# Search results of SQL query from the Crystallography Open Database # Date and time performed: 2024-11-01T00:33:15+01:00 # Query: # SELECT data.* # FROM # data JOIN jaltnames # ON altname = journal # WHERE # (status is null or status != 'retracted') and # (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Journal of the American Chemical Society') AND volume = 132 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 "4101620","15.3624","0.0007","16.4958","0.0007","18.56","0.0008","90","","90","","90","","4703.4","0.4","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C39 H76 B N6 O Si2 Y -","- C39 H76 B N6 O Si2 Y -","- C156 H304 B4 N24 O4 Si8 Y4 -","4","1","","Cheng, Jianhua; Ferguson, Michael J.; Takats, Josef","Synthesis and reaction of [(Tp(iPr2))LnH2]3 (Ln = Y, Lu) with CO: trinuclear cluster-bound propenolate en route to selective formation of propene.","Journal of the American Chemical Society","2010","132","1","2","3","10.1021/ja905679k","","","0.71073","MoKα","","0.0484","0.0328","","","0.0629","0.0674","","","","","","0.974","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101621","15.331","0.0013","16.5053","0.0014","18.4712","0.0016","90","","90","","90","","4674","0.7","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C39 H76 B Lu N6 O Si2 -","- C39 H76 B Lu N6 O Si2 -","- C156 H304 B4 Lu4 N24 O4 Si8 -","4","1","","Cheng, Jianhua; Ferguson, Michael J.; Takats, Josef","Synthesis and reaction of [(Tp(iPr2))LnH2]3 (Ln = Y, Lu) with CO: trinuclear cluster-bound propenolate en route to selective formation of propene.","Journal of the American Chemical Society","2010","132","1","2","3","10.1021/ja905679k","","","0.71073","MoKα","","0.0164","0.0155","","","0.0386","0.0389","","","","","","1.035","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101622","17.824","0.0011","18.0259","0.0011","31.3594","0.0019","90","","90","","90","","10075.6","1.1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C87 H158 B3 N18 Y3 -","- C81 H144 B3 N18 Y3 -","- C324 H576 B12 N72 Y12 -","4","1","","Cheng, Jianhua; Ferguson, Michael J.; Takats, Josef","Synthesis and reaction of [(Tp(iPr2))LnH2]3 (Ln = Y, Lu) with CO: trinuclear cluster-bound propenolate en route to selective formation of propene.","Journal of the American Chemical Society","2010","132","1","2","3","10.1021/ja905679k","","","0.71073","MoKα","","0.0413","0.0317","","","0.0698","0.0721","","","","","","0.984","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101623","17.8179","0.0009","17.9008","0.0009","31.1982","0.0015","90","","90","","90","","9950.8","0.9","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C87 H158 B3 Lu3 N18 -","- C81 H144 B3 Lu3 N18 -","- C324 H576 B12 Lu12 N72 -","4","1","","Cheng, Jianhua; Ferguson, Michael J.; Takats, Josef","Synthesis and reaction of [(Tp(iPr2))LnH2]3 (Ln = Y, Lu) with CO: trinuclear cluster-bound propenolate en route to selective formation of propene.","Journal of the American Chemical Society","2010","132","1","2","3","10.1021/ja905679k","","","0.71073","MoKα","","0.0204","0.0186","","","0.0432","0.0438","","","","","","1.037","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101624","17.0572","0.0008","19.6657","0.0009","20.5279","0.0009","97.1478","0.0006","106.822","0.0006","109.729","0.0006","6012.9","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H180 B3 N18 O5 Si4 Y3 -","- C96 H180 B3 N18 O5 Si4 Y3 -","- C192 H360 B6 N36 O10 Si8 Y6 -","2","1","","Cheng, Jianhua; Ferguson, Michael J.; Takats, Josef","Synthesis and reaction of [(Tp(iPr2))LnH2]3 (Ln = Y, Lu) with CO: trinuclear cluster-bound propenolate en route to selective formation of propene.","Journal of the American Chemical Society","2010","132","1","2","3","10.1021/ja905679k","","","0.71073","MoKα","","0.0721","0.0469","","","0.1214","0.1365","","","","","","1.029","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101625","8.6884","0.0002","12.1203","0.0003","11.8457","0.0002","90","","114.301","0.001","90","","1136.9","0.04","173","2","173","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 O3 -","- C14 H18 O3 -","- C56 H72 O12 -","4","1","","Penkett, Clive S.; Woolford, Jason A.; Day, Iain J.; Coles, Martyn P.","The double [3 + 2] photocycloaddition reaction.","Journal of the American Chemical Society","2010","132","1","4","5","10.1021/ja906163s","","x-ray","0.71073","MoKα","","0.0421","0.0388","","","0.0997","0.1022","","","","","","1.05","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101626","11.6012","0.0003","11.6012","0.0003","11.6012","0.0003","90","","90","","90","","1561.38","0.07","105","2","100","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","tetramethylammonium copper(I) zinc cyanide","tetramethylammonium copper(I) zinc cyanide","","- C8 H12 Cu N5 Zn -","- C8 H11.9997 Cu N5 Zn -","- C32 H47.9988 Cu4 N20 Zn4 -","4","0.333333","","Phillips, Anthony E.; Halder, Gregory J.; Chapman, Karena W.; Goodwin, Andrew L.; Kepert, Cameron J.","Zero thermal expansion in a flexible, stable framework: tetramethylammonium copper(I) zinc(II) cyanide.","Journal of the American Chemical Society","2010","132","1","10","11","10.1021/ja906895j","","","0.71073","MoKα","","0.0235","0.0222","","","0.0525","0.0533","","","","","","1.235","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101627","11.6247","0.0007","11.6247","0.0007","11.6247","0.0007","90","","90","","90","","1570.89","0.16","150","2","150","2","","","","","","","","5","F -4 3 m","F -4 2 3","216","tetramethylammonium copper(I) zinc cyanide","tetramethylammonium copper(I) zinc cyanide","","- C8 H12 Cu N5 Zn -","- C8 H23.9976 Cu N5 Zn -","- C32 H95.9904 Cu4 N20 Zn4 -","4","0.0416667","","Phillips, Anthony E.; Halder, Gregory J.; Chapman, Karena W.; Goodwin, Andrew L.; Kepert, Cameron J.","Zero thermal expansion in a flexible, stable framework: tetramethylammonium copper(I) zinc(II) cyanide.","Journal of the American Chemical Society","2010","132","1","10","11","10.1021/ja906895j","","","0.71073","MoKα","","0.0246","0.019","","","0.0479","0.0532","","","","","","1.097","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101628","11.6269","0.0009","11.6269","0.0009","11.6269","0.0009","90","","90","","90","","1571.8","0.2","231","2","225","2","","","","","","","","5","F -4 3 m","F -4 2 3","216","tetramethylammonium copper(I) zinc cyanide","tetramethylammonium copper(I) zinc cyanide","","- C8 H12 Cu N5 Zn -","- C8 H23.9976 Cu N5 Zn -","- C32 H95.9904 Cu4 N20 Zn4 -","4","0.0416667","","Phillips, Anthony E.; Halder, Gregory J.; Chapman, Karena W.; Goodwin, Andrew L.; Kepert, Cameron J.","Zero thermal expansion in a flexible, stable framework: tetramethylammonium copper(I) zinc(II) cyanide.","Journal of the American Chemical Society","2010","132","1","10","11","10.1021/ja906895j","","","0.71073","MoKα","","0.0221","0.0164","","","0.0429","0.049","","","","","","1.168","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101629","11.6282","0.0008","11.6282","0.0008","11.6282","0.0008","90","","90","","90","","1572.31","0.19","300","2","300","2","","","","","","","","5","F -4 3 m","F -4 2 3","216","tetramethylammonium copper(I) zinc cyanide","tetramethylammonium copper(I) zinc cyanide","","- C8 H12 Cu N5 Zn -","- C8 H23.9976 Cu N5 Zn -","- C32 H95.9904 Cu4 N20 Zn4 -","4","0.0416667","","Phillips, Anthony E.; Halder, Gregory J.; Chapman, Karena W.; Goodwin, Andrew L.; Kepert, Cameron J.","Zero thermal expansion in a flexible, stable framework: tetramethylammonium copper(I) zinc(II) cyanide.","Journal of the American Chemical Society","2010","132","1","10","11","10.1021/ja906895j","","","0.71073","MoKα","","0.0246","0.0184","","","0.0453","0.0502","","","","","","1.061","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101630","11.6312","0.0006","11.6312","0.0006","11.6312","0.0006","90","","90","","90","","1573.52","0.14","375","2","375","2","","","","","","","","5","F -4 3 m","F -4 2 3","216","tetramethylammonium copper(I) zinc cyanide","tetramethylammonium copper(I) zinc cyanide","","- C8 H12 Cu N5 Zn -","- C8 H23.9976 Cu N5 Zn -","- C32 H95.9904 Cu4 N20 Zn4 -","4","0.0416667","","Phillips, Anthony E.; Halder, Gregory J.; Chapman, Karena W.; Goodwin, Andrew L.; Kepert, Cameron J.","Zero thermal expansion in a flexible, stable framework: tetramethylammonium copper(I) zinc(II) cyanide.","Journal