100 N12 -","4","1","","David B. Kimball; Timothy J. R. Weakley; Rainer Herges; Michael M. Haley","Deciphering the Mechanistic Dichotomy in the Cyclization of 1-(2-Ethynylphenyl)-3,3-dialkyltriazenes: Competition between Pericyclic and Pseudocoarctate Pathways","Journal of the American Chemical Society","2002","124","","13463","13473","10.1021/ja027809r","","","0.71073","MoKα","","0.116","0.08","","0.141","","0.068","","","1.61","","","2.09","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115283","12.7216","0.0019","15.1679","0.0019","25.883","0.004","79.492","0.012","86.2","0.012","69.796","0.009","4608.4","1.2","183","2","183","2","","","","","","","","7","P -1","-P 1","2","","","","- C98.25 H62.5 Cl7 F4.5 N4 O25 S4 -","- C97.5 H52 Cl7.26 F4.5 N4 O25 S4 -","- C195 H104 Cl14.52 F9 N8 O50 S8 -","2","1","","Howard M. Colquhoun; David J. Williams; Zhixue Zhu","Macrocyclic Aromatic Ether-Imide-Sulfones: Versatile Supramolecular Receptors with Extreme Thermochemical and Oxidative Stability","Journal of the American Chemical Society","2002","124","","13346","13347","10.1021/ja027851m","","","1.54178","CuKα","","0.1447","0.0863","","0.2174","0.193","","","","1.139","1.268","1.268","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115284","11.037","0.002","12.434","0.002","21.401","0.002","100.791","0.012","91.485","0.011","111.457","0.013","2670.7","0.8","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C54.3 H36.6 Cl9.6 N2 O10 S2 -","- C50 H28 N2 O10 S2 -","- C100 H56 N4 O20 S4 -","2","1","","Howard M. Colquhoun; David J. Williams; Zhixue Zhu","Macrocyclic Aromatic Ether-Imide-Sulfones: Versatile Supramolecular Receptors with Extreme Thermochemical and Oxidative Stability","Journal of the American Chemical Society","2002","124","","13346","13347","10.1021/ja027851m","","","1.54178","CuKα","","0.1122","0.0869","","0.2321","0.2214","","","","1.481","1.775","1.775","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115285","9.8199","0.0006","36.2332","0.0012","17.4128","0.0007","90","","106.171","0.004","90","","5950.5","0.5","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H54 N4 O12 S2 -","- C76 H54 N4 O12 S2 -","- C304 H216 N16 O48 S8 -","4","1","","Howard M. Colquhoun; David J. Williams; Zhixue Zhu","Macrocyclic Aromatic Ether-Imide-Sulfones: Versatile Supramolecular Receptors with Extreme Thermochemical and Oxidative Stability","Journal of the American Chemical Society","2002","124","","13346","13347","10.1021/ja027851m","","","1.54178","CuKα","","0.0595","0.0423","","0.1147","0.1014","","","","1.042","1.084","1.084","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115286","21.651","0.003","16.699","0.002","30.468","0.002","90","","90","","90","","11016","2","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C122 H76 Cl8 N6 O22 Pd S4 -","- C122 H76 Cl8 N6 O22 Pd S4 -","- C488 H304 Cl32 N24 O88 Pd4 S16 -","4","0.5","","Howard M. Colquhoun; David J. Williams; Zhixue Zhu","Macrocyclic Aromatic Ether-Imide-Sulfones: Versatile Supramolecular Receptors with Extreme Thermochemical and Oxidative Stability","Journal of the American Chemical Society","2002","124","","13346","13347","10.1021/ja027851m","","","1.54178","CuKα","","0.2447","0.0998","","0.283","0.1953","","","","1.081","1.347","1.347","","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115287","9.6206","0.0007","43.267","0.003","15.1111","0.0011","90","","95.257","0.006","90","","6263.6","0.8","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C146 H90 Cl12 N4 O22 S4 -","- C146 H90 Cl12 N4 O22 S4 -","- C292 H180 Cl24 N8 O44 S8 -","2","0.5","","Howard M. Colquhoun; David J. Williams; Zhixue Zhu","Macrocyclic Aromatic Ether-Imide-Sulfones: Versatile Supramolecular Receptors with Extreme Thermochemical and Oxidative Stability","Journal of the American Chemical Society","2002","124","","13346","13347","10.1021/ja027851m","","","1.54178","CuKα","","0.1734","0.0883","","0.2765","0.2118","","","","1.147","1.347","1.347","","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115288","16.6123","0.001","14.499","0.0009","21.2765","0.0013","90","","111.761","0.001","90","","4759.5","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H39 Na12 Np2 O110 P2 W18 -","- Na12 Np2 O110 P2 W18 -","- Na24 Np4 O220 P4 W36 -","2","0.5","","Andrew J. Gaunt; Iain May; Madeleine Helliwell; Steve Richardson","The First Structural and Spectroscopic Characterization of a Neptunyl Polyoxometalate Complex","Journal of the American Chemical Society","2002","124","","13350","13351","10.1021/ja028005e","","","0.71073","MoKα","","0.0829","0.0618","","","0.1508","0.163","","","","","","0.981","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115289","11.4789","0.0006","11.1983","0.0005","16.7409","0.0008","90","","106.559","0.001","90","","2062.7","0.17","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 N2 O4 -","- C24 H26 N2 O4 -","- C96 H104 N8 O16 -","4","1","","Ohyun Kwon; Seung Bum Park; Stuart L. Schreiber","Skeletal Diversity via a Branched Pathway: Efficient Synthesis of 29400 Discrete, Polycyclic Compounds and Their Arraying into Stock Solutions","Journal of the American Chemical Society","2002","124","","13402","13404","10.1021/ja028086e","","","0.71073","MoKα","","0.0495","0.0419","","","0.1098","0.116","","","","","","1.055","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115290","10.4042","0.0006","10.9633","0.0007","11.9333","0.0007","87.657","0.001","71.839","0.001","69.444","0.001","1207.41","0.13","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H16 Br2 F N3 O4 -","- C26 H16 Br2 F N3 O4 -","- C52 H32 Br4 F2 N6 O8 -","2","1","","Ohyun Kwon; Seung Bum Park; Stuart L. Schreiber","Skeletal Diversity via a Branched Pathway: Efficient Synthesis of 29400 Discrete, Polycyclic Compounds and Their Arraying into Stock Solutions","Journal of the American Chemical Society","2002","124","","13402","13404","10.1021/ja028086e","","","0.71073","MoKα","","0.0683","0.0466","","","0.1187","0.1303","","","","","","1.008","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115291","8.7883","0.0011","10.7793","0.0015","16.657","0.002","89.879","0.002","81.922","0.003","66.124","0.002","1426","0.3","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C31.5 H24 Br Cl F N3 O6 -","- C31.5 H24 Br Cl F N3 O6 -","- C63 H48 Br2 Cl2 F2 N6 O12 -","2","1","","Ohyun Kwon; Seung Bum Park; Stuart L. Schreiber","Skeletal Diversity via a Branched Pathway: Efficient Synthesis of 29400 Discrete, Polycyclic Compounds and Their Arraying into Stock Solutions","Journal of the American Chemical Society","2002","124","","13402","13404","10.1021/ja028086e","","","0.71073","MoKα","","0.0991","0.0489","","","0.1167","0.1361","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115292","9.2454","0.0005","8.6672","0.0004","25.6417","0.0015","90","","95.526","0.001","90","","2045.16","0.19","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H20 Cl2 O4 -","- C23 H20 Cl2 O4 -","- C92 H80 Cl8 O16 -","4","1","","Ohyun Kwon; Seung Bum Park; Stuart L. Schreiber","Skeletal Diversity via a Branched Pathway: Efficient Synthesis of 29400 Discrete, Polycyclic Compounds and Their Arraying into Stock Solutions","Journal of the American Chemical Society","2002","124","","13402","13404","10.1021/ja028086e","","","0.71073","MoKα","","0.0769","0.0465","","","0.1206","0.1397","","","","","","0.968","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115293","18.2827","0.0011","16.4696","0.0011","16.3919","0.001","90","","93.57","0.001","90","","4926.2","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H60 F9 N2 O15 P -","- C44 H58 F9 N2 O14 P -","- C176 H232 F36 N8 O56 P4 -","4","1","","Jason W. Jones; Lev N. Zakharov; Arnold L. Rheingold; Harry W. Gibson","Cooperative Host/Guest Interactions via Counterion Assisted Chelation: Pseudorotaxanes from Supramolecular Cryptands","Journal of the American Chemical Society","2002","124","","13378","13379","10.1021/ja028306o","","","0.71073","MoKα","","0.0941","0.07","","","0.1613","0.1735","","","","","","1.058","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115294","7.6777","0.0004","23.502","0.0013","13.5215","0.0007","90","","90.773","0.001","90","","2439.6","0.2","198","2","198","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H27 B11 Cl6 O2 -","- C9 H27 B11 Cl6 O2 -","- C36 H108 B44 Cl24 O8 -","4","1","","Daniel Stasko; Stephan P. Hoffmann; Kee-Chan Kim; Nathanael L. P. Fackler; Anna S. Larsen; Tatiana Drovetskaya; Fook S. Tham; Christopher A. Reed; Clifton E. F. Rickard; Peter D. W. Boyd; Evgenii S. Stoyanov","Molecular Structure of the Solvated Proton in Isolated Salts. Short, Strong, Low Barrier (SSLB) H-bonds","Journal of the American Chemical Society","2002","124","","13869","13876","10.1021/ja012671i","","","0.71073","MoKα","","0.0666","0.0409","","","0.0949","0.1055","","","","","","1.02","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115295","12.1524","0.0001","24.9529","0.0002","17.1935","0.0002","90","","108.35","0.001","90","","4948.6","0.09","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(tetrahydrofuran)hydronium hexabromocarborane","","- C9 H23 B11 Br6 O2 -","- C9 H22 B11 Br6 O2 -","- C72 H176 B88 Br48 O16 -","8","2","","Daniel Stasko; Stephan P. Hoffmann; Kee-Chan Kim; Nathanael L. P. Fackler; Anna S. Larsen; Tatiana Drovetskaya; Fook S. Tham; Christopher A. Reed; Clifton E. F. Rickard; Peter D. W. Boyd; Evgenii S. Stoyanov","Molecular Structure of the Solvated Proton in Isolated Salts. Short, Strong, Low Barrier (SSLB) H-bonds","Journal of the American Chemical Society","2002","124","","13869","13876","10.1021/ja012671i","","","0.71073","MoKα","","0.1025","0.0496","","","0.0887","0.1067","","","","","","1.022","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115296","9.9028","0.0005","13.8281","0.0007","13.9213","0.0007","68.214","0.001","74.937","0.001","84.967","0.002","1709.28","0.15","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H27 B11 Cl6 O2 -","- C27 H27 B11 Cl6 O2 -","- C54 H54 B22 Cl12 O4 -","2","1","","Daniel Stasko; Stephan P. Hoffmann; Kee-Chan Kim; Nathanael L. P. Fackler; Anna S. Larsen; Tatiana Drovetskaya; Fook S. Tham; Christopher A. Reed; Clifton E. F. Rickard; Peter D. W. Boyd; Evgenii S. Stoyanov","Molecular Structure of the Solvated Proton in Isolated Salts. Short, Strong, Low Barrier (SSLB) H-bonds","Journal of the American Chemical Society","2002","124","","13869","13876","10.1021/ja012671i","","","0.71073","MoKα","","0.0922","0.0536","","","0.1236","0.141","","","","","","1.021","","","","has coordinates","178923","2020-10-21","18:00:00",""
"4115297","7.6653","0.0008","19.583","0.002","9.0121","0.0009","90","","91.987","0.002","90","","1352","0.2","213","2","213","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C13 H17 B11 Cl6 N2 O4 -","- C13 H17 B11 Cl6 N2 O4 -","- C26 H34 B22 Cl12 N4 O8 -","2","0.5","","Daniel Stasko; Stephan P. Hoffmann; Kee-Chan Kim; Nathanael L. P. Fackler; Anna S. Larsen; Tatiana Drovetskaya; Fook S. Tham; Christopher A. Reed; Clifton E. F. Rickard; Peter D. W. Boyd; Evgenii S. Stoyanov","Molecular Structure of the Solvated Proton in Isolated Salts. Short, Strong, Low Barrier (SSLB) H-bonds","Journal of the American Chemical Society","2002","124","","13869","13876","10.1021/ja012671i","","","0.71073","MoKα","","0.0545","0.0382","","","0.0962","0.1064","","","","","","1.04","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115298","23.374","0.005","15.107","0.004","23.804","0.005","90","","99.907","0.01","90","","8280","3","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H19 B11 Cl6 O2 -","- C5 H19 B11 Cl6 O2 -","- C80 H304 B176 Cl96 O32 -","16","4","","Daniel Stasko; Stephan P. Hoffmann; Kee-Chan Kim; Nathanael L. P. Fackler; Anna S. Larsen; Tatiana Drovetskaya; Fook S. Tham; Christopher A. Reed; Clifton E. F. Rickard; Peter D. W. Boyd; Evgenii S. Stoyanov","Molecular Structure of the Solvated Proton in Isolated Salts. Short, Strong, Low Barrier (SSLB) H-bonds","Journal of the American Chemical Society","2002","124","","13869","13876","10.1021/ja012671i","","","0.71073","MoKα","","0.1248","0.0534","","","0.1025","0.1248","","","","","","1.013","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115299","12.9829","0.0006","36.305","0.002","14.0126","0.0006","90","","108.087","0.001","90","","6278.4","0.5","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H71 Cl2 Fe N7 O5 -","- C70 H71 Cl2 Fe N7 O5 -","- C280 H284 Cl8 Fe4 N28 O20 -","4","1","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Nitrosyliron(III) Porphyrinates: Porphyrin Core Conformation and FeNO Geometry. Any Correlation?","Journal of the American Chemical Society","2002","124","","13833","13841","10.1021/ja0207145","","","0.71073","MoKα","","0.0864","0.0659","","0.1891","0.1728","","","","1.026","1.084","1.084","","","","","has coordinates,has disorder","178923","2020-10-21","18:00:00",""