of the American Chemical Society","2010","132","1","10","11","10.1021/ja906895j","","","0.71073","MoKα","","0.0283","0.0208","","","0.0509","0.0561","","","","","","1.088","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101631","18.286","0.003","18.286","0.003","49.079","0.01","90","","90","","120","","14212","4","293","2","293","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C62 H135 Fe0.5 Mo9 N5.5 O30 -","- C62 H135 Fe0.5 Mo9 N5.5 O30 -","- C372 H810 Fe3 Mo54 N33 O180 -","6","1","","Zhang, Jin; Hao, Jian; Wei, Yongge; Xiao, Fengping; Yin, Panchao; Wang, Longsheng","Nanoscale chiral rod-like molecular triads assembled from achiral polyoxometalates.","Journal of the American Chemical Society","2010","132","1","14","15","10.1021/ja907535g","","","0.71073","MoKα","","0.0761","0.0644","","","0.1602","0.1689","","","","","","1.085","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101632","18.174","0.003","18.174","0.003","49.125","0.01","90","","90","","120","","14052","4","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C62 H135 Mn0.5 Mo9 N5.5 O30 -","- C62 H135 Mn0.5 Mo9 N5.5 O30 -","- C372 H810 Mn3 Mo54 N33 O180 -","6","1","","Zhang, Jin; Hao, Jian; Wei, Yongge; Xiao, Fengping; Yin, Panchao; Wang, Longsheng","Nanoscale chiral rod-like molecular triads assembled from achiral polyoxometalates.","Journal of the American Chemical Society","2010","132","1","14","15","10.1021/ja907535g","","","0.71073","MoKα","","0.0845","0.0568","","","0.1275","0.1434","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101633","20.1518","0.0009","20.1518","0.0009","7.9277","0.0009","90","","90","","120","","2788.1","0.4","293","2","293","2","","","","","","","","6","P 63","P 6c","173","","","","- C36 H30 I9 N9 O6 Pb3 -","- C36 H30 I9 N9 O6 Pb3 -","- C72 H60 I18 N18 O12 Pb6 -","2","0.333333","","Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin","Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture.","Journal of the American Chemical Society","2010","132","1","18","19","10.1021/ja907562m","","","0.71073","MoKα","","0.0389","0.025","","","0.0425","0.0455","","","","","","1.007","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101634","20.028","0.0012","20.028","0.0012","8.0181","0.0009","90","","90","","120","","2785.3","0.4","293","2","293","2","","","","","","","","6","P 63","P 6c","173","","","","- C36 H30 Br3 I9 N6 Pb3 -","- C36 H30 Br3 I9 N6 Pb3 -","- C72 H60 Br6 I18 N12 Pb6 -","2","0.333333","","Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin","Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture.","Journal of the American Chemical Society","2010","132","1","18","19","10.1021/ja907562m","","","0.71073","MoKα","","0.0997","0.075","","","0.1893","0.1987","","","","","","1.037","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101635","20.025","0.003","20.025","0.003","7.975","0.0016","90","","90","","120","","2769.5","0.8","293","2","293","2","","","","","","","","6","P 63","P 6c","173","","","","- C12 H10 Cl I3 N2 Pb -","- C12 H10 Cl I3 N2 Pb -","- C72 H60 Cl6 I18 N12 Pb6 -","6","1","","Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin","Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture.","Journal of the American Chemical Society","2010","132","1","18","19","10.1021/ja907562m","","","0.71073","MoKα","","0.0974","0.0548","","","0.1128","0.1336","","","","","","1.072","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101636","19.9426","0.0006","19.9426","0.0006","7.8618","0.0003","90","","90","","120","","2707.8","0.15","293","2","293","2","","","","","","","","6","P 63","P 6c","173","","","","- C36 H30 F3 I9 N6 Pb3 -","- C36 H30 F3 I9 N6 Pb3 -","- C72 H60 F6 I18 N12 Pb6 -","2","0.333333","","Zhao, Hai-Rong; Li, Dong-Ping; Ren, Xiao-Ming; Song, You; Jin, Wan-Qin","Larger spontaneous polarization ferroelectric inorganic-organic hybrids: [PbI3](infinity) chains directed organic cations aggregation to Kagomé-shaped tubular architecture.","Journal of the American Chemical Society","2010","132","1","18","19","10.1021/ja907562m","","","0.71073","MoKα","","0.0532","0.0304","","","0.057","0.0593","","","","","","0.888","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101637","6.6869","0.0012","13.862","0.003","13.166","0.002","90","","97.899","0.004","90","","1208.8","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C60 H52 N4 O8 -","4","2","","Zhang, Chun; Jiao, Ning","Dioxygen activation under ambient conditions: Cu-catalyzed oxidative amidation-diketonization of terminal alkynes leading to alpha-ketoamides.","Journal of the American Chemical Society","2010","132","1","28","29","10.1021/ja908911n","","","0.71073","MoKα","","0.0489","0.0427","","","0.1086","0.113","","","","","","0.992","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101638","35.441","0.009","14.902","0.004","30.925","0.011","90","","102.795","0.011","90","","15927","8","80","2","80","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56.57 H58.44 I6 N12 O0.56 Zn3 -","- C55.662 H56.592 I6 N12 O0.561 Zn3 -","- C445.296 H452.736 I48 N96 O4.488 Zn24 -","8","1","","Ohara, Kazuaki; Kawano, Masaki; Inokuma, Yasuhide; Fujita, Makoto","A porous coordination network catalyzes an olefin isomerization reaction in the pore.","Journal of the American Chemical Society","2010","132","1","30","31","10.1021/ja908794n","","","0.6889","Synchrotron","","0.1388","0.0684","","","0.1728","0.2215","","","","","","1.053","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101639","15.4355","0.0018","15.4355","0.0018","22.775","0.005","90","","90","","90","","5426.2","1.5","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","bio-MOF-11","","","- C7 H7 Co N5 O2 -","- C7 H7 Co N5 O2 -","- C112 H112 Co16 N80 O32 -","16","1","","An, Jihyun; Geib, Steven J; Rosi, Nathaniel L","High and selective CO2 uptake in a cobalt adeninate metal-organic framework exhibiting pyrimidine- and amino-decorated pores.","Journal of the American Chemical Society","2010","132","1","38","39","10.1021/ja909169x","","","0.71073","MoKα","","0.1371","0.1047","","","0.2834","0.2974","","","","","","2.388","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101640","22.3571","0.0005","23.4069","0.0005","21.3354","0.0004","90","","90","","90","","11165","0.4","120","","120","","","","","","","","","7","P n 21 a","P -2ac -2n","33","","","","- C53 H93 Co N5 O2 P3 Zr -","- C53 H93 Co N5 O2 P3 Zr -","- C424 H744 Co8 N40 O16 P24 Zr8 -","8","2","","Greenwood, Bennett P.; Rowe, Gerard T.; Chen, Chun-Hsing; Foxman, Bruce M.; Thomas, Christine M.","Metal-metal multiple bonds in early/late heterobimetallics support unusual trigonal monopyramidal geometries at both Zr and Co.","Journal of the American Chemical Society","2010","132","1","44","45","10.1021/ja909310t","","","0.71073","MoKα","","0.0726","0.0423","","0.1114","0.088","0.1114","","","","","","0.9614","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101641","18.2757","0.0006","18.2757","0.0006","18.1771","0.0006","90","","90","","120","","5257.8","0.3","120","","120","","","","","","","","","6","P 3 c 1","P 3 -2""c","158","","","","- C27 H63 Co N5 P3 Zr -","- C27 H63 Co N5 P3 Zr -","- C162 H378 Co6 N30 P18 Zr6 -","6","1","","Greenwood, Bennett P.; Rowe, Gerard T.; Chen, Chun-Hsing; Foxman, Bruce M.; Thomas, Christine M.","Metal-metal multiple bonds in early/late heterobimetallics support unusual trigonal monopyramidal geometries at both Zr and Co.","Journal of the American Chemical Society","2010","132","1","44","45","10.1021/ja909310t","","","0.71073","MoKα","","0.0771","0.0402","","0.0915","0.0829","0.0915","","","","","","1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101642","11.9572","0.0005","21.3291","0.0008","40.224","0.0015","90","","92.592","0.002","90","","10248.1","0.7","120","","120","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C100 H171 Co2 N6 O2.5 P6 Zr2 -","- C100 H171 Co2 N6 O2.5 P6 Zr2 -","- C400 H684 Co8 N24 O10 P24 Zr8 -","4","1","","Greenwood, Bennett P.; Rowe, Gerard T.; Chen, Chun-Hsing; Foxman, Bruce M.; Thomas, Christine M.","Metal-metal multiple bonds in early/late heterobimetallics support unusual trigonal monopyramidal geometries at both Zr and Co.","Journal of the American Chemical Society","2010","132","1","44","45","10.1021/ja909310t","","","0.71073","MoKα","","0.0777","0.0424","","0.0853","0.0788","0.0853","","","","","","1.0036","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101643","30.221","0.011","30.221","0.011","23.645","0.012","90","","90","","90","","21595","16","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C35 H43 Li N O6 P Pd S2 -","- C35 H43 Li N O6 P Pd S2 -","- C560 H688 Li16 N16 O96 P16 Pd16 S32 -","16","1","","Shen, Zhongliang; Jordan, Richard F.","Self-assembled tetranuclear palladium catalysts that produce high molecular weight linear polyethylene.","Journal of the American Chemical Society","2010","132","1","52","53","10.1021/ja909473y","","","0.71073","MoKα","","0.0955","0.0603","","","0.1607","0.1708","","","","","","0.871","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101644","10.704","0.005","34.391","0.015","14.836","0.006","90","","90.933","0.007","90","","5461","4","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C50 H72.5 Cl1.5 Li N3 O10 P Pd S2 -","- C49.78 H72.56 Cl1.56 Li N3 O10 P Pd S2 -","- C199.12 H290.24 Cl6.24 Li4 N12 O40 P4 Pd4 S8 -","4","1","","Shen, Zhongliang; Jordan, Richard F.","Self-assembled tetranuclear palladium catalysts that produce high molecular weight linear polyethylene.","Journal of the American Chemical Society","2010","132","1","52","53","10.1021/ja909473y","","","0.71073","MoKα","","0.2595","0.0868","","","0.178","0.2418","","","","","","0.918","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101645","9.764","0.005","14.101","0.007","18.639","0.007","90","","110.23","0.02","90","","2408","2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 Cl4 O12 P2 Pd2 S4 -","- C42 H38 Cl4 O12 P2 Pd2 S4 -","- C84 H76 Cl8 O24 P4 Pd4 S8 -","2","0.5","","Shen, Zhongliang; Jordan, Richard F.","Self-assembled tetranuclear palladium catalysts that produce high molecular weight linear polyethylene.","Journal of the American Chemical Society","2010","132","1","52","53","10.1021/ja909473y","","","0.71073","MoKα","","0.0682","0.0463","","","0.0903","0.0962","","","","","","0.997","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101646","12.3776","0.0003","14.4722","0.0004","19.919","0.0006","90","","92.9745","0.001","90","","3563.31","0.17","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H35 N Ni O P2 -","- C44 H35 N Ni O P2 -","- C176 H140 N4 Ni4 O4 P8 -","4","1","","Yamauchi, Motoshi; Morimoto, Masao; Miura, Tomoya; Murakami, Masahiro","Enantioselective synthesis of 3,4-dihydroisoquinolin-1(2H)-ones by nickel-catalyzed denitrogenative annulation of 1,2,3-benzotriazin-4(3H)-ones with allenes.","Journal of the American Chemical Society","2010","132","1","54","55","10.1021/ja909603j","","","0.71075","MoKα","","0.0343","0.0295","","","0.0784","0.0814","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00","" "4101647","11.4536","0.0019","14.49","0.002","16.233","0.003","97.87","0.002","98.337","0.002","106.382","0.002","2512.1","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H73 Fe N4 O Sc Si2 -","- C52 H73 Fe N4 O Sc Si2 -","- C104 H146 Fe2 N8 O2 Sc2 Si4 -","2","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.0948","0.0581","","","0.1341","0.153","","","","","","1.024","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101648","14.3694","0.0013","16.5282","0.0014","19.6525","0.0017","90","","90","","90","","4667.5","0.7","125","2","125","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C49 H63 Fe N4 Si2 Y -","- C49 H63 Fe N4 Si2 Y -","- C196 H252 Fe4 N16 Si8 Y4 -","4","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.085","0.0469","","","0.0859","0.0979","","","","","","0.961","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101649","13.908","0.002","13.942","0.005","14.914","0.003","95.659","0.002","116.825","0.002","98.466","0.002","2507.6","1.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H64 Fe Lu N5 Si2 -","- C52 H64 Fe Lu N5 Si2 -","- C104 H128 Fe2 Lu2 N10 Si4 -","2","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.042","0.0316","","","0.0658","0.0694","","","","","","1.004","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101650","24.396","0.01","11.83","0.005","16.723","0.007","90","","90","","90","","4826","3","101","2","101","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C50 H67 Fe Lu N4 O Si2 -","- C50 H67 Fe Lu N4 O Si2 -","- C200 H268 Fe4 Lu4 N16 O4 Si8 -","4","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.086","0.0454","","","0.068","0.0789","","","","","","0.978","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101651","10.065","0.003","29.126","0.007","14.029","0.004","90","","100.204","0.003","90","","4047.6","1.9","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H62 Fe N3 O2 Si2 Y -","- C39 H62 Fe N3 O2 Si2 Y -","- C156 H248 Fe4 N12 O8 Si8 Y4 -","4","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.1139","0.0521","","","0.0911","0.1082","","","","","","0.983","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101652","45.634","0.013","9.376","0.003","20.379","0.006","90","","99.243","0.003","90","","8606","4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H62 Fe La N3 O Si2 -","- C44 H62 Fe La N3 O Si2 -","- C352 H496 Fe8 La8 N24 O8 Si16 -","8","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.1001","0.0497","","","0.0766","0.0907","","","","","","0.991","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101653","19.018","0.003","17.284","0.003","11.281","0.002","90","","90","","90","","3708.1","1.1","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C35 H57 Fe La N2 O Si2 -","- C35 H57 Fe La N2 O Si2 -","- C140 H228 Fe4 La4 N8 O4 Si8 -","4","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.0565","0.0364","","","0.0601","0.0657","","","","","","1.006","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101654","39.536","0.004","47.303","0.004","11.3457","0.001","90","","90","","90","","21218","3","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C57 H70 Fe N5 Si2 Y -","- C57 H70 Fe N5 Si2 Y -","- C912 H1120 Fe16 N80 Si32 Y16 -","16","1","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.0961","0.0579","","","0.1185","0.1336","","","","","","1.001","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101655","27.282","0.003","13.0297","0.0015","14.8077","0.0017","90","","99.407","0.001","90","","5193","1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H54 Fe N5 Si2 Y -","- C37 H54 Fe N5 Si2 Y -","- C148 H216 Fe4 N20 Si8 Y4 -","4","0.5","","Miller, Kevin L.; Williams, Bryan N.; Benitez, Diego; Carver, Colin T.; Ogilby, Kevin R.; Tkatchouk, Ekaterina; Goddard, 3rd, William A.; Diaconescu, Paula L.","Dearomatization reactions of N-heterocycles mediated by group 3 complexes.","Journal of the American Chemical Society","2010","132","1","342","355","10.1021/ja908489p","","","0.71073","MoKα","","0.0988","0.0627","","","0.2125","0.2318","","","","","","1.196","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101656","7.5973","0.0006","12.6018","0.001","34.196","0.002","90","","90","","90","","3273.9","0.4","163","2","163","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C31 H37 Br Cl2 O9 -","- C31 H37 Br Cl2 O9 -","- C124 H148 Br4 Cl8 O36 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71074","MoKα","","0.1841","0.1098","","","0.2106","0.2289","","","","","","1.464","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101657","9.0904","0.0003","10.349","0.0003","30.9898","0.0014","90","","90","","90","","2915.41","0.18","295","2","295","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C14 H16 Cl2 O3 -","- C14 H16 Cl2 O3 -","- C112 H128 Cl16 O24 -","8","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71069","MoKα","","0.0903","0.0472","","","0.1096","0.135","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101658","7","0.0007","17.7274","0.0016","12.3192","0.0014","90","","92.187","0.004","90","","1527.