"4115300","14.062","0.002","16.175","0.003","19.948","0.003","69.427","0.003","71.504","0.003","89.054","0.003","4005.3","1.1","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C40.5 H51 Cl2 Fe N7 O5 -","- C40.5 H51 Cl2 Fe N7 O5 -","- C162 H204 Cl8 Fe4 N28 O20 -","4","2","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Nitrosyliron(III) Porphyrinates: Porphyrin Core Conformation and FeNO Geometry. Any Correlation?","Journal of the American Chemical Society","2002","124","","13833","13841","10.1021/ja0207145","","","0.71073","MoKα","","0.0866","0.0521","","0.1558","0.1338","","","","0.956","1.044","1.044","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115301","9.7923","0.0008","14.5753","0.0011","25.18","0.002","89.96","0.007","89.964","0.007","89.928","0.007","3593.8","0.5","153.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H36 Si4 -","- C16 H36 Si4 -","- C96 H216 Si24 -","6","3","","Günther Maier; Jörg Neudert; Oliver Wolf; Dirk Pappusch; Akira Sekiguchi; Masanobu Tanaka; Tsukasa Matsuo","Tetrakis(trimethylsilyl)tetrahedrane+","Journal of the American Chemical Society","2002","124","","13819","13826","10.1021/ja020863n","","","0.7107","MoKα","","","0.071","","","","0.188","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115302","12.1429","0.0003","33.2454","0.0008","15.7008","0.0004","90","","94.494","0.001","90","","6318.9","0.3","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C113 H158 Cl12 Cu6 N18 O11 -","- C56.5 H72 Cl6 Cu3 N9 O5.5 -","- C226 H288 Cl24 Cu12 N36 O22 -","4","2","","Makoto Komiyama; Shinichiro Kina; Kazunari Matsumura; Jun Sumaoka; Suzanne Tobey; Vincent M. Lynch; Eric Anslyn","Trinuclear Copper(II) Complex Showing High Selectivity for the Hydrolysis of 2'-5' over 3'-5' for UpU and 3'-5' over 2'-5' for ApA Ribonucleotides","Journal of the American Chemical Society","2002","124","","13731","13736","10.1021/ja020877t","","","0.71073","MoKα","","0.1953","0.116","","","0.1639","0.1798","","","","","","1.867","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115303","9.2962","0.0005","23.9211","0.0012","15.0493","0.0008","90","","96.508","0.001","90","","3325","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H29 Cl2 Co -","- C40 H29 Cl2 Co -","- C160 H116 Cl8 Co4 -","4","1","","Matthew Laskoski; Winfried Steffen; Jason G. M. Morton; Mark D. Smith; Uwe H. F. Bunz","Synthesis and Explosive Decomposition of Organometallic Dehydro[18]annulenes: An Access to Carbon Nanostructures","Journal of the American Chemical Society","2002","124","","13814","13818","10.1021/ja026809o","","","0.71073","MoKα","","0.081","0.0582","","","0.1736","0.1863","","","","","","1.051","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115304","9.5471","0.001","14.7157","0.0014","18.3884","0.0018","95.188","0.002","91.231","0.002","93.394","0.002","2567.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C58 H70 Co Si2 -","- C58 H70 Co Si2 -","- C116 H140 Co2 Si4 -","2","1","","Matthew Laskoski; Winfried Steffen; Jason G. M. Morton; Mark D. Smith; Uwe H. F. Bunz","Synthesis and Explosive Decomposition of Organometallic Dehydro[18]annulenes: An Access to Carbon Nanostructures","Journal of the American Chemical Society","2002","124","","13814","13818","10.1021/ja026809o","","","0.71073","MoKα","","0.0963","0.0651","","","0.1554","0.1691","","","","","","1.01","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115305","9.4538","0.0007","22.1839","0.0016","16.7388","0.0012","90","","93.265","0.002","90","","3504.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H33 Cl2 Co -","- C42 H33 Cl2 Co -","- C168 H132 Cl8 Co4 -","4","1","","Matthew Laskoski; Winfried Steffen; Jason G. M. Morton; Mark D. Smith; Uwe H. F. Bunz","Synthesis and Explosive Decomposition of Organometallic Dehydro[18]annulenes: An Access to Carbon Nanostructures","Journal of the American Chemical Society","2002","124","","13814","13818","10.1021/ja026809o","","","0.71073","MoKα","","0.1507","0.0573","","","0.1054","0.1315","","","","","","0.961","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115306","11.982","0.001","13.2987","0.0011","18.256","0.0016","69.471","0.002","79.704","0.002","89.862","0.002","2674.7","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H18 Cl1.5 Fe -","- C35 H18 Cl1.5 Fe -","- C140 H72 Cl6 Fe4 -","4","2","","Matthew Laskoski; Winfried Steffen; Jason G. M. Morton; Mark D. Smith; Uwe H. F. Bunz","Synthesis and Explosive Decomposition of Organometallic Dehydro[18]annulenes: An Access to Carbon Nanostructures","Journal of the American Chemical Society","2002","124","","13814","13818","10.1021/ja026809o","","","0.71073","MoKα","","0.1586","0.0744","","","0.1703","0.2096","","","","","","0.956","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115307","9.0856","0.0006","11.8076","0.0008","16.3129","0.0011","96.19","0.001","95.868","0.001","104.724","0.001","1667.33","0.19","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H28 Fe -","- C40 H28 Fe -","- C80 H56 Fe2 -","2","1","","Matthew Laskoski; Winfried Steffen; Jason G. M. Morton; Mark D. Smith; Uwe H. F. Bunz","Synthesis and Explosive Decomposition of Organometallic Dehydro[18]annulenes: An Access to Carbon Nanostructures","Journal of the American Chemical Society","2002","124","","13814","13818","10.1021/ja026809o","","","0.71073","MoKα","","0.078","0.0579","","","0.1494","0.1571","","","","","","1.013","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115308","12.342","0.001","15.898","0.001","15.526","0.001","103.9","0.01","106.24","0.01","97","0.01","2780.2","0.4","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C55 H74 N6 O18 -","- C55 H74 N6 O18 -","- C110 H148 N12 O36 -","2","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.1197","0.0567","","","0.084","0.0981","","","","","","0.972","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115309","12.349","0.001","15.721","0.001","15.815","0.001","105.39","0.01","106.01","0.01","97.59","0.01","2774.7","0.4","87","0.5","87","0.5","","","","","","","","5","P -1","-P 1","2","","","","- C54 H71 Cl N6 O18 -","- C54 H71 Cl N6 O18 -","- C108 H142 Cl2 N12 O36 -","2","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.0943","0.0564","","","0.094","0.1036","","","","","","1.03","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115310","12.341","0.001","15.818","0.001","15.787","0.001","105.27","0.01","106.12","0.01","97.5","0.01","2786.3","0.4","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H71 F3 N6 O18 -","- C55 H71 F3 N6 O18 -","- C110 H142 F6 N12 O36 -","2","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.0895","0.0526","","","0.094","0.1042","","","","","","1.028","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115311","9.631","0.0004","18.905","0.0007","25.17","0.0011","90","","90","","90","","4582.8","0.3","90","0.2","90","0.2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H27 N3 O8 -","- C22 H27 N3 O8 -","- C176 H216 N24 O64 -","8","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.107","0.0612","","","0.0887","0.0999","","","","","","1.062","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115312","8.9703","0.0004","9.8733","0.0004","23.6934","0.001","90","","90.215","0.002","90","","2098.43","0.15","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H28 N2 O6 -","- C22 H28 N2 O6 -","- C88 H112 N8 O24 -","4","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.1068","0.053","","","0.0887","0.1022","","","","","","0.992","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115313","17.978","0.0005","12.391","0.0006","10.333","0.0008","90","","90","","90","","2301.8","0.2","90","0.2","90","0.2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H26 Cl4 N2 O6 -","- C18 H26 Cl4 N2 O6 -","- C72 H104 Cl16 N8 O24 -","4","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.0441","0.0358","","","0.0665","0.0691","","","","","","1.025","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115314","12.251","0.001","10.375","0.001","13.46","0.001","90","","90.01","0.01","90","","1710.8","0.3","145","1","173","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H24 N2 O6 -","- C17 H24 N2 O6 -","- C68 H96 N8 O24 -","4","1","","Robert B. Grossman; Kazuyuki Hattori; Sean Parkin; Brian O. Patrick; Melissa A. Varner","The Bicyclic N,N'-Diacylaminal: A New Motif for Molecular Self-Assembly","Journal of the American Chemical Society","2002","124","","13686","13687","10.1021/ja026949y","","","0.71073","MoKα","","0.0784","0.0527","","","0.1084","0.118","","","","","","1.036","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115315","5.782","0.0002","5.782","0.0002","14.149","0.0008","90","","90","","120","","409.65","0.03","293","2","293","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 Li O9 Ru2 -","- Ba3 Li O9 Ru2 -","- Ba6 Li2 O18 Ru4 -","2","0.0833333","","Katharine E. Stitzer; Mark D. Smith; William R. Gemmill; Hans-Conrad zur Loye","Novel Mixed-Valent (V/VI) Triple Perovskite Ruthenates: Observation of a Complex Low-Temperature Structural and Magnetic Transition","Journal of the American Chemical Society","2002","124","","13877","13885","10.1021/ja0271781","","","0.71073","MoKα","","0.0368","0.0293","","","0.0673","0.0708","","","","","","1.089","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115316","5.8729","0.0002","5.8729","0.0002","14.4676","0.0007","90","","90","","120","","432.15","0.03","293","2","293","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba3 Na O9 Ru2 -","- Ba3 Na O9 Ru2 -","- Ba6 Na2 O18 Ru4 -","2","0.0833333","","Katharine E. Stitzer; Mark D. Smith; William R. Gemmill; Hans-Conrad zur Loye","Novel Mixed-Valent (V/VI) Triple Perovskite Ruthenates: Observation of a Complex Low-Temperature Structural and Magnetic Transition","Journal of the American Chemical Society","2002","124","","13877","13885","10.1021/ja0271781","","","0.71073","MoKα","","0.0233","0.0213","","","0.0485","0.0494","","","","","","1.138","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115317","11.7282","0.0008","20.3541","0.0013","14.4856","0.001","90","","90","","90","","3458","0.4","173","2","173","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Ba3 Na O9 Ru2 -","- Ba3 Na O9 Ru2 -","- Ba48 Na16 O144 Ru32 -","16","1","","Katharine E. Stitzer; Mark D. Smith; William R. Gemmill; Hans-Conrad zur Loye","Novel Mixed-Valent (V/VI) Triple Perovskite Ruthenates: Observation of a Complex Low-Temperature Structural and Magnetic Transition","Journal of the American Chemical Society","2002","124","","13877","13885","10.1021/ja0271781","","","0.71073","MoKα","","0.0377","0.0331","","","0.0846","0.0869","","","","","","1.092","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115318","9.415","0","9.415","0","20.513","0.001","90","","90","","90","","1818.32","0.09","273.1","","","","","","","","","","","3","P 41","P 4w","76","","","","- C19 H30 O4 -","- C19 H30 O4 -","- C76 H120 O16 -","4","1","","Paul A. Wender; Jeremy L. Baryza; Chad E. Bennett; F. Christopher Bi; Stacey E. Brenner; Michael O. Clarke; Joshua C. Horan; Cindy Kan; Emmanuel Lacôte; Blaise Lippa; Peter G. Nell; Tim M. Turner","The Practical Synthesis of a Novel and Highly Potent Analogue of Bryostatin","Journal of the American Chemical Society","2002","124","","13648","13649","10.1021/ja027509+","","","0.7107","MoKα","","","0.034","","","","0.078","","","","","","0.823","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115319","8.6258","0.0009","10.158","0.001","20.659","0.002","90","","90","","90","","1810.2","0.3","273.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H30 O4 -","- C19 H30 O4 -","- C76 H120 O16 -","4","1","","Paul A. Wender; Jeremy L. Baryza; Chad E. Bennett; F. Christopher Bi; Stacey E. Brenner; Michael O. Clarke; Joshua C. Horan; Cindy Kan; Emmanuel Lacôte; Blaise Lippa; Peter G. Nell; Tim M. Turner","The Practical Synthesis of a Novel and Highly Potent Analogue of Bryostatin","Journal of the American Chemical Society","2002","124","","13648","13649","10.1021/ja027509+","","","0.7107","MoKα","","","0.036","","","","0.066","","","","","","0.863","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115320","9.7777","0.0011","10.6494","0.0012","14.6628","0.0017","92.226","0.002","95.533","0.002","111.283","0.002","1411.