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 Cl2 O3 -","- C15 H18 Cl2 O3 -","- C60 H72 Cl8 O12 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71069","MoKα","","0.0949","0.0646","","","0.1647","0.1839","","","","","","1.047","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101659","7.2623","0.0004","8.6146","0.0004","12.9699","0.0009","105.49","0.002","88.947","0.002","93.441","0.004","780.54","0.08","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H18 Cl2 O3 -","- C15 H18 Cl2 O3 -","- C30 H36 Cl4 O6 -","2","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71069","MoKα","","0.0912","0.0666","","","0.2015","0.2377","","","","","","0.95","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101660","7.1261","0.0003","10.5633","0.0005","12.464","0.0009","90","","90","","90","","938.23","0.09","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H14 O3 -","- C11 H14 O3 -","- C44 H56 O12 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","1.5418","CuKα","","0.0342","0.0315","","","0.0769","0.0811","","","","","","0.971","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101661","11.252","0.003","14.425","0.003","14.949","0.004","68.148","0.003","70.938","0.004","72.309","0.004","2082.1","0.9","233","2","233","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H27 Br O5 -","- C23 H27 Br O5 -","- C92 H108 Br4 O20 -","4","2","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71069","MoKα","","0.0579","0.0416","","","0.0923","0.1002","","","","","","1.001","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101662","22.958","0.002","7.2742","0.0007","18.915","0.002","90","0.005","90","0.005","90","0.005","3158.8","0.5","153","2","153","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H17 Br Cl2 O3 -","- C15 H17 Br Cl2 O3 -","- C120 H136 Br8 Cl16 O24 -","8","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71069","MoKα","","0.1162","0.0599","","","0.1123","0.1319","","","","","","1.063","","","","has coordinates","178762","2020-10-21","18:00:00","" "4101663","6.6611","0.0008","10.6173","0.001","24.981","0.002","90","","90","","90","","1766.7","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 Br F3 O6 S -","- C15 H18 Br F3 O6 S -","- C60 H72 Br4 F12 O24 S4 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.71069","MoKα","","0.0307","0.0267","","","0.0547","0.0561","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101664","5.7276","0.0002","10.5267","0.0006","22.9283","0.0012","90","","90","","90","","1382.41","0.12","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 Br O4 -","- C14 H19 Br O4 -","- C56 H76 Br4 O16 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.7107","MoKα","","0.0548","0.0412","","","0.0899","0.0975","","","","","","1.05","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101665","5.7276","0.0002","10.5267","0.0006","22.9283","0.0012","90","","90","","90","","1382.41","0.12","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 Br O4 -","- C13.3 H17.6 Br0.65 O4 -","- C53.2 H70.4 Br2.6 O16 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.7107","MoKα","","0.0548","0.0412","","","0.0899","0.0975","","","","","","1.05","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101666","5.7276","0.0002","10.5267","0.0006","22.9283","0.0012","90","","90","","90","","1382.41","0.12","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 Br O4 -","- C12.7 H16.4 Br0.35 O4 -","- C50.8 H65.6 Br1.4 O16 -","4","1","","Gao, Shuanhu; Wang, Qiaoling; Huang, Lily Jun-Shen; Lum, Lawrence; Chen, Chuo","Chemical and biological studies of nakiterpiosin and nakiterpiosinone.","Journal of the American Chemical Society","2010","132","1","371","383","10.1021/ja908626k","","","0.7107","MoKα","","0.0548","0.0412","","","0.0899","0.0975","","","","","","1.05","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00","" "4101711","6.3122","0.0007","12.153","0.001","28.515","0.003","90","","90","","90","","2187.4","0.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H28 O4 -","- C26 H28 O4 -","- C104 H112 O16 -","4","1","","Kim, Hun Young; Salvi, Luca; Carroll, Patrick J.; Walsh, Patrick J.","One-pot catalytic enantio- and diastereoselective syntheses of anti-, syn-cis-disubstituted, and syn-vinyl cyclopropyl alcohols.","Journal of the American Chemical Society","2010","132","1","402","412","10.1021/ja907781t","","","","","","","","","","","","","","","","","","","","","has coordinates","288250","2023-12-12","13:26:53","" "4101769","28.302","0.0004","18.3435","0.0002","18.0349","0.0002","90","","106.193","0.001","90","","8991.51","0.19","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C93 H124 B2 Cl6 Fe2 N8 S2 -","- C93 H124 B2 Cl6 Fe2 N8 S2 -","- C372 H496 B8 Cl24 Fe8 N32 S8 -","4","1","","Frances Namuswe; Takahiro Hayashi; Yunbo Jiang; Gary D. Kasper; Amy A. Narducci Sarjeant; Pierre Moënne-Loccoz; David P. Goldberg","Influence of the Nitrogen Donors on Nonheme Iron Models of Superoxide Reductase: High-Spin FeIII-OOR Complexes","Journal of the American Chemical Society","2010","132","","157","167","10.1021/ja904818z","","","0.71073","MoKα","","0.085","0.061","","","0.1353","0.1449","","","","","","1.047","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00","" "4101770","18.431","0.005","21.805","0.006","12.751","0.004","90","","102.806","0.004","90","","4997","2","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H76 Cl2 N2 O6 Pd -","- C51 H76 Cl2 N2 O6 Pd -","- C204 H304 Cl8 N8 O24 Pd4 -","4","1","","Stephen M. Goldup; David A. Leigh; Paul R. McGonigal; Vicki E. Ronaldson; Alexandra M. Z. Slawin","Two Axles Threaded Using a Single Template Site: Active Metal Template Macrobicyclic [3]Rotaxanes","Journal of the American Chemical Society","2010","132","","315","320","10.1021/ja9080716","","","0.71073","MoKα","","0.0928","0.0855","","","0.2288","0.2379","","","","","","1.07","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101771","12.245","0.003","14.106","0.003","15.104","0.003","63.58","0.03","78.33","0.03","66.59","0.03","2143.1","1.1","200","2","200","2","","","","","","","","5","P -1","-P 1","2","[Rh((C6H4)PPh2)(trop2PPh)]","","","- C112 H92 O P4 Rh2 -","- C114.465 H82 P4 Rh2 -","- C114.465 H82 P4 Rh2 -","1","0.5","","Florian F. Puschmann; Hansjörg Grützmacher; Bas de Bruin","Rhodium(0) Metalloradicals in Binuclear C-H Activation","Journal of the American Chemical Society","2010","132","","73","75","10.1021/ja909022p","","","0.7107","MoKα","","0.0493","0.0392","","","0.0814","0.0857","","","","","","0.99","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101772","10.6562","0.0004","9.0426","0.0004","25.5092","0.0011","90","","95.246","0.002","90","","2447.76","0.18","297","2","297","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H64 Br4 F6 P2 Pd2 -","- C38 H64 Br4 F6 P2 Pd2 -","- C76 H128 Br8 F12 P4 Pd4 -","2","0.5","","Brad P. Carrow; John. F. Hartwig","Ligandless, Anionic, Arylpalladium Halide Intermediates in the Heck Reaction","Journal of the American Chemical Society","2010","132","","79","81","10.1021/ja909306f","","","0.71073","MoKα","","0.092","0.0407","","","0.0857","0.104","","","","","","1.013","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4101773","9.527","0.002","19.163","0.004","12.549","0.003","90","","110.754","0.003","90","","2142.4","0.8","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H66 Br4 P2 Pd2 -","- C36 H66 Br4 P2 Pd2 -","- C72 H132 Br8 P4 Pd4 -","2","1","","Brad P. Carrow; John. F. Hartwig","Ligandless, Anionic, Arylpalladium Halide Intermediates in the Heck Reaction","Journal of the American Chemical Society","2010","132","","79","81","10.1021/ja909306f","","","0.71073","MoKα","","0.0553","0.033","","","0.0613","0.0667","","","","","","0.984","","","","has coordinates","176432","2020-10-21","18:00:00","" "4101774","31.4372","0.0006","20.4126","0.0004","20.8384","0.0003","90","","96.0642","0.0019","90","","13297.5","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C65 H99 K N3 O10 U -","- C65 H99 K N3 O10 U -","- C520 H792 K8 N24 O80 U8 -","8","1","","Grégory Nocton; Pawel Horeglad; Valentina Vetere; Jacques Pécaut; Lionel Dubois; Pascale Maldivi; Norman M. Edelstein; Marinella Mazzanti","Synthesis, Structure, and Bonding of Stable Complexes of Pentavalent Uranyl","Journal of the American Chemical Society","2010","132","","495","508","10.1021/ja9037164","","","0.71073","MoKα","","0.0585","0.032","","","0.0695","0.0727","","","","","","0.919","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00","" "4101775","11.85","0.002","13.9279","0.0012","26.375","0.005","82.17","0.01","84.019","0.014","69.999","0.012","4044.6","1.1","150","0.2","150","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C79 H109 Co N7 O4 U -","- C79 H109 Co N7 O4 U -","- C158 H218 Co2 N14 O8 U2 -","2","1","","Grégory Nocton; Pawel Horeglad; Valentina Vetere; Jacques Pécaut; Lionel Dubois; Pascale Maldivi; Norman M. Edelstein; Marinella Mazzanti","Synthesis, Structure, and Bonding of Stable Complexes of Pentavalent Uranyl","Journal of the American Chemical Society","2010","132","","495","508","10.1021/ja9037164","","","0.71073","MoKα","","0.1599","0.0918","","","0.1974","0.2301","","","","","","0.955","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00","" "4101776","17.4608","0.00019","21.55872","0.00018","15.06929","0.00015","90","","112.941","0.0012","90","","5223.9","0.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H78 K N2 O8 U -","- C52 H78 K N2 O8 U -","- C208 H312 K4 N8 O32 U4 -","4","1","","Grégory Nocton; Pawel Horeglad; Valentina Vetere; Jacques Pécaut; Lionel Dubois; Pascale Maldivi; Norman M. Edelstein; Marinella Mazzanti","Synthesis, Structure, and Bonding of Stable Complexes of Pentavalent Uranyl","Journal of the American Chemical Society","2010","132","","495","508","10.1021/ja9037164","","","0.71073","MoKα","","0.0444","0.0257","","","0.0532","0.0551","","","","","","0.882","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00","" "4101777","12.83","0.003","14.283","0.003","16.894","0.005","90.61","0.02","104.71","0.02","116.42","0.01","2654.2","1.2","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H38 Cl3 N6 Na O12 Ru Se4 -","- C48 H38 Cl3 N6 Na O12 Ru Se4 -","- C96 H76 Cl6 N12 Na2 O24 Ru2 Se8 -","2","1","","Alexander Laskavy; Linda J. W. Shimon; Leonid Konstantinovski; Mark A. Iron; Ronny Neumann","Activation of Molecular Oxygen by a Dioxygenase Pathway by a Ruthenium Bis-bipyridine Compound with a Proximal Selenium Site","Journal of the American Chemical Society","2010","132","","517","523","10.1021/ja9047027","","","0.71073","MoKα","","0.0877","0.058","","","0.143","0.1542","","","","","","1.038","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00","" "4101778","21.8438","0.0004","21.8438","0.0004","21.8438","0.0004","99.34","","99.34","","99.34","","9956","0.3","100","2","100","2","","","","","","","","9","R -3 :R","-P 3*","148","","","","- C293 H221 Cl93 F36 N24 O12 P6 Ru6 Se24 -","- C293 H221 Cl93 F36 N24 O12 P6 Ru6 Se24 -","- C293 H221 Cl93 F36 N24 O12 P6 Ru6 Se24 -","1","0.166667","","Alexander Laskavy; Linda J. W. Shimon; Leonid Konstantinovski; Mark A. Iron; Ronny Neumann","Activation of Molecular Oxygen by a Dioxygenase Pathway by a Ruthenium Bis-bipyridine Compound with a Proximal Selenium Site","Journal of the American Chemical Society","2010","132","","517","523","10.1021/ja9047027","","","0.71073","MoKα","","0.1121","0.0591","","","0.1525","0.1984","","","","","","1.049","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4101779","21.3422","0.0003","13.3525","0.0002","19.5085","0.0003","90","","102.279","0.001","90","","5432.19","0.14","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H25 Cl2 N5 O10 Zn -","- C22 H25 Cl2 N5 O10 Zn -","- C176 H200 Cl16 N40 O80 Zn8 -","8","1","","Zhaochao Xu; Kyung-Hwa Baek; Ha Na Kim; Jingnan Cui; Xuhong Qian; David R. Spring; Injae Shin; Juyoung Yoon","Zn2±Triggered Amide Tautomerization Produces a Highly Zn2±Selective, Cell-Permeable, and Ratiometric Fluorescent Sensor","Journal of the American Chemical Society","2010","132","","601","610","10.1021/ja907334j","","","0.71073","MoKα","","0.0621","0.0438","","","0.1009","0.112","","","","","","1.039","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101780","10.5185","0.0004","10.3824","0.0005","31.1766","0.0014","90","","90.055","0.001","90","","3404.7","0.3","243","2","243","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H42 B Hg N7 O S4 -","- C29 H42 B Hg N7 O S4 -","- C116 H168 B4 Hg4 N28 O4 S16 -","4","1","","Jonathan G. Melnick; Kevin Yurkerwich; Gerard Parkin","On the Chalcogenophilicity of Mercury: Evidence for a Strong Hg-Se Bond in [TmBut]HgSePh and Its Relevance to the Toxicity of Mercury","Journal of the American Chemical Society","2010","132","","647","655","10.1021/ja907523x","","","0.71073","MoKα","","0.0434","0.0258","","","0.0626","0.0765","","","","","","1.036","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101781","9.4951","0.0007","32.986","0.003","10.4048","0.0008","90","","110.762","0.001","90","","3047.2","0.4","125","2","125","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H36 B Cl3 Hg N6 S3 -","- C22 H36 B Cl3 Hg N6 S3 -","- C88 H144 B4 Cl12 Hg4 N24 S12 -","4","1","","Jonathan G. Melnick; Kevin Yurkerwich; Gerard Parkin","On the Chalcogenophilicity of Mercury: Evidence for a Strong Hg-Se Bond in [TmBut]HgSePh and Its Relevance to the Toxicity of Mercury","Journal of the American Chemical Society","2010","132","","647","655","10.1021/ja907523x","","","0.71073","MoKα","","0.0711","0.041","","","0.0921","0.1018","","","","","","1.038","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101782","20.755","0.005","32.173","0.008","10.741","0.003","90","","101.385","0.004","90","","7031","3","170","2","170","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H42 B Hg N6 S3 Te -","- C30 H42 B Hg N6 S3 Te -","- C240 H336 B8 Hg8 N48 S24 Te8 -","8","2","","Jonathan G. Melnick; Kevin Yurkerwich; Gerard Parkin","On the Chalcogenophilicity of Mercury: Evidence for a Strong Hg-Se Bond in [TmBut]HgSePh and Its Relevance to the Toxicity of Mercury","Journal of the American Chemical Society","2010","132","","647","655","10.1021/ja907523x","","","0.71073","MoKα","","0.0918","0.0531","","","0.1391","0.1576","","","","","","1.094","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101783","10.4452","0.0005","32.4688","0.0015","10.6341","0.0005","90","","113.759","0.001","90","","3300.8","0.3","243","2","243","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H39 B Hg N6 S3 Se -","- C27 H39 B Hg N6 S3 Se -","- C108 H156 B4 Hg4 N24 S12 Se4 -","4","1","","Jonathan G. Melnick; Kevin Yurkerwich; Gerard Parkin","On the Chalcogenophilicity of Mercury: Evidence for a Strong Hg-Se Bond in [TmBut]HgSePh and Its Relevance to the Toxicity of Mercury","Journal of the American Chemical Society","2010","132","","647","655","10.1021/ja907523x","","","0.71073","MoKα","","0.0427","0.0268","","","0.054","0.0582","","","","","","1.025","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101784","10.235","0.003","32.516","0.009","10.447","0.003","90","","112.271","0.004","90","","3217.4","1.6","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H39 B Hg N6 S4 -","- C27 H39 B Hg N6 S4 -","- C108 H156 B4 Hg4 N24 S16 -","4","1","","Jonathan G. Melnick; Kevin Yurkerwich; Gerard Parkin","On the Chalcogenophilicity of Mercury: Evidence for a Strong Hg-Se Bond in [TmBut]HgSePh and Its Relevance to the Toxicity of Mercury","Journal of the American Chemical Society","2010","132","","647","655","10.1021/ja907523x","","","0.71073","MoKα","","0.1212","0.0489","","","0.0729","0.0882","","","","","","1.02","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101785","57.31","0.02","7.522","0.003","18.203","0.007","90","","98.1","0.006","90","","7769","5","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C19 H22 N O5 Pd S -","- C19 H22 N O5 Pd S -","- C304 H352 N16 O80 Pd16 S16 -","16","4","","Ramesh Giri; Jonathan K. Lam; Jin-Quan Yu","Synthetic Applications of Pd(II)-Catalyzed C-H Carboxylation and Mechanistic Insights: Expedient Routes to Anthranilic Acids, Oxazolinones, and Quinazolinones","Journal of the American Chemical Society","2010","132","","686","693","10.1021/ja9077705","","","0.71073","MoKα","","0.0403","0.0385","","","0.1","0.1016","","","","","","1.05","","","","has coordinates","198632","2020-10-21","18:00:00","" "4101786","10.6326","0.0009","5.7924","0.0005","15.5841","0.0014","90","","107.396","0.006","90","","915.9","0.14","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H23 N O3 -","- C22 H23 N O3 -","- C44 H46 N2 O6 -","2","1","","Yajing Lian; Huw M. L. Davies","Rhodium-Catalyzed [3 + 2] Annulation of Indoles","Journal of the American Chemical Society","2010","132","","440","441","10.1021/ja9078094","","","1.54178","CuKα","","0.0589","0.0313","","","0.0866","0.1062","","","","","","1.085","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101787","10.3908","0.0018","8.4201","0.0016","12.468","0.002","90","","105.207","0.006","90","","1052.6","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H22 