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C67 H56 Cl2 Cr Fe6 N6 -","- C67 H56 Cl2 Cr Fe6 N6 -","- C67 H56 Cl2 Cr Fe6 N6 -","1","0.5","","Mikhail V. Barybin; Thomas C. Holovics; Stephan F. Deplazes; Gerald H. Lushington; Douglas R. Powell; Masaharu Toriyama","First Homoleptic Complexes of Isocyanoferrocene","Journal of the American Chemical Society","2002","124","","13668","13669","10.1021/ja028271s","","","0.71073","MoKα","","0.0458","0.0353","","","0.0833","0.0884","","","","","","1.023","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115321","8.631","0.008","17.489","0.016","16.349","0.014","90","","92.228","0.018","90","","2466","4","243","2","243","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H36 Mo N P3 -","- C22 H36 Mo N P3 -","- C88 H144 Mo4 N4 P12 -","4","1","","Guang Zhu; Joseph M. Tanski; David G. Churchill; Kevin E. Janak; Gerard Parkin","The Reactivity of Mo(PMe3)6 towards Heterocyclic Nitrogen Compounds: Transformations Relevant to Hydrodenitrogenation","Journal of the American Chemical Society","2002","124","","13658","13659","10.1021/ja028512w","","","0.71073","MoKα","","0.236","0.0849","","","0.157","0.1895","","","","","","1.026","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115322","52.243","0.004","13.0264","0.0009","18.3017","0.0013","90","","100.512","0.001","90","","12246","1.5","243","2","243","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C21 H36 Mo N P3 -","- C21 H35.8 Mo N P3 -","- C420 H716 Mo20 N20 P60 -","20","5","","Guang Zhu; Joseph M. Tanski; David G. Churchill; Kevin E. Janak; Gerard Parkin","The Reactivity of Mo(PMe3)6 towards Heterocyclic Nitrogen Compounds: Transformations Relevant to Hydrodenitrogenation","Journal of the American Chemical Society","2002","124","","13658","13659","10.1021/ja028512w","","","0.71073","MoKα","","0.218","0.06","","","0.0676","0.0924","","","","","","0.874","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115323","14.1007","0.0007","28.0482","0.0013","10.9671","0.0005","90","","90","","90","","4337.5","0.4","243","2","243","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C20 H30 Mo N P4 -","- C17 H34 Mo N P3 -","- C136 H272 Mo8 N8 P24 -","8","1","","Guang Zhu; Joseph M. Tanski; David G. Churchill; Kevin E. Janak; Gerard Parkin","The Reactivity of Mo(PMe3)6 towards Heterocyclic Nitrogen Compounds: Transformations Relevant to Hydrodenitrogenation","Journal of the American Chemical Society","2002","124","","13658","13659","10.1021/ja028512w","","","0.71073","MoKα","","0.1006","0.0522","","","0.1561","0.1744","","","","","","1.075","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115324","14.891","0.002","18.871","0.003","16.272","0.003","90","","104.604","0.003","90","","4424.8","1.2","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H34 Mo N P3 -","- C18 H34 Mo N P3 -","- C144 H272 Mo8 N8 P24 -","8","2","","Guang Zhu; Joseph M. Tanski; David G. Churchill; Kevin E. Janak; Gerard Parkin","The Reactivity of Mo(PMe3)6 towards Heterocyclic Nitrogen Compounds: Transformations Relevant to Hydrodenitrogenation","Journal of the American Chemical Society","2002","124","","13658","13659","10.1021/ja028512w","","","0.71073","MoKα","","0.0664","0.0429","","","0.1072","0.1213","","","","","","1.034","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115325","9.1319","0.0008","14.9526","0.0013","16.5873","0.0014","90","","105.074","0.002","90","","2187","0.3","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H34 Mo N P3 -","- C18 H34 Mo N P3 -","- C72 H136 Mo4 N4 P12 -","4","1","","Guang Zhu; Joseph M. Tanski; David G. Churchill; Kevin E. Janak; Gerard Parkin","The Reactivity of Mo(PMe3)6 towards Heterocyclic Nitrogen Compounds: Transformations Relevant to Hydrodenitrogenation","Journal of the American Chemical Society","2002","124","","13658","13659","10.1021/ja028512w","","","0.71073","MoKα","","0.0344","0.0244","","","0.0564","0.059","","","","","","1.028","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115326","15.8105","0.0019","31.466","0.004","10.2786","0.0012","90","","90","","90","","5113.5","1.1","243","2","243","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C17 H41 Mo N P4 -","- C17 H41 Mo N P4 -","- C136 H328 Mo8 N8 P32 -","8","1","","Guang Zhu; Joseph M. Tanski; David G. Churchill; Kevin E. Janak; Gerard Parkin","The Reactivity of Mo(PMe3)6 towards Heterocyclic Nitrogen Compounds: Transformations Relevant to Hydrodenitrogenation","Journal of the American Chemical Society","2002","124","","13658","13659","10.1021/ja028512w","","","0.71073","MoKα","","0.071","0.0415","","","0.1329","0.1529","","","","","","1.004","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115327","12.592","0.0004","5.616","0.0002","17.032","0.0006","90","","117.165","0.0013","90","","1071.59","0.06","130","2","130","2","","","","","","","","3","P 1 c 1","P -2yc","7","DPAENE-ligand","DPAENE-ligand","","- C26 H22 As2 -","- C26 H22 As2 -","- C52 H44 As4 -","2","1","","Brenden Carlsen; Gregory D. Phelan; Werner Kaminsky; Larry R. Dalton; Xuezhong Jiang; Sen Liu; Alex K-Y. Jen","Divalent Osmium Complexes: Synthesis, Characterization, Strong Red Phosphorescence, and Electrophosphorescence","Journal of the American Chemical Society","2002","124","","14162","14172","10.1021/ja0176705","","","0.71073","MoKα","","0.0431","0.0376","","","0.0851","0.0872","","","","","","1.069","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115328","18.329","0.005","17.24","0.01","22.048","0.009","90","","99.055","0.011","90","","6880","5","130","2","130","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Complex3","Complex3","","- C84 H70 As2 N4 O7 Os S2 -","- C84 H70 As2 N4 O7 Os S2 -","- C336 H280 As8 N16 O28 Os4 S8 -","4","1","","Brenden Carlsen; Gregory D. Phelan; Werner Kaminsky; Larry R. Dalton; Xuezhong Jiang; Sen Liu; Alex K-Y. Jen","Divalent Osmium Complexes: Synthesis, Characterization, Strong Red Phosphorescence, and Electrophosphorescence","Journal of the American Chemical Society","2002","124","","14162","14172","10.1021/ja0176705","","","0.71073","MoKα","","0.178","0.0667","","","0.0661","0.084","","","","","","0.896","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115329","14.515","0.0002","26.071","0.0003","11.148","0.0007","90","","90","","90","","4218.6","0.3","130","2","130","2","","","","","","","","9","P 21 21 2","P 2 2ab","18","Comple12","Comple12","","- C45 H33 As Br2 Cl3 N2 O3 Os0.5 S -","- C45 H33 As Br2 Cl3 N2 O3 Os0.5 S -","- C180 H132 As4 Br8 Cl12 N8 O12 Os2 S4 -","4","1","","Brenden Carlsen; Gregory D. Phelan; Werner Kaminsky; Larry R. Dalton; Xuezhong Jiang; Sen Liu; Alex K-Y. Jen","Divalent Osmium Complexes: Synthesis, Characterization, Strong Red Phosphorescence, and Electrophosphorescence","Journal of the American Chemical Society","2002","124","","14162","14172","10.1021/ja0176705","","","0.71073","MoKα","","0.0853","0.0554","","","0.1171","0.1276","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115330","10.562","0.001","12.545","0.001","15.19","0.001","95.85","0.01","91.99","0.02","97.57","0.01","1982.4","0.3","125","","","","","","","","","","","7","P -1","-P 1","2","","","","- C44 H30 Co Fe N O8 P2 -","- C44 H30 Co Fe N O8 P2 -","- C88 H60 Co2 Fe2 N2 O16 P4 -","2","1","","Piero Macchi; Luigi Garlaschelli; Angelo Sironi","Electron Density of Semi-Bridging Carbonyls. Metamorphosis of CO Ligands Observed via Experimental and Theoretical Investigations on [FeCo(CO)8]-","Journal of the American Chemical Society","2002","124","","14173","14184","10.1021/ja026186e","","","0.71073","MoKα","","","0.0275","","","0.0198","","","","","1.27","1.27","","","","","has coordinates","288068","2023-12-06","11:38:59",""
"4115331","10.89","0.007","20.998","0.013","11.754","0.008","90","0.05","90","0.05","90","0.05","2688","3","278","2","278","2","","","","","","","","7","C m c a","-C 2ac 2","64","NiN33.6D2O","bis(hydrotris(1,2,4-triazolyl)borato)nickel(II)- hexakis(deuterium oxide)","","- C12 H14 B2 D12 N18 Ni O6 -","- C12 H14 B2 D12 N18 Ni O6 -","- C48 H56 B8 D48 N72 Ni4 O24 -","4","","","Christoph Janiak; Tobias G. Scharmann; Sax A. Mason","Two-Dimensional Water and Ice Layers: Neutron Diffraction Studies at 278, 263, and 20 K","Journal of the American Chemical Society","2002","124","","14010","14011","10.1021/ja0274608","","neutron","1.3143","neutrons","","0.0766","0.0666","","","0.1534","0.1598","","","","","","1.055","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115332","10.8517","0.0017","20.919","0.003","11.6959","0.0013","89.995","0.008","90","0.01","89.998","0.008","2655","0.6","263","2","263","2","","","","","","","","7","P m n b","-P 2bc 2a","62","NiN33.6D2O","bis(hydrotris(1,2,4-triazolyl)borato)nickel(II)- hexakis(deuterium oxide)","","- C12 H14 B2 D12 N18 Ni O6 -","- C12 H14 B2 D12 N18 Ni O6 -","- C48 H56 B8 D48 N72 Ni4 O24 -","4","0.5","","Christoph Janiak; Tobias G. Scharmann; Sax A. Mason","Two-Dimensional Water and Ice Layers: Neutron Diffraction Studies at 278, 263, and 20 K","Journal of the American Chemical Society","2002","124","","14010","14011","10.1021/ja0274608","","neutron","1.3143","neutrons","","0.0659","0.0503","","","0.1132","0.1194","","","","","","1.278","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115333","10.7548","0.001","20.7363","0.0015","11.587","0.002","90","0.006","90","0.006","90","0.006","2584.1","0.5","20","2","20","2","","","","","","","Chem. Ber. 1994, 127, 1379","7","P 21 n b","P -2bc 2a","33","NiN33.6D2O","bis(hydrotris(1,2,4-triazolyl)borato)nickel(II)- hexakis(deuterium oxide)","","- C12 H14 B2 D12 N18 Ni O6 -","- C12 H14 B2 D12 N18 Ni O6 -","- C48 H56 B8 D48 N72 Ni4 O24 -","4","1","","Christoph Janiak; Tobias G. Scharmann; Sax A. Mason","Two-Dimensional Water and Ice Layers: Neutron Diffraction Studies at 278, 263, and 20 K","Journal of the American Chemical Society","2002","124","","14010","14011","10.1021/ja0274608","","neutron","1.3143","neutrons","","0.0289","0.0285","","0.0669","0.0667","","","","1.155","","","","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115334","10.772","0.002","29.335","0.003","11.17","0.002","90","","106.53","0.01","90","","3383.8","1","296.2","","296.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H34 F6 N2 O6 P2 S2 -","- C26 H34 F6 N2 O6 P2 S2 -","- C104 H136 F24 N8 O24 P8 S8 -","4","1","","Neil Burford; T. Stanley Cameron; Korey D. Conroy; Bobby Ellis; Michael Lumsden; Charles L. B. Macdonald; Robert McDonald; Andrew D. Phillips; Paul J. Ragogna; Robert W. Schurko; Denise Walsh; Roderick E. Wasylishen","Transformations between Monomeric, Dimeric, and Trimeric Phosphazanes: Oligomerizing NP Analogues of Olefins","Journal of the American Chemical Society","2002","124","","14012","14013","10.1021/ja027946o","","","1.5418","CuKα","","0.0477","0.048","","0.05","","0.05","","","1.418","","","1.42","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115335","11.358","0.002","16.4","0.002","12.006","0.001","90","","90.56","0.01","90","","2236.3","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 F3 N O3 P S -","- C19 H29 F3 N O3 P S -","- C76 H116 F12 N4 O12 P4 S4 -","4","1","","Neil Burford; T. Stanley Cameron; Korey D. Conroy; Bobby Ellis; Michael Lumsden; Charles L. B. Macdonald; Robert McDonald; Andrew D. Phillips; Paul J. Ragogna; Robert W. Schurko; Denise Walsh; Roderick E. Wasylishen","Transformations between Monomeric, Dimeric, and Trimeric Phosphazanes: Oligomerizing NP Analogues of Olefins","Journal of the American Chemical Society","2002","124","","14012","14013","10.1021/ja027946o","","","1.54178","CuKα","","0.2624","0.0579","","0.242","0.1596","","","","1.037","1.298","1.298","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115336","10.4687","0.0008","13.9849","0.001","16.4674","0.0012","87.2367","0.0012","81.3528","0.0012","78.8655","0.0012","2338.2","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H53 Cl8 Ga N3 P3 -","- C37 H53 Cl8 Ga N3 P3 -","- C74 H106 Cl16 Ga2 N6 P6 -","2","1","","Neil Burford; T. Stanley Cameron; Korey D. Conroy; Bobby Ellis; Michael Lumsden; Charles L. B. Macdonald; Robert McDonald; Andrew D. Phillips; Paul J. Ragogna; Robert W. Schurko; Denise Walsh; Roderick E. Wasylishen","Transformations between Monomeric, Dimeric, and Trimeric Phosphazanes: Oligomerizing NP Analogues of Olefins","Journal of the American Chemical Society","2002","124","","14012","14013","10.1021/ja027946o","","","0.71073","MoKα","","0.0531","0.0375","","","0.0914","0.0981","","","","","","1.022","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115337","6.0001","0.0002","12.2626","0.0005","12.4228","0.0002","74.897","0.003","77.983","0.002","79.092","0.002","854.26","0.05","143.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H28 N4 -","- C17 H28 N4 -","- C34 H56 N8 -","2","1","","Kian L. Tan; Robert G. Bergman; Jonathan A. Ellman","Intermolecular Coupling of Isomerizable Alkenes to Heterocycles via Rhodium-Catalyzed C-H Bond Activation","Journal of the American Chemical Society","2002","124","","13964","13965","10.1021/ja0281129","","","0.7107","MoKα","","","0.0582","","","","0.0702","","","","","","1.384","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115338","18.8242","0.0009","19.6196","0.0009","19.2891","0.0009","90","","100.05","0.001","90","","7014.6","0.6","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C64 H67 B2 Cl0 Cr F24 N8 O -","- C64 H67 B2 Cr F24 N8 O -","- C256 H268 B8 Cr4 F96 N32 O4 -","4","1","","Kun Qin; Christopher D. Incarvito; Arnold L. Rheingold; Klaus H. Theopold","Hydrogen Atom Abstraction by a Chromium(IV) Oxo Complex Derived from O2","Journal of the American Chemical Society","2002","124","","14008","14009","10.1021/ja028382r","","","0.71073","MoKα","","0.0889","0.0609","","","0.1518","0.1689","","","","","","1.033","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115339","19.115","0.004","19.652","0.004","19.334","0.005","90","","100.058","0.005","90","","7151","3","218","2","218","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C64.5 H67 B2 Cl Cr F24 N8 O -","- C64 H66 B2 Cr F24 N8 O -","- C256 H264 B8 Cr4 F96 N32 O4 -","4","1","","Kun Qin; Christopher D. Incarvito; Arnold L. Rheingold; Klaus H. Theopold","Hydrogen Atom Abstraction by a Chromium(IV) Oxo Complex Derived from O2","Journal of the American Chemical Society","2002","124","","14008","14009","10.1021/ja028382r","","","0.71073","MoKα","","0.1178","0.0777","","","0.1832","0.2032","","","","","","1.083","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115340","18.86","0.08","18.55","0.03","6.244","0.009","90","","90","","90","","2184","10","293.1","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C14 H16 F6 N2 O3 -","- C14 H15 F6 N2 O3 -","- C56 H60 F24 N8 O12 -","4","1","","Yasuhiro Ishida; Takuzo Aida","Homochiral Supramolecular Polymerization of an ""S""-Shaped Chiral Monomer: Translation of Optical Purity into Molecular Weight Distribution","Journal of the American Chemical Society","2002","124","","14017","14019","10.1021/ja028403h","","","0.7107","MoKα","","","0.136","","","","0.175","","","","","","1.299","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115341","6.235","0.002","11.743","0.005","14.21","0.007","105.67","0.02","95.622","0.007","96.003","0.007","987.6","0.7","123.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H30 F12 N4 O12 -","- C30 H30 F12 N4 O12 -","- C30 H30 F12 N4 O12 -","1","0.5","","Yasuhiro Ishida; Takuzo Aida","Homochiral Supramolecular Polymerization of an ""S""-Shaped Chiral Monomer: Translation of Optical Purity into Molecular Weight Distribution","Journal of the American Chemical Society","2002","124","","14017","14019","10.1021/ja028403h","","","0.7107","MoKα","","","0.078","","","","0.2455","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115342","14.67","0.01","7.774","0.005","12.4","0.01","90","","90","","90","","1414.2","1.7","","","20","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C4 H16 Mn N8 Ni O8 -","- C4 H16 Mn N8 Ni O8 -","- C16 H64 Mn4 N32 Ni4 O32 -","4","0.5","","Béatrice Gillon; Corine Mathonière; Eliseo Ruiz; Santiago Alvarez; Alain Cousson; Thekkel M. Rajendiran; Olivier Kahn","Spin Densities in a Ferromagnetic Bimetallic Chain Compound: Polarized Neutron Diffraction and DFT Calculations","Journal of the American Chemical Society","2002","124","","14433","14441","10.1021/ja020188h","","neutron","0.8308","Neutron","","","0.055651","","","0.042638","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115343","13.63","0.002","13.612","0.003","16.663","0.006","90","","98.05","0.02","90","","3061","1.4","295","","295","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H39 Mo2 O4 P -","- C32 H38 Mo2 O4 P -","- C128 H152 Mo8 O16 P4 -","4","1","","M. Esther García; Víctor Riera; Miguel A. Ruiz; David Sáez; Jacqueline Vaissermann; John C. Jeffery","High Yield Synthesis and Reactivity of a Phosphinidene Bridged Dimolybdenum Complex","Journal of the American Chemical Society","2002","124","","14304","14305","10.1021/ja021072o","","","0.71069","MoKα","","","0.0599","","","0.0749","","","","","0.9867","0.9867","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115344","14.673","0.005","14.438","0.006","16.653","0.016","90","","113.13","0.05","90","","3244","4","295","","295","","","","","","","","?","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H39 I2 Mo2 O2 P -","- C30 H30 I2 Mo2 O2 P -","- C120 H120 I8 Mo8 O8 P4 -","4","0.5","","M. Esther García; Víctor Riera; Miguel A. Ruiz; David Sáez; Jacqueline Vaissermann; John C. Jeffery","High Yield Synthesis and Reactivity of a Phosphinidene Bridged Dimolybdenum Complex","Journal of the American Chemical Society","2002","124","","14304","14305","10.1021/ja021072o","","","0.71069","MoKα","","","0.0421","","","0.0516","","","","","1.1287","1.1287","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115345","10.107","0.0012","24.32","0.003","16.839","0.002","90","","98.244","0.017","90","","4096.3","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H47 Mo2 O4 P -","- C44 H47 Mo2 O4 P -","- C176 H188 Mo8 O16 P4 -","4","1","","M. Esther García; Víctor Riera; Miguel A. Ruiz; David Sáez; Jacqueline Vaissermann; John C. Jeffery","High Yield Synthesis and Reactivity of a Phosphinidene Bridged Dimolybdenum Complex","Journal of the American Chemical Society","2002","124","","14304","14305","10.1021/ja021072o","","","0.71073","MoKα","","0.0482","0.0368","","","0.0952","0.0981","","","","","","0.955","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115346","22.8416","0.0017","9.1166","0.0006","17.0423","0.0012","90","","108.604","0.001","90","","3363.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","LNiCl","2,2,6,6-tetramethyl-3,5-bis(2,6-diisopropylphenylimido)heptyl nickel(II) chloride","","- C35 H53 Cl N2 Ni -","- C35 H53 Cl N2 Ni -","- C140 H212 Cl4 N8 Ni4 -","4","0.5","","Patrick L. Holland; Thomas R. Cundari; Lanyn L. Perez; Nathan A. Eckert; Rene J. Lachicotte","Electronically Unsaturated Three-Coordinate Chloride and Methyl Complexes of Iron, Cobalt, and Nickel","Journal of the American Chemical Society","2002","124","","14416","14424","10.1021/ja025583m","","","0.71073","MoKα","","0.0668","0.0631","","","0.1825","0.1852","","","","","","1.038","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115347","10.0886","0.0006","12.4995","0.0007","18.3218","0.001","76.743","0.001","80.254","0.001","84.81","0.001","2213.2","0.2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","LCoCl2Li(ether)2","2,2,6,6-tetramethyl-3,5-bis(2,6-diisopropylphenylimido)heptyl cobalt(II) bis(mu-chloro)lithium dietherate","","- C43 H71 Cl2 Co Li N2 O2 -","- C43 H70.366 Cl2 Co Li N2 O2 -","- C86 H140.732 Cl4 Co2 Li2 N4 O4 -","2","1","","Patrick L. Holland; Thomas R. Cundari; Lanyn L. Perez; Nathan A. Eckert; Rene J. Lachicotte","Electronically Unsaturated Three-Coordinate Chloride and Methyl Complexes of Iron, Cobalt, and Nickel","Journal of the American Chemical Society","2002","124","","14416","14424","10.1021/ja025583m","","","0.71073","mokα","","0.0642","0.0475","","","0.1138","0.1226","","","","","","1.063","","","","has coordinates,has disorder","134499","2020-10-21","18:00:00",""
"4115348","16.9464","0.0009","9.2668","0.0005","22.8151","0.0012","90","","107.067","0.001","90","","3425.1","0.3","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","LCoCl","2,2,6,6-tetramethyl-3,5-bis(2,6-diisopropylphenylimido)heptyl cobalt(II) chloride","","- C35 H53 Cl Co N2 -","- C35 H53 Cl Co N2 -","- C140 H212 Cl4 Co4 N8 -","4","0.5","","Patrick L. Holland; Thomas R. Cundari; Lanyn L. Perez; Nathan A. Eckert; Rene J. Lachicotte","Electronically Unsaturated Three-Coordinate Chloride and Methyl Complexes of Iron, Cobalt, and Nickel","Journal of the American Chemical Society","2002","124","","14416","14424","10.1021/ja025583m","","","0.71073","MoKα","","0.1041","0.0776","","","0.1214","0.1283","","","","","","1.268","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115349","16.8841","0.0012","9.3872","0.0007","22.7802","0.0016","90","","107.219","0.001","90","","3448.7","0.4","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","LCoCH3","2,2,6,6-tetramethyl-3,5-bis(2,6-diisopropylphenylimido)heptyl cobalt(II) methyl","","- C36 H56 Co N2 -","- C36 H56 Co N2 -","- C144 H224 Co4 N8 -","4","0.5","","Patrick L. Holland; Thomas R. Cundari; Lanyn L. Perez; Nathan A. Eckert; Rene J. Lachicotte","Electronically Unsaturated Three-Coordinate Chloride and Methyl Complexes of Iron, Cobalt, and Nickel","Journal of the American Chemical Society","2002","124","","14416","14424","10.1021/ja025583m","","","0.71073","MoKα","","0.0449","0.0398","","","0.0959","0.0981","","","","","","1.119","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115350","9.562","0.0007","17.7515","0.0014","21.7048","0.0017","90","","95.543","0.002","90","","3666.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","LNiCl","2,2,6,6-tetramethyl-3,5-bis(2,6-diisopropylphenylimido)heptyl nickel(I) tetrahydrofuran","","- C39 H61 N2 Ni O -","- C39 H61 N2 Ni O -","- C156 H244 N8 Ni4 O4 -","4","1","","Patrick L. Holland; Thomas R. Cundari; Lanyn L. Perez; Nathan A. Eckert; Rene J. Lachicotte","Electronically Unsaturated Three-Coordinate Chloride and Methyl Complexes of Iron, Cobalt, and Nickel","Journal of the American Chemical Society","2002","124","","14416","14424","10.1021/ja025583m","","","0.71073","MoKα","","0.0486","0.0394","","","0.1064","0.1107","","","","","","1.009","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115351","32.758","0.003","10.7326","0.0009","20.0076","0.0016","90","","121.888","0.001","90","","5972.7","0.9","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C98 H143 Cl3 Nd2 O50 P6 -","- C98 H114 Cl2.5 Nd2 O46 P6 -","- C196 H228 Cl5 Nd4 O92 P12 -","2","0.5","","Helen L. Ngo; Wenbin Lin","Chiral Crown Ether Pillared Lamellar Lanthanide Phosphonates","Journal of the American Chemical Society","2002","124","","14298","14299","10.1021/ja027892i","","","0.71073","MoKα","","0.1581","0.0841","","","0.2081","0.2525","","","","","","1.032","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115352","15.4332","0.0008","15.4332","0.0008","44.421","0.005","90","","90","","120","","9162.9","1.2","293","2","293","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C51 H75 B2 Fe3 Mo N6 P3 S4 -","- C51.02 H75.02 B2 Fe3 Mo N6 P3 S4 -","- C306.12 H450.12 B12 Fe18 Mo6 N36 P18 S24 -","6","0.333333","","Yugen Zhang; Jing-Lin Zuo; Hong-Cai Zhou; R. H. Holm","Rearrangement of Symmetrical Dicubane Clusters into Topological Analogues of the P Cluster of Nitrogenase: Nature's Choice?","Journal of the American Chemical Society","2002","124","","14292","14293","10.1021/ja0279702","","","0.71073","MoKα","","0.0796","0.0657","","","0.19","0.206","","","","","","1.094","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115353","11.2863","0.0009","25.2819","0.0018","12.832","0.0009","90","","112.743","0.001","90","","3376.8","0.4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C42 H80 B2 Fe6 Mo2 N12 P4 S8 -","- C42 H80 B2 Fe6 Mo2 N12 P4 S8 -","- C84 H160 B4 Fe12 Mo4 N24 P8 S16 -","2","0.5","","Yugen Zhang; Jing-Lin Zuo; Hong-Cai Zhou; R. H. Holm","Rearrangement of Symmetrical Dicubane Clusters into Topological Analogues of the P Cluster of Nitrogenase: Nature's Choice?","Journal of the American Chemical Society","2002","124","","14292","14293","10.1021/ja0279702","","","0.71073","MoKα","","0.0752","0.0496","","","0.1223","0.1403","","","","","","1.063","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115354","18.3853","0.0011","17.5344","0.001","29.4244","0.0016","90","","96.619","0.001","90","","9422.5","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H109 B2 Fe6 Mo2 N24 S11 -","- C60 H109 B2 Fe6 Mo2 N24 S11 -","- C240 H436 B8 Fe24 Mo8 N96 S44 -","4","1","","Yugen Zhang; Jing-Lin Zuo; Hong-Cai Zhou; R. H. Holm","Rearrangement of Symmetrical Dicubane Clusters into Topological Analogues of the P Cluster of Nitrogenase: Nature's Choice?","Journal of the American Chemical Society","2002","124","","14292","14293","10.1021/ja0279702","","","0.71073","MoKα","","0.0933","0.0661","","","0.1512","0.1659","","","","","","1.14","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115355","22.981","0.007","16.858","0.005","24.753","0.007","90","","96.441","0.005","90","","9529","5","293","2","293","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","tetrakis(tetraethylammonium)bis(trispyrazoloylborate) -bis(hydrogensulfido)-mu6-sulfido-hexakis-(mu3)-sulfido -bis(mu2)-sulfido-hexa-iron-di-vanadium acetonitrile solvate","","- C62 H120 B2 Fe6 N22 S11 V2 -","- C62 H120 B2 Fe6 N22 S11 V2 -","- C248 H480 B8 Fe24 N88 S44 V8 -","4","0.5","","Yugen Zhang; Jing-Lin Zuo; Hong-Cai Zhou; R. H. Holm","Rearrangement of Symmetrical Dicubane Clusters into Topological Analogues of the P Cluster of Nitrogenase: Nature's Choice?","Journal of the American Chemical Society","2002","124","","14292","14293","10.1021/ja0279702","","","0.71073","MoKα","","0.0878","0.0743","","","0.1601","0.1664","","","","","","1.246","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115356","9.576","0.001","11.239","0.002","22.457","0.002","90","","90.77","0.01","90","","2416.7","0.5","301.2","","301.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 Au P -","- C26 H38 Au P -","- C104 H152 Au4 P4 -","4","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0205","","","0.0243","","","","","1.116","1.116","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115357","9.579","0.001","11.34","0.001","22.543","0.002","90","","91.59","","90","","2447.8","0.4","301","2","301","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","gold-complex","","","- C26 H37 Au F P -","- C26 H37 Au F P -","- C104 H148 Au4 F4 P4 -","4","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.71073","MoKα","","0.0437","0.0356","","","0.0957","0.109","","","","","","1.15","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115358","12.062","0.002","16.782","0.003","12.667","0.002","90","","97.83","0.02","90","","2540.2","0.7","301.2","","301.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H40 Au P -","- C27 H40 Au P -","- C108 H160 Au4 P4 -","4","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0336","","","0.0493","","","","","1.231","1.231","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115359","12.321","0.004","16.755","0.002","12.731","0.002","90","","93.47","0.02","90","","2623.3","1","301.2","","301.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H38 Au P -","- C28 H38 Au P -","- C112 H152 Au4 P4 -","4","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0233","","","0.0272","","","","","1.178","1.178","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115360","13.273","0.001","17.234","0.002","25.08","0.002","90","","94.68","0.01","90","","5717.8","0.9","301.2","","301.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H42 Au P -","- C32 H42 Au P -","- C256 H336 Au8 P8 -","8","2","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0283","","","0.0339","","","","","1.093","1.093","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115361","18.663","0.003","19.047","0.003","16.774","0.003","90","","90","","90","","5962.7","1.7","301.2","","301.