Br N O2 -","- C25 H22 Br N O2 -","- C50 H44 Br2 N2 O4 -","2","1","","Yajing Lian; Huw M. L. Davies","Rhodium-Catalyzed [3 + 2] Annulation of Indoles","Journal of the American Chemical Society","2010","132","","440","441","10.1021/ja9078094","","","1.54178","CuKα","","0.0545","0.0422","","","0.1257","0.1616","","","","","","1.148","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101788","8.4016","0.0008","12.9089","0.0014","18.1051","0.0016","90","","90","","90","","1963.6","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H23 N O2 -","- C25 H23 N O2 -","- C100 H92 N4 O8 -","4","1","","Yajing Lian; Huw M. L. Davies","Rhodium-Catalyzed [3 + 2] Annulation of Indoles","Journal of the American Chemical Society","2010","132","","440","441","10.1021/ja9078094","","","1.54178","CuKα","","0.1234","0.0798","","","0.2193","0.2789","","","","","","1.009","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101789","15.453","0.002","16.161","0.002","24.311","0.003","76.646","0.002","86.741","0.002","67.404","0.002","5450.3","1.2","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C136 H115 B4 O18 -","- C136 H115 B4 O18 -","- C272 H230 B8 O36 -","2","1","","Naoki Nishimura; Kenji Yoza; Kenji Kobayashi","Guest-Encapsulation Properties of a Self-Assembled Capsule by Dynamic Boronic Ester Bonds","Journal of the American Chemical Society","2010","132","","777","790","10.1021/ja9084918","","","0.71073","MoKα","","0.1486","0.0867","","","0.2146","0.2622","","","","","","1.034","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00","" "4101790","5.5536","0.0001","8.6287","0.0002","42.4623","0.0007","90","","90","","90","","2034.81","0.07","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H21 Br O5 -","- C23 H21 Br O5 -","- C92 H84 Br4 O20 -","4","1","","Sheng Cui; Shawn D. Walker; Jacqueline C. S. Woo; Christopher J. Borths; Herschel Mukherjee; Maosheng J. Chen; Margaret M. Faul","Practical Asymmetric Conjugate Alkynylation of Meldrum's Acid-Derived Acceptors: Access to Chiral β-Alkynyl Acids","Journal of the American Chemical Society","2010","132","","436","437","10.1021/ja909105s","","x-ray","1.54178","CuKα","","0.0477","0.0408","","","0.0964","0.0996","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101791","12.9099","0.0015","16.726","0.002","17.744","0.002","90","","100.233","0.002","90","","3770.5","0.8","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C32 H49 B2 F4 N6 O2 Os P -","- C32 H49 B2 F4 N6 O2 Os P -","- C128 H196 B8 F16 N24 O8 Os4 P4 -","4","1","","Ruth Castro-Rodrigo; Miguel A. Esteruelas; Ana M. López; Fernando López; José L. Mascareñas; Montserrat Oliván; Enrique Oñate; Lucía Saya; Lara Villarino","Cleavage of Both C(sp3)-C(sp2) Bonds of Alkylidenecyclopropanes: Formation of Ethylene-Osmium-Vinylidene Complexes","Journal of the American Chemical Society","2010","132","","454","455","10.1021/ja909240q","","","0.71073","MoKα","","0.0504","0.0384","","","0.0808","0.0849","","","","","","1.042","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101792","13.194","0.0012","13.2046","0.0012","17.0692","0.0015","92.519","0.002","96.857","0.002","118.83","0.001","2568.9","0.4","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H71 B2 N6 O Os P -","- C56 H71 B2 N6 O Os P -","- C112 H142 B4 N12 O2 Os2 P2 -","2","1","","Ruth Castro-Rodrigo; Miguel A. Esteruelas; Ana M. López; Fernando López; José L. Mascareñas; Montserrat Oliván; Enrique Oñate; Lucía Saya; Lara Villarino","Cleavage of Both C(sp3)-C(sp2) Bonds of Alkylidenecyclopropanes: Formation of Ethylene-Osmium-Vinylidene Complexes","Journal of the American Chemical Society","2010","132","","454","455","10.1021/ja909240q","","","0.71073","MoKα","","0.0416","0.0351","","","0.0742","0.077","","","","","","1.048","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101793","10.832","0.003","16.129","0.005","16.28","0.005","90","","97.185","0.005","90","","2821.9","1.5","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H41 B2 F4 N6 O Os P -","- C23 H41 B2 F4 N6 O Os P -","- C92 H164 B8 F16 N24 O4 Os4 P4 -","4","1","","Ruth Castro-Rodrigo; Miguel A. Esteruelas; Ana M. López; Fernando López; José L. Mascareñas; Montserrat Oliván; Enrique Oñate; Lucía Saya; Lara Villarino","Cleavage of Both C(sp3)-C(sp2) Bonds of Alkylidenecyclopropanes: Formation of Ethylene-Osmium-Vinylidene Complexes","Journal of the American Chemical Society","2010","132","","454","455","10.1021/ja909240q","","","0.71073","MoKα","","0.0517","0.0298","","","0.0485","0.0514","","","","","","0.838","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101794","30.984","0.003","7.2879","0.0006","21.4868","0.0011","90","","104.397","0.005","90","","4699.5","0.7","100","2","100","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","[Au2Ag2(p-C6F4I)4(OCMe2)2] (acet/hex)","","","- C36 H24 Ag2 Au2 F16 I4 O4 -","- C36 H24 Ag2 Au2 F16 I4 O4 -","- C144 H96 Ag8 Au8 F64 I16 O16 -","4","0.5","","Antonio Laguna; Tania Lasanta; José M. López-de-Luzuriaga; Miguel Monge; Panče Naumov; M. Elena Olmos","Combining Aurophilic Interactions and Halogen Bonding To Control the Luminescence from Bimetallic Gold-Silver Clusters","Journal of the American Chemical Society","2010","132","","456","457","10.1021/ja909241m","","x-ray","0.71073","MoKα","","0.1409","0.0678","","","0.1609","0.2026","","","","","","0.979","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101795","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 Laguna; Tania Lasanta; José M. López-de-Luzuriaga; Miguel Monge; Panče Naumov; M. Elena Olmos","Combining Aurophilic Interactions and Halogen Bonding To Control the Luminescence from Bimetallic Gold-Silver Clusters","Journal of the American Chemical Society","2010","132","","456","457","10.1021/ja909241m","","","0.7107","MoKα","","0.0487","0.0339","","","0.08","0.0865","","","","","","1.084","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101796","46.2308","0.0011","14.7634","0.0006","31.4991","0.0011","90","","122.483","0.002","90","","18135.4","1.1","120","2","120","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","TLC134 thf/hx","","","- C34 H20 Ag2 Au2 F16 I4 O3 -","- C34 H20 Ag2 Au2 F16 I4 O3 -","- C544 H320 Ag32 Au32 F256 I64 O48 -","16","2","","Antonio Laguna; Tania Lasanta; José M. López-de-Luzuriaga; Miguel Monge; Panče Naumov; M. Elena Olmos","Combining Aurophilic Interactions and Halogen Bonding To Control the Luminescence from Bimetallic Gold-Silver Clusters","Journal of the American Chemical Society","2010","132","","456","457","10.1021/ja909241m","","x-ray","0.71073","MoKα","","0.1641","0.077","","","0.1591","0.1968","","","","","","1.01","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101797","10.1196","0.0004","10.5757","0.0006","10.6529","0.0006","65.682","0.002","72.493","0.003","84.767","0.003","990.11","0.09","100","2","100","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C32 H16 Ag2 Au2 F16 I4 O2 -","- C32 H16 Ag2 Au2 F16 I4 O2 -","- C32 H16 Ag2 Au2 F16 I4 O2 -","1","0.5","","Antonio Laguna; Tania Lasanta; José M. López-de-Luzuriaga; Miguel Monge; Panče Naumov; M. Elena Olmos","Combining Aurophilic Interactions and Halogen Bonding To Control the Luminescence from Bimetallic Gold-Silver Clusters","Journal of the American Chemical Society","2010","132","","456","457","10.1021/ja909241m","","x-ray","0.71073","MoKα","","0.0346","0.0318","","","0.0783","0.0798","","","","","","1.12","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101798","17.4331","0.0005","15.6926","0.0005","14.7773","0.0004","90","","109.09","0.001","90","","3820.3","0.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H6 Ag2 Au2 F16 I4 N2 -","- C28 H6 Ag2 Au2 F16 I4 N2 -","- C112 H24 Ag8 Au8 F64 I16 N8 -","4","0.5","","Antonio Laguna; Tania Lasanta; José M. López-de-Luzuriaga; Miguel Monge; Panče Naumov; M. Elena Olmos","Combining Aurophilic Interactions and Halogen Bonding To Control the Luminescence from Bimetallic Gold-Silver Clusters","Journal of the American Chemical Society","2010","132","","456","457","10.1021/ja909241m","","","0.71073","MoKα","","0.0367","0.0323","","","0.0822","0.0854","","","","","","1.057","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101799","8.9623","0.0006","17.635","0.0013","12.5098","0.0008","90","","105.836","0.004","90","","1902.1","0.2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H19 Cl O2 -","- C23 H19 Cl O2 -","- C92 H76 Cl4 O8 -","4","2","","Bing-Feng Shi; Yang-Hui Zhang; Jonathan K. Lam; Dong-Hui Wang; Jin-Quan Yu","Pd(II)-Catalyzed Enantioselective C-H Olefination of Diphenylacetic Acids","Journal of the American Chemical Society","2010","132","","460","461","10.1021/ja909571z","","","1.54178","CuKα","","0.0369","0.0331","","","0.075","0.0836","","","","","","1.054","","","","has coordinates","178763","2020-10-21","18:00:00","" "4101800","8.7295","0.0003","9.1322","0.0004","15.4663","0.0006","90","","90","","90","","1232.97","0.08","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 O2 -","- C14 H18 O2 -","- C56 H72 O8 -","4","1","","Paula Álvarez-Bercedo; Areli Flores-Gaspar; Arkaitz Correa; Ruben Martin","Pd-Catalyzed Intramolecular Acylation of Aryl Bromides via C-H Functionalization: A Highly Efficient Synthesis of Benzocyclobutenones","Journal of the American Chemical Society","2010","132","","466","467","10.1021/ja909811t","","","0.71073","MoKα","","0.0495","0.0439","","","0.1109","0.1146","","","","","","1.072","","","","has coordinates","288243","2023-12-12","09:57:13","" "4101801","19.336","0.02","37.32","0.03","27.17","0.03","90","","100.48","0.04","90","","19279","3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C122.5 H120 N35.5 O45 Pd6 -","- C122.484 H120 N35.5 O44.998 Pd6 -","- C489.936 H480 N142 O179.992 Pd24 -","4","1","","Yoshihiro Yamauchi; Michito Yoshizawa; Munetaka Akita; Makoto Fujita","Engineering Double to Quintuple Stacks of a Polarized Aromatic in Confined Cavities","Journal of the American Chemical Society","2010","132","","960","966","10.1021/ja904063r","","","0.71073","MoKα","","0.4192","0.1887","","","0.4415","0.5792","","","","","","1.066","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101802","9.0402","0.0004","9.0402","0.0004","25.26","0.003","90","","90","","90","","2064.4","0.3","298","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","1","","","- C20 H16 S4 Si2 -","- C20 H16 S4 Si2 -","- C80 H64 S16 Si8 -","4","0.5","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.0296","0.028","","","0.0709","0.0727","","","","","","1.051","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101803","19.715","","3.902","","17.846","","90","","90","","90","","1372.86","","173","2","173","2","","","","","","","","3","P n a 21","P 2c -2n","33","2a","","","- C16 H4 S6 -","- C20.1333 H4.73333 S7.89333 -","- C60.4 H14.2 S23.68 -","3","0.75","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.0454","0.0402","","","0.1115","0.1168","","","","","","0.922","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101804","16.522","0.002","6.2465","0.0008","16.655","0.002","90","","101.261","0.003","90","","1685.8","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2b","","","- C28 H36 S6 Si4 -","- C28 H36 S6 Si4 -","- C56 H72 S12 Si8 -","2","0.5","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.045","0.0364","","","0.1007","0.1164","","","","","","1.169","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101805","6.4045","0.0019","10.484","0.003","26.798","0.008","90","","90.94","0.005","90","","1799.1","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3b","","","- C28 H36 O4 S6 Si4 -","- C28 H36 O4 S6 Si4 -","- C56 H72 O8 S12 Si8 -","2","0.5","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.0654","0.0482","","","0.1122","0.1289","","","","","","1.193","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101806","13.186","0.003","12.994","0.003","6.7057","0.0014","90","","90","","90","","1148.9","0.4","298","2","298","2","","","","","","","","4","C m c 21","C 2c -2","36","5","","","- C10 H10 S2 Si -","- C10 H10 S2 Si -","- C40 H40 S8 Si4 -","4","0.5","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.0284","0.0276","","","0.0702","0.0725","","","","","","1.115","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101807","9.037","0.004","5.959","0.002","15.129","0.006","90","","97.172","0.006","90","","808.3","0.6","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","7","","","- C8 H4 S3 -","- C8 H4 S3 -","- C32 H16 S12 -","4","1","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.0396","0.0336","","","0.084","0.09","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101808","7.5141","0.0013","7.8398","0.0014","15.087","0.003","90","","92.208","0.003","90","","888.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","9","","","- C8 H4 O2 S3 -","- C8 H4 O2 S3 -","- C32 H16 O8 S12 -","4","1","","Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda","Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties","Journal of the American Chemical Society","2010","132","","1066","1074","10.1021/ja908161r","","","0.71073","MoKα","","0.0497","0.0382","","","0.0916","0.1173","","","","","","1.162","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101809","12.2403","0.0008","15.7531","0.0011","16.6894","0.0011","90","","90","","90","","3218.1","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-D-Pro-Aib-Ala-Aib-Val-OMe","t-Butyloxycarbonyl-D-prolyl-alpha-aminoisobutyryl-alanyl -alpha-aminoisobutyryl-valyl-methyl ester","","- C27 H47 N5 O8 -","- C27 H47 N5 O8 -","- C108 H188 N20 O32 -","4","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.0501","0.0439","","","0.1249","0.1313","","","","","","1.019","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101810","10.3268","0.0008","18.7549","0.0015","18.9682","0.0016","90","","90","","90","","3673.7","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-D-Pro-Aib-Phe-Aib-Val-OMe","t-Butyloxycarbonyl-D-prolyl-alpha-aminoisobutyryl-phenylalanyl -alpha-aminoisobutyryl-valyl-methyl ester","","- C33 H51 N5 O8 -","- C33 H51 N5 O8 -","- C132 H204 N20 O32 -","4","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.0582","0.0472","","","0.1325","0.1418","","","","","","1.101","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101811","12.2528","0.0012","15.7498","0.0016","16.6866","0.0016","90","","90","","90","","3220.2","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Pro-Aib-D-Ala-Aib-D-Val-OMe","t-Butyloxycarbonyl-prolyl-alpha-aminoisobutyryl -D-alanyl-alpha-aminoisobutyryl-D-valyl-methyl ester","","- C27 H47 N5 O8 -","- C27 H47 N5 O8 -","- C108 H188 N20 O32 -","4","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.059","0.0473","","","0.1278","0.138","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101812","10.3354","0.0005","18.7733","0.001","18.982","0.001","90","","90","","90","","3683.1","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Pro-Aib-D-Phe-Aib-D-Val-OMe","t-Butyloxycarbonyl-prolyl-alpha-aminoisobutyryl -D-phenylalanyl-alpha-aminoisobutyryl-D-valyl-methyl ester","","- C33 H51 N5 O8 -","- C33 H51 N5 O8 -","- C132 H204 N20 O32 -","4","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.0612","0.051","","","0.1526","0.1638","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101813","24.4102","0.0008","24.4102","0.0008","10.6627","0.0007","90","","90","","120","","5502.3","0.4","293","2","293","2","","","","","","","","4","P 61","P 61","169","Boc-Pro-Aib-D-Leu-Aib-D-Val-OMe","t-Butyloxycarbonyl-prolyl-alpha-aminoisobutyryl -D-leucyl-alpha-aminoisobutyryl-D-valyl-methyl ester","","- C30 H53 N5 O8 -","- C30 H53 N5 O8 -","- C180 H318 N30 O48 -","6","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.0668","0.0543","","","0.1495","0.1605","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101814","24.3645","0.0014","24.3645","0.0014","10.4875","0.0014","90","","90","","120","","5391.6","0.8","293","2","293","2","","","","","","","","4","P 61","P 61","169","Boc-Pro-Aib-D-Val-Aib-D-Val-OMe","t-Butyloxycarbonyl-prolyl-alpha-aminoisobutyryl -D-valyl-alpha-aminoisobutyryl-D-valyl-methyl ester","","- C29 H51 N5 O8.17 -","- C29 H51 N5 O8.17 -","- C174 H306 N30 O49.02 -","6","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.1936","0.0745","","","0.181","0.2426","","","","","","0.934","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101815","20.728","0.004","9.1079","0.0015","19.573","0.003","90","","94.207","0.003","90","","3685.2","1.1","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","Boc-Pro-Aib-D-Val-Aib-D-Val-OMe","t-Butyloxycarbonyl-prolyl-alpha-aminoisobutyryl-D-valyl -alpha-aminoisobutyryl-D-valyl-methyl