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C34 H42 Au P -","- C34 H42 Au P -","- C272 H336 Au8 P8 -","8","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0297","","","0.0399","","","","","1.63","1.63","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115362","7.785","0.002","16.959","0.003","27.833","0.006","90","","95.44","0.03","90","","3658.1","1.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H46 Au P -","- C42 H46 Au P -","- C168 H184 Au4 P4 -","4","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.71069","MoKα","","0.0634","0.0375","","","0.0924","0.121","","","","","","0.93","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115363","9.542","0.002","11.13","0.002","22.448","0.003","90","","91.8","0.02","90","","2382.9","0.7","301.2","","301.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H37 Au N P -","- C25 H37 Au N P -","- C100 H148 Au4 N4 P4 -","4","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0301","","","0.0405","","","","","1.674","1.674","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115364","9.527","0.002","16.889","0.003","13.687","0.002","90","","91.77","0.02","90","","2201.2","0.7","301.2","","301.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H70 Au2 P2 -","- C46 H70 Au2 P2 -","- C92 H140 Au4 P4 -","2","0.5","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0449","","","0.0599","","","","","1.719","1.719","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115365","13.284","0.002","14.46","0.002","15.618","0.003","97.15","0.02","100.99","0.02","115.93","0.02","2574.1","1","301.2","","301.2","","","","","","","","","5","P -1","-P 1","2","","","","- C53 H80 Au2 O2 P2 -","- C53 H74 Au2 O2 P2 -","- C106 H148 Au4 O4 P4 -","2","1","","Hsiu-Yi Chao; Wei Lu; Yanqin Li; Michael C. W. Chan; Chi-Ming Che; Kung-Kai Cheung; Nianyong Zhu","Organic Triplet Emissions of Arylacetylide Moieties Harnessed through Coordination to [Au(PCy3)]+. Effect of Molecular Structure upon Photoluminescent Properties","Journal of the American Chemical Society","2002","124","","14696","14706","10.1021/ja0209417","","","0.7107","MoKalpha","","","0.0467","","","0.0655","","","","","1.625","1.625","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115366","11.8161","0.0002","14.1196","0.0004","22.7184","0.0006","91.812","0.001","103.976","0.001","102.74","0.001","3573.09","0.15","140.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H57 N3 O0.5 P4 Ru -","- C29.15 H57 N3 O0.35 P4 Ru -","- C116.6 H228 N12 O1.4 P16 Ru4 -","4","2","","Andrew W. Holland; Robert G. Bergman","Effects of Phosphine Ligand Chelation on the Reactivity of Monomeric Parent Amido Ruthenium Complexes: Synthesis and Reactivity of Such a Complex Bearing Monodentate Ligands","Journal of the American Chemical Society","2002","124","","14684","14695","10.1021/ja027620f","","","0.7107","MoKα","","","0.0521","","","","0.0634","","","","","","1.613","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115367","9.121","0.007","16.772","0.01","16.949","0.008","90","","90","","90","","2593","3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[(R)-1,2-bis(ethoxycarbonyl)ethyl-d1a](pyridine-d5)- bis(dimethylglyoxymato-d6)cobalt(III)","","- C21 H14 Co D18 N5 O8 -","- C21 H32 Co N5 O8 -","- C84 H128 Co4 N20 O32 -","4","1","","Takashi Ohhara; Susumu Ikeda; Hiroyuki Imura; Hidehiro Uekusa; Yuji Ohashi; Ichiro Tanaka; Nobuo Niimura","Direct Observation of Deuterium Migration in Crystalline-State Reaction by Single Crystal Neutron Diffraction IV. ""Hula-Twist"" Rotation of a Long Alkyl Radical Produced by Photoirradiation","Journal of the American Chemical Society","2002","124","","14736","14740","10.1021/ja027872g","","","0.71073","MoKα","","0.0486","0.0398","","","0.1065","0.1133","","","","","","1.048","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115368","9.133","0.001","16.813","0.001","16.911","0.001","90","","90","","90","","2596.7","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[(R)-1,2-bis(ethoxycarbonyl)ethyl-d1a](pyridine-d5)- bis(dimethylglyoxymato-d6)cobalt(III)","","- C21 H14 Co D18 N5 O8 -","- C20.984 H13.974 Co D18.004 N5 O7.992 -","- C83.936 H55.896 Co4 D72.016 N20 O31.968 -","4","1","","Takashi Ohhara; Susumu Ikeda; Hiroyuki Imura; Hidehiro Uekusa; Yuji Ohashi; Ichiro Tanaka; Nobuo Niimura","Direct Observation of Deuterium Migration in Crystalline-State Reaction by Single Crystal Neutron Diffraction IV. ""Hula-Twist"" Rotation of a Long Alkyl Radical Produced by Photoirradiation","Journal of the American Chemical Society","2002","124","","14736","14740","10.1021/ja027872g","","neutron","1.23","Neutron","","0.1319","0.1256","","","0.3065","0.3098","","","","","","2.754","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115369","6.415","0.0002","12.041","0.0005","19.022","0.001","90","","108.702","0.0014","90","","1391.74","0.1","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ADG001B","","","- C14 H19 Cl O2 Ti -","- C14 H19 Cl O2 Ti -","- C56 H76 Cl4 O8 Ti4 -","4","1","","Antonio G. DiPasquale; Werner Kaminsky; James M. Mayer","Oxygen-Oxygen Bond Homolysis in a Novel Titanium(IV) Alkylperoxide Complex, Cp2Ti(OOtBu)Cl","Journal of the American Chemical Society","2002","124","","14534","14535","10.1021/ja028500a","","","0.71073","MoKα","","0.0551","0.0393","","","0.1016","0.1083","","","","","","1.047","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115370","12.6893","0.001","11.0908","0.001","16.796","0.005","90","0.02","97.61","0.02","90","0.01","2343","0.8","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","stephacidin B","","","- C54 H57 N7 O8 -","- C54 H57 N7 O8 -","- C108 H114 N14 O16 -","2","1","","Jingfang Qian-Cutrone; Stella Huang; Yue-Zhong Shu; Dolatrai Vyas; Craig Fairchild; Ana Menendez; Kimberly Krampitz; Richard Dalterio; Steven E Klohr; Qi Gao","Stephacidin A and B: Two Structurally Novel, Selective Inhibitors of the Testosterone-Dependent Prostate LNCaP Cells","Journal of the American Chemical Society","2002","124","","14556","14557","10.1021/ja028538n","","","1.5418","CuKα","","0.0401","0.0373","","","0.0918","0.0947","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115371","40.805","0.006","40.805","0.006","60.53","0.01","90","","90","","120","","87283","2","93.2","","","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C124 H120 Ag4 N24 O18 S4 -","- C123.25 H105.75 Ag4 N24 O15.75 S3.25 -","- C2958 H2538 Ag96 N576 O378 S78 -","24","1.33333","","Shuichi Hiraoka; Tao Yi; Motoo Shiro; Mitsuhiko Shionoya","Triangular and Tetrahedral Array of Silver(I) Ions by a Novel Disk-Shaped Tridentate Ligand: Dynamic Control of Coordination Equilibrium of the Silver(I) Complexes","Journal of the American Chemical Society","2002","124","","14510","14511","10.1021/ja028659n","","","0.7107","MoKα","","","0.0887","","","","0.128","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115372","18.3194","0.0003","11.6991","0.0002","19.5426","0.0004","90","","115.994","0.001","90","","3764.68","0.12","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H47 Cl N2 P2 Ru -","- C42 H47 Cl N2 P2 Ru -","- C168 H188 Cl4 N8 P8 Ru4 -","4","1","","Kamaluddin Abdur-Rashid; Sean E. Clapham; Alen Hadzovic; Jeremy N. Harvey; Alan J. Lough; Robert H. Morris","Mechanism of the Hydrogenation of Ketones Catalyzed by trans-Dihydrido(diamine)ruthenium(II) Complexes","Journal of the American Chemical Society","2002","124","","15104","15118","10.1021/ja016817p","","","0.71073","MoKα","","0.0737","0.039","","","0.0813","0.0935","","","","","","0.995","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4115373","11.109","0.0002","11.976","0.0002","14.251","0.0002","88.465","0.0007","76.124","0.0007","77.973","0.0007","1799.7","0.05","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C42 H46 N2 P2 Ru -","- C42 H46 N2 P2 Ru -","- C84 H92 N4 P4 Ru2 -","2","1","","Kamaluddin Abdur-Rashid; Sean E. Clapham; Alen Hadzovic; Jeremy N. Harvey; Alan J. Lough; Robert H. Morris","Mechanism of the Hydrogenation of Ketones Catalyzed by trans-Dihydrido(diamine)ruthenium(II) Complexes","Journal of the American Chemical Society","2002","124","","15104","15118","10.1021/ja016817p","","","0.7107","MoKα","","0.031","0.0268","","","0.0645","0.0671","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115374","10.9055","0.0002","17.1298","0.0003","21.0805","0.0003","84.145","0.001","89.997","0.001","81.012","0.001","3868.88","0.11","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C43 H48 N2 O2 P2 Ru -","- C43 H48 N2 O2 P2 Ru -","- C172 H192 N8 O8 P8 Ru4 -","4","2","","Kamaluddin Abdur-Rashid; Sean E. Clapham; Alen Hadzovic; Jeremy N. Harvey; Alan J. Lough; Robert H. Morris","Mechanism of the Hydrogenation of Ketones Catalyzed by trans-Dihydrido(diamine)ruthenium(II) Complexes","Journal of the American Chemical Society","2002","124","","15104","15118","10.1021/ja016817p","","","0.71073","MoKα","","0.122","0.082","","","0.1858","0.2064","","","","","","1.082","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115375","10.6872","0.0003","17.5724","0.0006","27.1237","0.0012","90","","90","","90","","5093.8","0.3","150","1","150","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C60 H46 O P2 Ru -","- C60 H45 O P2 Ru -","- C240 H180 O4 P8 Ru4 -","4","1","","Kamaluddin Abdur-Rashid; Sean E. Clapham; Alen Hadzovic; Jeremy N. Harvey; Alan J. Lough; Robert H. Morris","Mechanism of the Hydrogenation of Ketones Catalyzed by trans-Dihydrido(diamine)ruthenium(II) Complexes","Journal of the American Chemical Society","2002","124","","15104","15118","10.1021/ja016817p","","","0.71073","MoKα","","0.064","0.048","","","0.1079","0.1141","","","","","","1.03","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115376","10.918","0.0009","18.917","0.0011","25.048","0.0018","90","","94.397","0.004","90","","5158.1","0.6","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1-Bis(di-tert-butyl(methyl)silyl]-2,2-bis(2,4,6-triisopropylphenyl)- 1-sila-2-stannaethene","","- C48 H88 Si3 Sn -","- C48 H88 Si3 Sn -","- C192 H352 Si12 Sn4 -","4","1","","Akira Sekiguchi; Rika Izumi; Vladimir Ya. Lee; Masaaki Ichinohe","The First Silastannene >SiSn<: A New Doubly-Bonded System of Heavier Group 14 Elements","Journal of the American Chemical Society","2002","124","","14822","14823","10.1021/ja021077l","","","0.7107","MoKα","","0.114","0.068","","","0.1397","0.163","","","","","","1.024","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115377","10.9718","0.0009","16.101","0.002","18.681","0.001","90","","91.601","0.004","90","","3298.8","0.5","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H33 F3 O3 P2 Pd S -","- C32 H33 F3 O3 P2 Pd S -","- C128 H132 F12 O12 P8 Pd4 S4 -","4","1","","Moniek Tromp; Jeroen A. van Bokhoven; Richard J. van Haaren; Gino P. F. van Strijdonck; Ad M. J. van der Eerden; Piet W. N. M. van Leeuwen; Diek C. Koningsberger","Structure-Performance Relations in Homogeneous Pd Catalysis by In Situ EXAFS Spectroscopy","Journal of the American Chemical Society","2002","124","","14814","14815","10.1021/ja026604f","","","1.5418","CuKα","","0.072","0.065","","0.07","","0.067","","","1.058","","","1.089","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4115378","22.809","0.005","9.523","0.0019","11.144","0.002","90","","90","","90","","2420.6","0.8","200","2","200","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C26 H21 Mn O6 W -","- C26 H21 Mn O6 W -","- C104 H84 Mn4 O24 W4 -","4","0.5","","Li Shao; Steven J. Geib; Paul D. Badger; N. John Cooper","[2 + 2] Cross Coupling of Benzene and Tropylium Ligands in Reductively Activated Piano Stool Complexes of Mn, Cr, and W","Journal of the American Chemical Society","2002","124","","14812","14813","10.1021/ja027081e","","","0.71073","MoKα","","0.047","0.0375","","","0.1001","0.1045","","","","","","1.21","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115379","8.7774","0.0009","10.2972","0.001","13.6424","0.0013","92.513","0.002","90.93","0.002","94.008","0.002","1228.6","0.2","173","2","173","2","","","","","","","","2","P -1","-P 1","2","","","","- C30 H44 -","- C30 H44 -","- C60 H88 -","2","1","","Rajendra Rathore; Mihaela I. Deselnicu; Carrie L. Burns","A Remarkably Efficient Synthesis of Pure cis-Stilbenoid Hydrocarbons Using trans-Dibromoalkenes via Palladium Catalysis","Journal of the American Chemical Society","2002","124","","14832","14833","10.1021/ja027421w","","","0.71073","MoKα","","0.0615","0.0483","","","0.1307","0.1393","","","","","","1.018","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115380","8.491","0.0009","9.8941","0.001","16.8648","0.0017","98.979","0.002","100.758","0.002","91.471","0.002","1372.7","0.2","173","2","173","2","","","","","","","","2","P -1","-P 1","2","","","","- C34 H44 -","- C34 H44 -","- C68 H88 -","2","1","","Rajendra Rathore; Mihaela I. Deselnicu; Carrie L. Burns","A Remarkably Efficient Synthesis of Pure cis-Stilbenoid Hydrocarbons Using trans-Dibromoalkenes via Palladium Catalysis","Journal of the American Chemical Society","2002","124","","14832","14833","10.1021/ja027421w","","","0.71073","MoKα","","0.1128","0.097","","","0.2721","0.2879","","","","","","0.993","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115381","17.686","0.002","18.44","0.01","14.89","0.002","99.54","0.01","110.68","0.01","107.37","0.02","4131","2","123.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C45 H69 As -","- C45 H69 As -","- C180 H276 As4 -","4","2","","Shigeru Sasaki; Katsuhide Sutoh; Fumiki Murakami; Masaaki Yoshifuji","Synthesis, Structure, and Redox Properties of the Extremely Crowded Triarylpnictogens: Tris(2,4,6-triisopropylphenyl)phosphine, Arsine, Stibine, and Bismuthine","Journal of the American Chemical Society","2002","124","","14830","14831","10.1021/ja027493n","","","0.7107","MoKα","","","0.0471","","","","0.0639","","","","","","1.655","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115382","11.492","0.002","18.212","0.007","10.496","0.002","100.96","0.02","91.82","0.01","96.24","0.02","2140.8","1","200.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C45 H69 P -","- C45 H69 P -","- C90 H138 P2 -","2","1","","Shigeru Sasaki; Katsuhide Sutoh; Fumiki Murakami; Masaaki Yoshifuji","Synthesis, Structure, and Redox Properties of the Extremely Crowded Triarylpnictogens: Tris(2,4,6-triisopropylphenyl)phosphine, Arsine, Stibine, and Bismuthine","Journal of the American Chemical Society","2002","124","","14830","14831","10.1021/ja027493n","","","0.7107","MoKα","","","0.0813","","","","0.1656","","","","","","1.664","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115383","19.757","0.002","18.344","0.002","24.842","0.004","90","","111.049","0.003","90","","8402.5","1.8","115.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C45 H69 Sb -","- C45 H69 Sb -","- C360 H552 Sb8 -","8","2","","Shigeru Sasaki; Katsuhide Sutoh; Fumiki Murakami; Masaaki Yoshifuji","Synthesis, Structure, and Redox Properties of the Extremely Crowded Triarylpnictogens: Tris(2,4,6-triisopropylphenyl)phosphine, Arsine, Stibine, and Bismuthine","Journal of the American Chemical Society","2002","124","","14830","14831","10.1021/ja027493n","","","0.7107","MoKα","","","0.0344","","","","0.0483","","","","","","1.339","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115384","25.6986","0.0015","35.504","0.003","29.214","0.002","90","","100.573","0.003","90","","26202","3","147","2","147","2","","","","","","","synthetic","6","P 1 c 1","P -2yc","7","","","","- C130 H325 Cu70 O P21 Se35 -","- C130 Cu70.01 O P21 Se35 -","- C520 Cu280.04 O4 P84 Se140 -","4","2","","Nathan R. M. Crawford; Allan G. Hee; Jeffrey R. Long","Cluster Synthesis via Ligand-Arrested Solid Growth: Triethylphosphine-Capped Fragments of Binary Metal Chalcogenides","Journal of the American Chemical Society","2002","124","","14842","14843","10.1021/ja027862f","","","0.71073","MoKα","","0.3223","0.1581","","","0.34","0.4339","","","","","","1.313","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115385","17.2391","0.0007","23.4906","0.001","17.303","0.0012","90","","90.305","0.002","90","","7006.9","0.6","130","2","130","2","","","","","","","synthetic","5","I 1 2/m 1","-I 2y","12","","","","- C84 H210 Cu26 P14 Se13 -","- C84 H210 Cu26 P14 Se13 -","- C168 H420 Cu52 P28 Se26 -","2","0.25","","Nathan R. M. Crawford; Allan G. Hee; Jeffrey R. Long","Cluster Synthesis via Ligand-Arrested Solid Growth: Triethylphosphine-Capped Fragments of Binary Metal Chalcogenides","Journal of the American Chemical Society","2002","124","","14842","14843","10.1021/ja027862f","","","0.71073","MoKα","","0.1757","0.0925","","0.2745","0.2391","","","","1.078","1.37","1.37","","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115386","7.4957","0.0012","9.8957","0.0015","18.149","0.003","90","","90","","90","","1346.2","0.4","123","2","123","2","","","","","","","","3","C 2 2 21","C 2c 2","20","1,2-dithiin annelated with BCO","","","- C16 H20 S2 -","- C16 H20 S2 -","- C64 H80 S8 -","4","0.5","","Atsushi Wakamiya; Tohru Nishinaga; Koichi Komatsu","1,2-Dithiin Annelated with Bicyclo[2.2.2]octene Frameworks. One-Electron and Two-Electron Oxidations and Formation of a Novel 2,3,5,6-Tetrathiabicyclo[2.2.2]oct-7-ene Radical Cation with Remarkable Stability Owing to a Strong Transannular Interaction","Journal of the American Chemical Society","2002","124","","15038","15050","10.1021/ja028297j","","","0.71073","MoKα","","0.0524","0.0518","","","0.1417","0.1422","","","","","","1.223","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115387","8.0506","0.0008","23.896","0.002","12.1284","0.0011","90","","96.488","0.002","90","","2318.3","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","tetrathia radical cation","","","- C16 H20 Cl6 S4 Sb -","- C16 H20 Cl6 S4 Sb -","- C64 H80 Cl24 S16 Sb4 -","4","1","","Atsushi Wakamiya; Tohru Nishinaga; Koichi Komatsu","1,2-Dithiin Annelated with Bicyclo[2.2.2]octene Frameworks. One-Electron and Two-Electron Oxidations and Formation of a Novel 2,3,5,6-Tetrathiabicyclo[2.2.2]oct-7-ene Radical Cation with Remarkable Stability Owing to a Strong Transannular Interaction","Journal of the American Chemical Society","2002","124","","15038","15050","10.1021/ja028297j","","","0.71073","MoKα","","0.0483","0.045","","","0.1201","0.1223","","","","","","1.042","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115388","8.0312","0.0006","11.1246","0.0008","14.3052","0.001","107.786","0.001","92.856","0.001","108.053","0.001","1142.25","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","1,2-dithiolium cation","","","- C16 H21 Cl6 O2 S2 Sb -","- C16 H21 Cl6 O2 S2 Sb -","- C32 H42 Cl12 O4 S4 Sb2 -","2","1","","Atsushi Wakamiya; Tohru Nishinaga; Koichi Komatsu","1,2-Dithiin Annelated with Bicyclo[2.2.2]octene Frameworks. One-Electron and Two-Electron Oxidations and Formation of a Novel 2,3,5,6-Tetrathiabicyclo[2.2.2]oct-7-ene Radical Cation with Remarkable Stability Owing to a Strong Transannular Interaction","Journal of the American Chemical Society","2002","124","","15038","15050","10.1021/ja028297j","","","0.71073","MoKα","","0.0431","0.0383","","","0.1026","0.1048","","","","","","1.057","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115389","10.3179","0.0006","12.9096","0.0008","12.5001","0.0007","90","","112.27","0.001","90","","1540.82","0.16","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","diiodide","","","- C16 H20 I2 -","- C16 H20 I2 -","- C64 H80 I8 -","4","1","","Atsushi Wakamiya; Tohru Nishinaga; Koichi Komatsu","1,2-Dithiin Annelated with Bicyclo[2.2.2]octene Frameworks. One-Electron and Two-Electron Oxidations and Formation of a Novel 2,3,5,6-Tetrathiabicyclo[2.2.2]oct-7-ene Radical Cation with Remarkable Stability Owing to a Strong Transannular Interaction","Journal of the American Chemical Society","2002","124","","15038","15050","10.1021/ja028297j","","","0.71073","MoKα","","0.022","0.0188","","","0.0475","0.0485","","","","","","1.085","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4115390","12.97","0.002","13.3437","0.0019","14.041","0.002","90","","90","","90","","2430","0.6","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","protonated 2-butene-1,4-dione","","","- C17 H23 Cl8 O2 Sb -","- C17 H23 Cl8 O2 Sb -","- C68 H92 Cl32 O8 Sb4 -","4","0.5","","Atsushi Wakamiya; Tohru Nishinaga; Koichi Komatsu","1,2-Dithiin Annelated with Bicyclo[2.2.2]octene Frameworks. One-Electron and Two-Electron Oxidations and Formation of a Novel 2,3,5,6-Tetrathiabicyclo[2.2.2]oct-7-ene Radical Cation with Remarkable Stability Owing to a Strong Transannular Interaction","Journal of the American Chemical Society","2002","124","","15038","15050","10.1021/ja028297j","","","0.71073","MoKα","","0.0469","0.0376","","","0.0848","0.0887","","","","","","1.064","","","","has coordinates,has disorder","178924","2020-10-21","18:00:00",""
"4115391","10.5299","0.0007","14.42","0.0009","17.4768","0.0011","102.507","0.001","102.949","0.001","91.993","0.001","2515.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H50 N2 O6 Ti -","- C62 H50 N2 O6 Ti -","- C124 H100 N4 O12 Ti2 -","2","1","","Yu Yuan; Xin Li; Jie Sun; Kuiling Ding","To Probe the Origin of Activation Effect of Carboxylic Acid and (+)-NLE in Tridentated Titanium Catalyst Systems","Journal of the American Chemical Society","2002","124","","14866","14867","10.1021/ja0286775","","","0.71073","MoKα","","0.1199","0.05","","","0.1069","0.1169","","","","","","0.714","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115392","13.1301","0.0004","13.1301","0.0004","50.308","0.002","90","","90","","120","","7511.1","0.4","293","2","293","2","","","","","","","","6","P 61","P 61","169","","","","- C61 H50 Cl2 N2 O4 Ti -","- C60.96 H43.3 Cl1.303 N2 O4 Ti -","- C365.76 H259.8 Cl7.818 N12 O24 Ti6 -","6","1","","Yu Yuan; Xin Li; Jie Sun; Kuiling Ding","To Probe the Origin of Activation Effect of Carboxylic Acid and (+)-NLE in Tridentated Titanium Catalyst Systems","Journal of the American Chemical Society","2002","124","","14866","14867","10.1021/ja0286775","","","0.71073","MoKα","","0.1488","0.0687","","","0.1499","0.1804","","","","","","0.861","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115393","5.4616","0.0016","25.31","0.009","18.152","0.007","90","","94.38","0.03","90","","2501.9","1.5","203","","203","","","","","","","","sigma (St. Louis, MO)","5","P 1 21 1","P 2yb","4","α-indomethacin","1-(4-chlorobenxoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid","","- C19 H16 Cl N O4 -","- C19 H16 Cl N O4 -","- C114 H96 Cl6 N6 O24 -","6","3","","Xiaoming Chen; Kenneth R. Morris; Ulrich J. Griesser; Stephen R. Byrn; Joseph G. Stowell","Reactivity Differences of Indomethacin Solid Forms with Ammonia Gas","Journal of the American Chemical Society","2002","124","50","15012","15019","10.1021/ja017662o","","","0.71073","Mo-Κα","","","0.054","","","","0.198","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115394","7.254","0.001","9.959","0.002","10.793","0.002","90","","91.18","0.03","90","","779.5","0.2","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Tris(trifluoromethyl)_Borane_Carbonyl","","","- C4 B F9 O -","- C4 B F9 O -","- C16 B4 F36 O4 -","4","1","","Maik Finze; Eduard Bernhardt; Annegret Terheiden; Michael Berkei; Helge Willner; Dines Christen; Heinz Oberhammer; Friedhelm Aubke","Tris(trifluoromethyl)borane Carbonyl, (CF3)3BCO Synthesis, Physical, Chemical and Spectroscopic Properties, Gas Phase, and Solid State Structure","Journal of the American Chemical Society","2002","124","","15385","15398","10.1021/ja0209924","","","0.71069","MoKa","","0.1651","0.1271","","0.3937","0.3641","","","","1.137","1.337","1.337","","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115395","11.396","0.0005","18.121","0.0004","16.695","0.0007","90","","104.52","0.002","90","","3337.5","0.2","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1,3,3-Tetra-tert-butyl-2-[di-tert-butyl(methyl)silyl]- 1,3-dimethyltrisilane-2-lithium","","- C27 H63 Li Si4 -","- C27 H63 Li Si4 -","- C108 H252 Li4 Si16 -","4","1","","Masaaki Nakamoto; Tomohide Fukawa; Vladimir Ya. Lee; Akira Sekiguchi","Nearly Planar Nonsolvated Monomeric Silyl- and Germyllithiums as a Result of an Intramolecular CH-Li Agostic Interaction","Journal of the American Chemical Society","2002","124","","15160","15161","10.1021/ja021142r","","","0.7107","MoKα","","0.0765","0.0669","","","0.18","0.1906","","","","","","1.008","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115396","16.906","0.0002","11.413","0.0006","17.519","0.0006","90","","90","","90","","3380.3","0.2","120","","120","","","","","","","","","5","P n a 21","P 2c -2n","33","","Tris[di-tert-butyl(methyl)silyl]germyllithium","","- C27 H63 Ge Li Si3 -","- C27 H63 Ge Li Si3 -","- C108 H252 Ge4 Li4 Si12 -","4","1","","Masaaki Nakamoto; Tomohide Fukawa; Vladimir Ya. Lee; Akira Sekiguchi","Nearly Planar Nonsolvated Monomeric Silyl- and Germyllithiums as a Result of an Intramolecular CH-Li Agostic Interaction","Journal of the American Chemical Society","2002","124","","15160","15161","10.1021/ja021142r","","","0.7107","MoKα","","0.0399","0.0354","","","0.0922","0.0948","","","","","","1.06","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115397","14.829","0.005","20.776","0.006","16.806","0.003","90","","93.628","0.015","90","","5167","2","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris[di-tert-butyl(methyl)silyl]silyllithium (THF)4","","- C43 H95 Li O4 Si4 -","- C43 H95 Li O4 Si4 -","- C172 H380 Li4 O16 Si16 -","4","1","","Masaaki Nakamoto; Tomohide Fukawa; Vladimir Ya. Lee; Akira Sekiguchi","Nearly Planar Nonsolvated Monomeric Silyl- and Germyllithiums as a Result of an Intramolecular CH-Li Agostic Interaction","Journal of the American Chemical Society","2002","124","","15160","15161","10.1021/ja021142r","","","0.7107","MoKα","","0.246","0.0775","","","0.1735","0.2247","","","","","","0.771","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115398","33.156","0.0006","33.156","0.0006","32.884","0.0005","90","","90","","120","","31306.9","0.9","120","","120","","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","Lithium tris[di-tert-butyl(methyl)silyl]germanide","","- C168 H372 Ge4 Li4 O15 Si12 -","- C168 H363 Ge4 Li4 O15 Si12 -","- C1008 H2178 Ge24 Li24 O90 Si72 -","6","0.333333","","Masaaki Nakamoto; Tomohide Fukawa; Vladimir Ya. Lee; Akira Sekiguchi","Nearly Planar Nonsolvated Monomeric Silyl- and Germyllithiums as a Result of an Intramolecular CH-Li Agostic Interaction","Journal of the American Chemical Society","2002","124","","15160","15161","10.1021/ja021142r","","","0.7107","MoKα","","0.0794","0.0696","","","0.1754","0.1842","","","","","","1.047","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4115399","22.5443","0.0017","12.7044","0.0009","29.526","0.002","90","","90.23","0.002","90","","8456.5","1","98","2","98","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H44 B Co I P3 -","- C48 H44 B Co I P3 -","- C384 H352 B8 Co8 I8 P24 -","8","2","","David M. Jenkins; Angel J. Di Bilio; Matthew J. Allen; Theodore A. Betley; Jonas C. Peters","Elucidation of a Low Spin Cobalt(II) System in a Distorted Tetrahedral Geometry","Journal of the American Chemical Society","2002","124","","15336","15350","10.1021/ja026433e","","","0.71073","MoKα","","0.0899","0.0476","","","0.0786","0.0843","","","","","","1.137","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115400","22.214","0.003","19.286","0.003","18.008","0.003","90","","90","","90","","7715","2","98","2","98","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C90 H82 B2 Br2 Co2 P6 -","- C90 H82 B2 Br2 Co2 P6 -","- C360 H328 B8 Br8 Co8 P24 -","4","0.5","","David M. Jenkins; Angel J. Di Bilio; Matthew J. Allen; Theodore A. Betley; Jonas C. Peters","Elucidation of a Low Spin Cobalt(II) System in a Distorted Tetrahedral Geometry","Journal of the American Chemical Society","2002","124","","15336","15350","10.1021/ja026433e","","","0.71073","MoKα","","0.1432","0.0695","","","0.0965","0.1012","","","","","","1.534","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115401","26.34","0.003","13.2151","0.0014","28.015","0.003","90","","117.909","0.002","90","","8617.4","1.6","98","2","98","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C102 H94 B2 Cl2 Co2 P6 -","- C102 H94 B2 Cl2 Co2 P6 -","- C408 H376 B8 Cl8 Co8 P24 -","4","1","","David M. Jenkins; Angel J. Di Bilio; Matthew J. Allen; Theodore A. Betley; Jonas C. Peters","Elucidation of a Low Spin Cobalt(II) System in a Distorted Tetrahedral Geometry","Journal of the American Chemical Society","2002","124","","15336","15350","10.1021/ja026433e","","","0.71073","MoKα","","0.0995","0.0468","","","0.066","0.0724","","","","","","1.028","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4115402","12.916","0.003","18.582","0.004","21.674","0.005","90","","106.262","0.003","90","","4994","2","98","2","98","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C57 H53 B Co I O2 P3 -","- C57 H53 B Co I O2 P3 -","- C228 H212 B4 Co4 I4 O8 P12 -","4","1","","David M. Jenkins; Angel J. Di Bilio; Matthew J. Allen; Theodore A. Betley; Jonas C. Peters","Elucidation of a Low Spin Cobalt(II) System in a Distorted Tetrahedral Geometry","Journal of the American Chemical Society","2002","124","","15336","15350","10.1021/ja026433e","","","0.71073","MoKα","","0.0547","0.0361","","","0.0602","0.0637","","","","","","1.755","","","","has coordinates","178925","2020-10-21","18:00:00",""
"4115403","17.2447","0.0014","16.484","0.0013","16.4939","0.0013","90","","109.181","0.001","90","","4428.3","0.6","96","2","96","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C53 H50 B Co O P3 -","- C53 H50 B Co O P3 -","- C212 H200 B4 Co4 O4 P12 -","4","1","","David M. Jenkins; Angel J. Di Bilio; Matthew J. Allen; Theodore A. Betley; Jonas C. Peters","Elucidation of a Low Spin Cobalt(II) System in a Distorted Tetrahedral Geometry","Journal of the American Chemical Society","2002","124","","15336","15350","10.1021/ja026433e","","","0.71073","MoKα","","0.0454","0.0378","","","0.0612","0.0624","","","","","","1.661","","","","has coordinates","178925","2020-10-21","18:00:00",""
"4115404","13.435","0.003","16.162","0.003","10.858","0.002","90","","100.46","0.003","90","","2318.5","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H66 Li2 N2 O8 P2 -","- C48 H66 Li2 N2 O8 P2 -","- C96 H132 Li4 N4 O16 P4 -","2","0.5","","Ignacio Fernández; Julia María Álvarez Gutíerrez; Nikolaus Kocher; Dirk Leusser; Dietmar Stalke; Javier González; Fernando López Ortiz","[Li{CH(Me)P(Ph)2(NCO2Me)}2(THF)2]: Crystal, Solution, and Calculated Structure of aN-Delocalized Lithium Phosphazene","Journal of the American Chemical Society","2002","124","","15184","15185","10.1021/ja027469+","","","0.71073","MoKα","","0.0821","0.0593","","","0.1527","0.1691","","","","","","1.086","","","","has coordinates,has disorder","178925","2020-10-21","18:00:00",""
"4115405","8.7183","0.0003","12.1533","0.0006","15.4338","0.0009","73.528","0.002","74.898","0.002","78.929","0.001","1501.65","0.13","296.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H36 Cl F3 O4 Ru2 S3 -","- C23 Cl F3 O4 Ru2 S3 -","- C46 Cl2 F6 O8 Ru4 S6 -","2","1","","Youichi Inada; Yoshiaki Nishibayashi; Masanobu Hidai; Sakae Uemura","Ruthenium-Catalyzed Propargylic Substitution Reaction of Propargylic Alcohols with Thiols: A General Synthetic Route to Propargylic Sulfides","Journal of the American Chemical Society","2002","124","","15172","15173","10.1021/ja027754t","","","0.7107","MoKα","","","0.039","","","","0.048","","","","","","1.484","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115406","5.4003","0.0004","18.3885","0.0014","8.9518","0.0007","90","","90.707","0.001","90","","888.88","0.12","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C7 H13 N O6 -","- C7 H13 N O6 -","- C28 H52 N4 O24 -","4","2","","Valeri V. Mossine; Charles L. Barnes; Milton S. Feather; Thomas P. Mawhinney","Acyclic Tautomers in Crystalline Carbohydrates: The Keto Forms of 1-Deoxy-1-carboxymethylamino-d-2-pentuloses (Pentulose-glycines)","Journal of the American Chemical Society","2002","124","","15178","15179","10.1021/ja0282184","","","0.71073","MoKα","","0.0451","0.0369","","","0.0855","0.09","","","","","","1.043","","","","has coordinates","178925","2020-10-21","18:00:00",""
"4115407","14.063","0.003","7.4093","0.0015","15.285","0.003","90","","90","","90","","1592.7","0.6","293","2","293","2","","","","","","","","7","P m m n :2","-P 2ab 2a","59","","","","- C8.6 H18.8 F4 N2 O23 Si9 U2 -","- C8.64 F4 N1.99 O23 Si9 U2 -","- C17.28 F8 N3.98 O46 Si18 U4 -","2","0.25","","Xiqu Wang; Jin Huang; Allan J. Jacobson","[(CH3)4N][(C5H5NH)0.8((CH3)3NH)0.2]U2Si9O23F4(USH-8): An Organically Templated Open-Framework Uranium Silicate","Journal of the American Chemical Society","2002","124","","15190","15191","10.1021/ja0288284","","","0.71073","MoKα","","0.1467","0.0558","","","0.0837","0.1003","","","","","","0.861","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115408","8.3625","0.001","32.698","0.004","8.8068","0.0011","90","","107.747","0.002","90","","2293.5","0.5","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H20 Co2 O9 Si -","- C18 H20 Co2 O9 Si -","- C72 H80 Co8 O36 Si4 -","4","2","","Scott E. Denmark; Shyh-Ming Yang","Intramolecular Silicon-Assisted Cross-Coupling: Total Synthesis of (+)-Brasilenyne","Journal of the American Chemical Society","2002","124","","15196","15197","10.1021/ja028936q","","","0.71073","MoKα","","0.0752","0.0452","","","0.0609","0.0665","","","","","","0.932","","","","has coordinates","178925","2020-10-21","18:00:00",""
"4119067","3.8994","","3.8994","","29.015","","90","","90","","90","","441.182","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Ag1.1 Ca0.9) (Ca0.6 Ag0.9 Nb3 O10)","","- Ag2 Ca1.5 Nb3 O10 -","- Ag2 Ca1.5 Nb3 O10 -","- Ag4 Ca3 Nb6 O20 -","2","0.0625","","Woodward, P.M.; Bhuvanesh, N.S.P.","Thermally induced A' - A site exchange in novel layered perovskitesAg2 (Ca1.5 M3 O10) (M = Nb, Ta)","Journal of the American Chemical Society","2002","124","","14294","14295","10.1021/ja027805m","","","","","","","","","","","","","","","","","","","","","has coordinates","178961","2020-10-21","18:00:00",""
"4119078","11.6806","","4.3759","","18.9153","","90","","96.703","","90","","960.212","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Dy4 (B6 O15)","","- B6 Dy4 O15 -","- B6 Dy4 O15 -","- B24 Dy16 O60 -","4","0.5","","von der Eltz, B.; Huppertz, H.","Multianvil high-pressure synthesis of Dy4 B6 O15: the first oxoborate with edge-sharing B O4 tetrahedra","Journal of the American Chemical Society","2002","124","","9376","9377","10.1021/ja017691z","","","","","","","","","","","","","","","","","","","","","has coordinates","178961","2020-10-21","18:00:00",""
"4119080","17.2344","0.0009","23.2126","0.0012","22.2382","0.0012","90","","102.738","0.004","90","","8677.6","0.8","91","2","91","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Dipp*InBArF","","","- C48 H37 B F15 In -","- C48 H37 B F15 In -","- C384 H296 B8 F120 In8 -","8","2","","Wright, Robert J.; Phillips, Andrew D.; Hardman, Ned J.; Power, Philip P.","The “Diindene” ArInInAr (Ar = C6H3-2,6-Dipp2, Dipp = C6H3-2,6-Pri2). Dimeric versus Monomeric In(I) Aryls: para-Substituent Effects in Terphenyl Ligands","Journal of the American Chemical Society","2002","124","29","8538","","10.1021/ja026285s","","","0.71073","MoKα","","0.0686","0.0401","","","0.0796","0.0966","","","","","","1.058","","","","has coordinates","178961","2020-10-21","18:00:00",""
"4122285","15.794","0.0008","15.794","0.0008","15.1279","0.0012","90","","90","","90","","3773.7","0.4","183","2","183","2","","","","","","","","5","P 43","P 4cw","78","","","","- C15 H24 N2 O8 S -","- C15 H24 N2 O8 S -","- C120 H192 N16 O64 S8 -","8","2","","Tremmel, Peter; Geyer, Armin","An Oligomeric Ser-Pro Dipeptide Mimetic Assuming the Polyproline II Helix Conformation","Journal of the American Chemical Society","2002","124","29","8548","","10.1021/ja026098u","","","0.71073","MoKα","","0.1468","0.0586","","","0.1033","0.1267","","","","","","1.009","","","","has coordinates","179024","2020-10-21","18:00:00",""
"4124100","8.703","","7.154","","9.315","","90","","97.63","","90","","574.829","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Zn (H C O2)2 (H2 O)2","","- C2 H6 O6 Zn -","- C2 H6 O6 Zn -","- C8 H24 O24 Zn4 -","4","1","","Lipton, A.S.; Smith, M.D.; Adams, R.D.; Ellis, P.D.","67Zn solid-state and single-crystal NMR spectroscopy and x-ray structure of zinc formate dihydrate","Journal of the American Chemical Society","2002","124","","410","414","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124486","7.70736","","5.92871","","10.50584","","90","","90","","90","","480.061","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ba2 (V O3 N)","","- Ba2 N O3 V -","- Ba2 N1.034 O2.966 V -","- Ba8 N4.136 O11.864 V4 -","4","0.5","","Clarke, S.J.; Puyet, M.; Chalker, P.R.; Holman, J.; Michie, C.W.; Rosseinsky, M.J.","A first transition series pseudotetrahedral oxynitride anion: synthesis and characterization of Ba2 V O3 N","Journal of the American Chemical Society","2002","124","","3337","3342","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124487","3.78709","","3.78709","","12.9561","","90","","90","","90","","185.817","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- La4 Li Mn O8 -","- La4 Li Mn O8 -","- La4 Li Mn O8 -","1","0.03125","","Burley, J.C.; Battle, P.D.; Gallon, D.J.; Sloan, J.; Grey, C.P.; Rosseinsky, M.J.","Magnetism and structural chemistry of the n=1 Ruddlesden-Popper phases La4 Li Mn O8 and La3 Sr Li Mn O8","Journal of the American Chemical Society","2002","124","","620","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124488","3.80292","","3.80292","","12.6881","","90","","90","","90","","183.498","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","La3 Sr Li Mn O8","","- La3 Li Mn O8 Sr -","- La3 Li Mn O8 Sr -","- La3 Li Mn O8 Sr -","1","0.03125","","Burley, J.C.; Battle, P.D.; Gallon, D.J.; Sloan, J.; Grey, C.P.; Rosseinsky, M.J.","Magnetism and structural chemistry of the n=1 Ruddlesden-Popper phases La4 Li Mn O8 and La3 Sr Li Mn O8","Journal of the American Chemical Society","2002","124","","620","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124490","18.19","","10.406","","14.86","","90","","144.78","","90","","1622.18","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Na2.04 Cs1.068 C70","","- C70 Cs1.068 Na2.04 -","- C70 Cs1.068 Na2.04 -","- C140 Cs2.136 Na4.08 -","2","0.25","","Denning, M.S.; Watts, I.D.; Rosseinsky, M.J.; Moussa, S.M.; Durand, P.; Tanigaki, K.","Close-packed C70(3-) phases - synthesis, structure and electronic properties","Journal of the American Chemical Society","2002","124","","5570","5580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156665","2020-10-21","18:00:00",""
"4124491","14.804","","14.804","","14.804","","90","","90","","90","","3244.42","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Na2.24 Cs1.09 C70","","- C70 Cs1.09 Na2.24 -","- C70 Cs1.09 Na2.24 -","- C280 Cs4.36 Na8.96 -","4","0.0208333","","Denning, M.S.; Moussa, S.M.; Watts, I.D.; Rosseinsky, M.J.; Durand, P.; Tanigaki, K.","Close-packed C70(3-) phases - synthesis, structure and electronic properties","Journal of the American Chemical Society","2002","124","","5570","5580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156667","2020-10-21","18:00:00",""
"4124492","10.32","","10.32","","26.11","","90","","90","","120","","2408.22","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Na2.24 Cs1.09 C70","","- C70 Cs1.09 Na2.24 -","- C70 Cs1.09 Na2.24 -","- C210 Cs3.27 Na6.72 -","3","0.0833333","","Denning, M.S.; Rosseinsky, M.J.; Watts, I.D.; Durand, P.; Moussa, S.M.; Tanigaki, K.","Close-packed C70(3-) phases - synthesis, structure and electronic properties","Journal of the American Chemical Society","2002","124","","5570","5580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156669","2020-10-21","18:00:00",""
"4124493","14.983","","14.983","","14.983","","90","","90","","90","","3363.54","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Na1.68 Cs0.886 C70","","- C70 Cs0.886 Na1.68 -","- C70 Cs0.886 Na1.68 -","- C280 Cs3.544 Na6.72 -","4","0.0208333","","Denning, M.S.; Moussa, S.M.; Watts, I.D.; Durand, P.; Tanigaki, K.; Rosseinsky, M.J.","Close-packed C70(3-) phases - synthesis, structure and electronic properties","Journal of the American Chemical Society","2002","124","","5570","5580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156671","2020-10-21","18:00:00",""
"4124494","10.443","","10.443","","25.706","","90","","90","","120","","2427.82","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Na1.08 Cs0.883 C70","","- C70 Cs0.883 Na1.08 -","- C70 Cs0.883 Na1.08 -","- C210 Cs2.649 Na3.24 -","3","0.0833333","","Denning, M.S.; Watts, I.D.; Rosseinsky, M.J.; Moussa, S.M.; Tanigaki, K.; Durand, P.","Close-packed C70(3-) phases - synthesis, structure and electronic properties","Journal of the American Chemical Society","2002","124","","5570","5580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156673","2020-10-21","18:00:00",""
"4124495","15.2342","","15.2342","","15.2342","","90","","90","","90","","3535.57","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","K2 Cs C70","","- C70 Cs K2 -","- C70 Cs1.022 K2.08 -","- C280 Cs4.088 K8.32 -","4","0.0208333","","Denning, M.S.; Moussa, S.M.; Watts, I.D.; Durand, P.; Rosseinsky, M.J.; Tanigaki, K.","Close-packed C70(3-) phases - synthesis, structure and electronic properties","Journal of the American Chemical Society","2002","124","","5570","5580","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124499","9.157","","16.866","","9.538","","90","","90.61","","90","","1472.98","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K3 Pu (P S4)2","","- K3 P2 Pu S8 -","- K3 P2 Pu S8 -","- K12 P8 Pu4 S32 -","4","1","","Hess, R.F.; Gordon, P.L.; Tait, C.D.; Dorhout, P.K.; Abney, K.D.","Synthesis and structural characterization of the first quaternary plutonium thiophosphates : K3 Pu (P S4)2 and A Pu P2 S7 (A = K, Rb,Cs)","Journal of the American Chemical Society","2002","124","","1327","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124500","9.641","","12.255","","9.0152","","90","","90.218","","90","","1065.14","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K Pu (P2 S7)","","- K P2 Pu S7 -","- K P2 Pu S7 -","- K4 P8 Pu4 S28 -","4","1","","Hess, R.F.; Gordon, P.L.; Tait, C.D.; Dorhout, P.K.; Abney, K.D.","Synthesis and structural characterization of the first quaternary plutonium thiophosphates : K3 Pu (P S4)2 and A Pu P2 S7 (A = K, Rb,Cs)","Journal of the American Chemical Society","2002","124","","1327","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124501","9.8011","","12.3977","","9.0263","","90","","90.564","","90","","1096.74","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Rb Pu (P2 S7)","","- P2 Pu Rb S7 -","- P2 Pu Rb S7 -","- P8 Pu4 Rb4 S28 -","4","1","","Hess, R.F.; Gordon, P.L.; Tait, C.D.; Abney, K.D.; Dorhout, P.K.","Synthesis and structural characterization of the first quaternary plutonium thiophosphates : K3 Pu (P S4)2 and A Pu P2 S7 (A = K, Rb,Cs)","Journal of the American Chemical Society","2002","124","","1327","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124502","10.1034","","12.5412","","9.0306","","90","","91.007","","90","","1144.08","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs Pu (P2 S7)","","- Cs P2 Pu S7 -","- Cs P2 Pu S7 -","- Cs4 P8 Pu4 S28 -","4","1","","Hess, R.F.; Gordon, P.L.; Tait, C.D.; Abney, K.D.; Dorhout, P.K.","Synthesis and structural characterization of the first quaternary plutonium thiophosphates : K3 Pu (P S4)2 and A Pu P2 S7 (A = K, Rb,Cs)","Journal of the American Chemical Society","2002","124","","1327","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124503","18.226","","18.583","","6.579","","90","","90","","90","","2228.27","","","","","","","","","","","","","5","F d d 2","F 2 -2d","43","","Na16 (Al16 Si24 O80) (H2 O)16","","- Al16 H32 Na16 O96 Si24 -","- Al16 Na16 O96 Si24 -","- Al16 Na16 O96 Si24 -","1","0.0625","","Lee, Y.; Vogt, T.; Parise, J.B.; Hriljac, J.A.; Artioli, G.","Pressure-induced volume expansion of zeolites in the natrolite family","Journal of the American Chemical Society","2002","124","","5466","5475","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124504","18.39","","18.829","","6.547","","90","","90","","90","","2267","","","","","","","","","","","","","5","F d d 2","F 2 -2d","43","","Na16 (Al16 Si24 O80) (H2 O)32","","- Al16 H64 Na16 O112 Si24 -","- Al16 Na16 O112 Si24 -","- Al16 Na16 O112 Si24 -","1","0.0625","","Lee, Y.; Vogt, T.; Hriljac, J.A.; Parise, J.B.; Artioli, G.","Pressure-induced volume expansion of zeolites in the natrolite family","Journal of the American Chemical Society","2002","124","","5466","5475","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124505","17.924","","18.325","","6.487","","90","","90","","90","","2130.7","","","","","","","","","","","","","5","F d d 2","F 2 -2d","43","","Na16 (Al16 Si24 O80) (H2 O)32","","- Al16 H64 Na16 O112 Si24 -","- Al16 Na16 O112 Si24 -","- Al16 Na16 O112 Si24 -","1","0.0625","","Lee, Y.; Vogt, T.; Hriljac, J.A.; Parise, J.B.; Artioli, G.","Pressure-induced volume expansion of zeolites in the natrolite family","Journal of the American Chemical Society","2002","124","","5466","5475","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124506","14.3358","","14.3358","","14.3358","","90","","90","","90","","2946.22","","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","(N D3)0.97 (Na0.98 K0.85 Rb C60)","","- C60 D2.91 K0.85 N0.97 Na0.98 Rb -","- C60 D2.904 K0.852 N0.968 Na0.985 Rb0.997 -","- C240 D11.616 K3.408 N3.872 Na3.94 Rb3.988 -","4","0.0208333","","Margadonna, S.; Prassides, K.; Aslanis, E.","Ammoniated alkali fullerides (N D3)x Na A2 C60: ammonia specific effects and superconductivity","Journal of the American Chemical Society","2002","124","","10146","10156","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124507","14.42598","","14.42598","","14.42598","","90","","90","","90","","3002.18","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","(N D3)0.86 (Na0.93 Rb1.83 C60)","","- C60 D2.58 N0.86 Na0.93 Rb1.83 -","- C60 D2.568 N0.856 Na0.928 Rb1.835 -","- C240 D10.272 N3.424 Na3.712 Rb7.34 -","4","0.0208333","","Margadonna, S.; Prassides, K.; Aslanis, E.","Ammoniated alkali fullerides (N D3)x Na A2 C60: ammonia specific effects and superconductivity","Journal of the American Chemical Society","2002","124","","10146","10156","","","","","","","","","","","","","","","","","","","","","","has coordinates","157292","2020-10-21","18:00:00",""
"4124508","14.3879","","14.3879","","14.3879","","90","","90","","90","","2978.46","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","(N D3)0.79 (Na Rb2 C60)","","- C60 D2.37 N0.79 Na Rb2 -","- C60 N0.792 Na1.016 Rb2.015 -","- C240 N3.168 Na4.064 Rb8.06 -","4","0.0208333","","Margadonna, S.; Aslanis, E.; Prassides, K.","Ammoniated alkali fullerides (N D3)x Na A2 C60: ammonia specific effects and superconductivity","Journal of the American Chemical Society","2002","124","","10146","10156","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124509","10.9292","","10.9292","","10.9292","","90","","90","","90","","1305.46","","","","","","","","","","","","","2","I m -3","-I 2 2 3","204","","Eu6 C60","","- C60 Eu6 -","- C60 Eu6 -","- C120 Eu12 -","2","0.0416667","","Margiolaki, I.; Margadonna, S.; Prassides, K.; Suematsu, H.; Hansen, T.; Ishii, K.","Magnetic structure of the europium fulleride ferromagnet Eu6 C60","Journal of the American Chemical Society","2002","124","","11288","11289","","","","","","","","","","","","","","","","","","","","","","has coordinates","157297","2020-10-21","18:00:00",""
"4124511","11.498","","3.545","","4.345","","90","","90","","90","","177.104","","","","","","","","","","","","","2","P m m n :1","P 2 2ab -1ab","59","","V2 O5","","- O5 V2 -","- O5 V2 -","- O10 V4 -","2","0.25","","Petkov, V.; Trikalitis, P.N.; Bozin, E.S.; Billinge, S.J.L.; Vogt, T.; Kanatzidis, M.G.","Structure of V2 O5 * n(H2 O) xerogel solved by the atomic pair distribution function technique","Journal of the American Chemical Society","2002","124","","10157","10162","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4124512","11.722","","3.57","","11.52","","90","","88.65","","90","","481.95","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","V2 O5 (H2 O)","","- H2 O6 V2 -","- O6 V2 -","- O24 V8 -","4","0.5","","Petkov, V.; Trikalitis, P.N.; Bozin, E.S.; Kanatzidis, M.G.; Billinge, S.J.L.; Vogt, T.","Structure of V2 O5 * n(H2 O) xerogel solved by the atomic pair distribution function technique","Journal of the American Chemical Society","2002","124","","10157","10162","","","","","","","","","","","","","","","","","","","","","","has coordinates","157568","2020-10-21","18:00:00",""
"4124513","17.154","","5.6891","","9.8627","","90","","125","","90","","788.441","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Sr3 Ca (Ru2 O9)","","- Ca O9 Ru2 Sr3 -","- Ca O9 Ru2 Sr3 -","- Ca4 O36 Ru8 Sr12 -","4","1","","Rijssenbeek, J.T.; Malo, S.; Caignaert, V.; Poeppelmeier, K.R.","Site and oxidation-state specificity yielding dimensional control in perovskite ruthenates","Journal of the American Chemical Society","2002","124","","2090","2091","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124788","18.2124","","18.2124","","45.752","","90","","90","","120","","13142.4","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","Rb Na ((V O) (Si4 O10)) (H2 O)2.37","","- H4.74 Na O13.37 Rb Si4 V -","- Na O13.37 Rb1.00067 Si4 V -","- Na36 O481.32 Rb36.024 Si144 V36 -","36","1","","Wang, X.-Q.; Liu, L.-M.; Jacobson, A.J.","Open-framework and microporous vanadium silicates","Journal of the American Chemical Society","2002","124","","7812","7820","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124796","14.63","","14.63","","18.377","","90","","90","","120","","3406.39","","","","","","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","((Ir (C O)6) (Sb F6)3) (H F)4","","- C6 H4 F22 Ir O6 Sb3 -","- C6 H3.99 F22 Ir O6 Sb3 -","- C36 H23.94 F132 Ir6 O36 Sb18 -","6","0.333333","","von Ahsen, B.; Berkei, M.; Henkel, G.; Willner, H.; Aubke, F.","The synthesis, vibrational spectra and molecular structure of (Ir (C O)6) (Sb F6)3 * 4(H F) - the first structurally characterized salt with a tripositive, homoleptic metal carbonyl cation and the first example of a tetrahedral hydrogen-bonded (H F)4 cluster","Journal of the American Chemical Society","2002","124","","8371","8379","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"5000342","36.774","0.003","14.9295","0.0012","27.037","0.002","90","","121.884","0.004","90","","12604.3","1.9","105","","105","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C105 H102 Cl18 Mn12 N6 O30 -","- C105 H102 Cl18 Mn12 N6 O30 -","- C420 H408 Cl72 Mn48 N24 O120 -","4","0.5","","Colette Boskovic; Euan K. Brechin; William E. Streib; Kirsten Folting; John C. Bollinger; David N. Hendrickson; George Christou","Single-Molecule Magnets: A New Family of Mn12 Clusters of Formula [Mn12O8X4(O2CPh)8L6]","Journal of the American Chemical Society","2002","124","","3725","3736","10.1021/ja012403k","","","0.71069","MoKα","","","0.0353","","","","0.0379","","","","","","0.8413","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000356","14.2602","0.0012","14.8241","0.0012","15.7931","0.0014","94.558","0.002","92.773","0.002","114.916","0.002","3005.9","0.7","113","","113","","","","","","","","","6","P -1","-P 1","2","","","","- C104 H104 Cl12 Mn12 N6 O32 -","- C104 H104 Cl12 Mn12 N6 O32 -","- C104 H104 Cl12 Mn12 N6 O32 -","1","0.5","","Colette Boskovic; Euan K. Brechin; William E. Streib; Kirsten Folting; John C. Bollinger; David N. Hendrickson; George Christou","Single-Molecule Magnets: A New Family of Mn12 Clusters of Formula [Mn12O8X4(O2CPh)8L6]","Journal of the American Chemical Society","2002","124","","3725","3736","10.1021/ja012403k","","","0.71073","MoKα","","","0.0623","","","","0.0698","","","","","","1.5743","","","","has coordinates,has disorder","277867","2022-09-15","08:51:11",""
"5000357","41.153","0.0006","41.153","0.0006","14.3127","0.0003","90","","90","","90","","24239.5","0.7","112","","112","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C107.4 H110.8 Br4 Cl2.8 Mn12 N6 O32 -","- C109.884 H90.768 Br4 Cl2.768 Mn12 N6 O30 -","- C879.072 H726.144 Br32 Cl22.144 Mn96 N48 O240 -","8","0.5","","Colette Boskovic; Euan K. Brechin; William E. Streib; Kirsten Folting; John C. Bollinger; David N. Hendrickson; George Christou","Single-Molecule Magnets: A New Family of Mn12 Clusters of Formula [Mn12O8X4(O2CPh)8L6]","Journal of the American Chemical Society","2002","124","","3725","3736","10.1021/ja012403k","","","0.71073","MoKα","","0.0786","0.051","","","0.1286","0.1353","","","","","","1.294","","","","has coordinates","176451","2020-10-21","18:00:00",""