ester","","- C29 H51 N5 O10 -","- C29 H51 N5 O10 -","- C116 H204 N20 O40 -","4","1","","Upadhyayula S. Raghavender; Kantharaju; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hydrophobic Peptide Channels and Encapsulated Water Wires","Journal of the American Chemical Society","2010","132","","1075","1086","10.1021/ja9083978","","","0.71073","MoKα","","0.0774","0.0672","","","0.1784","0.1897","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101816","14.438","0.003","18.437","0.004","12.997","0.003","90","","90","","90","","3459.7","1.3","123","2","123.15","","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C9.6 H8 B0.8 Co0.4 Fe0.8 N7.2 -","- C9.6 H8 B0.8 Co0.4 Fe0.8 N7.2 -","- C96 H80 B8 Co4 Fe8 N72 -","10","0.625","","Yan-Juan Zhang; Tao Liu; Shinji Kanegawa; Osamu Sato","Interconversion between a Nonporous Nanocluster and a Microporous Coordination Polymer Showing Selective Gas Adsorption","Journal of the American Chemical Society","2010","132","","912","913","10.1021/ja908670u","","","0.71073","MoKα","","0.1091","0.1089","","","0.2007","0.2007","","","","","","1.107","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101817","19.978","0.005","13.293","0.003","33.001","0.008","90","","91.007","0.002","90","","8763","4","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C80 H92 F12 N18 O14 P2 -","- C100 H118 F14 N12 O18 P2 -","- C400 H472 F56 N48 O72 P8 -","4","0.5","","Dennis Cao; Matteo Amelia; Liana M. Klivansky; Gayane Koshkakaryan; Saeed I. Khan; Monica Semeraro; Serena Silvi; Margherita Venturi; Alberto Credi; Yi Liu","Probing Donor-Acceptor Interactions and Co-Conformational Changes in Redox Active Desymmetrized [2]Catenanes","Journal of the American Chemical Society","2010","132","","1110","1122","10.1021/ja909041g","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101818","13.604","0.003","27.331","0.007","22.298","0.006","90","","91.513","0.005","90","","8288","4","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C78 H82 F12 N8 O14 P2 S4 -","- C78 H82 F16 N8 O14 P2 S4 -","- C312 H328 F64 N32 O56 P8 S16 -","4","1","","Dennis Cao; Matteo Amelia; Liana M. Klivansky; Gayane Koshkakaryan; Saeed I. Khan; Monica Semeraro; Serena Silvi; Margherita Venturi; Alberto Credi; Yi Liu","Probing Donor-Acceptor Interactions and Co-Conformational Changes in Redox Active Desymmetrized [2]Catenanes","Journal of the American Chemical Society","2010","132","","1110","1122","10.1021/ja909041g","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101819","27.177","0.004","21.223","0.003","27.88","0.004","90","","90","","90","","16081","4","","","","","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C82 H84 F12 N8 O14 P2 S4 -","- C107 H119 F12 N9.5 O19 P2 S4 -","- C856 H952 F96 N76 O152 P16 S32 -","8","1","","Dennis Cao; Matteo Amelia; Liana M. Klivansky; Gayane Koshkakaryan; Saeed I. Khan; Monica Semeraro; Serena Silvi; Margherita Venturi; Alberto Credi; Yi Liu","Probing Donor-Acceptor Interactions and Co-Conformational Changes in Redox Active Desymmetrized [2]Catenanes","Journal of the American Chemical Society","2010","132","","1110","1122","10.1021/ja909041g","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101820","13.183","0.0004","13.2275","0.0004","24.4548","0.0008","90","","94.501","0.001","90","","4251.2","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 Cl2 N4 Si2 -","- C44 H56 Cl2 N4 Si2 -","- C176 H224 Cl8 N16 Si8 -","4","1","","Sakya S. Sen; Herbert W. Roesky; Daniel Stern; Julian Henn; Dietmar Stalke","High Yield Access to Silylene RSiCl (R = PhC(NtBu)2) and Its Reactivity toward Alkyne: Synthesis of Stable Disilacyclobutene","Journal of the American Chemical Society","2010","132","","1123","1126","10.1021/ja9091374","","","0.71073","MoKα","","0.058","0.0479","","","0.133","0.1388","","","","","","1.13","","","","has coordinates","176432","2020-10-21","18:00:00","" "4101821","18.4","0.02","6.935","0.007","11.075","0.011","90","","90","","90","","1413","3","293","2","293","2","","","","","","","","5","I m m a","-I 2b 2","74","","","","- C8 H4 Cl Fe O5 -","- C8 Cl Fe O5 -","- C32 Cl4 Fe4 O20 -","4","0.25","","Thomas Devic; Patricia Horcajada; Christian Serre; Fabrice Salles; Guillaume Maurin; Béatrice Moulin; Daniela Heurtaux; Guillaume Clet; Alexandre Vimont; Jean-Marc Grenèche; Benjamin Le Ouay; Florian Moreau; Emmanuel Magnier; Yaroslav Filinchuk; Jerôme Marrot; Jean-Claude Lavalley; Marco Daturi; Gérard Férey","Functionalization in Flexible Porous Solids: Effects on the Pore Opening and the Host-Guest Interactions","Journal of the American Chemical Society","2010","132","","1127","1136","10.1021/ja9092715","","","0.71073","MoKα","","0.1781","0.1077","","","0.254","0.2881","","","","","","1.019","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101822","17.841","0.004","6.8729","0.0015","11.839","0.003","90","","90","","90","","1451.7","0.6","293","2","293","2","","","","","","","","4","I m m a","-I 2b 2","74","","","","- C8 H5 Fe O7 -","- C8 Fe O7 -","- C32 Fe4 O28 -","4","0.25","","Thomas Devic; Patricia Horcajada; Christian Serre; Fabrice Salles; Guillaume Maurin; Béatrice Moulin; Daniela Heurtaux; Guillaume Clet; Alexandre Vimont; Jean-Marc Grenèche; Benjamin Le Ouay; Florian Moreau; Emmanuel Magnier; Yaroslav Filinchuk; Jerôme Marrot; Jean-Claude Lavalley; Marco Daturi; Gérard Férey","Functionalization in Flexible Porous Solids: Effects on the Pore Opening and the Host-Guest Interactions","Journal of the American Chemical Society","2010","132","","1127","1136","10.1021/ja9092715","","","0.71073","MoKα","","0.1149","0.0734","","","0.227","0.2455","","","","","","1.199","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101823","14.008","0.003","11.521","0.0013","15.701","0.003","90","","96.679","0.01","90","","2516.7","0.8","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C47 H26 N3 O9 Zn2 -","- C47 H26 N3 O9 Zn2 -","- C94 H52 N6 O18 Zn4 -","2","1","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","1.54178","CuKα","","0.1717","0.1266","","","0.3567","0.3954","","","","","","1.546","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101824","11.2038","0.0019","13.975","0.003","15.848","0.003","90","","90","","90","","2481.4","0.8","100","2","100","2","","","","","","","","6","P m m m","-P 2 2","47","","","","- C22 H12 Br N O4 Zn -","- C22 H12 Br N O4 Zn -","- C44 H24 Br2 N2 O8 Zn2 -","2","0.25","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","1.54178","CuKα","","0.0902","0.0487","","","0.1097","0.117","","","","","","0.808","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101825","15.654","0.001","15.9467","0.0011","11.6268","0.0008","90","","90","","90","","2902.4","0.3","100","2","100","2","","","","","","","","5","P m c 21","P 2c -2","26","","","","- C22 H13 N2 O4 Zn -","- C22 H13 N2 O4 Zn -","- C88 H52 N8 O16 Zn4 -","4","1","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","0.41823","","","0.0908","0.0802","","","0.2087","0.2204","","","","","","0.837","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101826","11.711","0.0016","15.6181","0.0012","16.0362","0.0019","90","","90.205","0.01","90","","2933.1","0.6","100","2","100","2","","","","","","","","6","P 1 2/m 1","-P 2y","10","","","","- C22 H12 Br N2 O4 Zn -","- C22 H12 Br N2 O4 Zn -","- C44 H24 Br2 N4 O8 Zn2 -","2","0.5","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","0.71073","MoKα","","0.13","0.0956","","","0.2285","0.2456","","","","","","0.874","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101827","15.674","0.002","18.118","0.002","11.5857","0.0014","90","","90","","90","","3290.1","0.7","100","2","100","2","","","","","","","","5","P 1 1 21","P 2c","4","","","","- C46 H30 N6 O8 Zn2 -","- C46 H30 N6 O8 Zn2 -","- C92 H60 N12 O16 Zn4 -","2","1","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","0.41328","","","0.159","0.1391","","","0.3553","0.3832","","","","","","1.196","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101828","11.6151","0.0011","15.648","0.001","18.163","0.003","90","","93.202","0.01","90","","3296","0.7","100","2","100","2","","","","","","","","6","P 1 2/m 1","-P 2y","10","","","","- C23 H14 Br N3 O4 Zn -","- C23 H14 Br N3 O4 Zn -","- C46 H28 Br2 N6 O8 Zn2 -","2","0.5","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","0.71073","MoKα","","0.1484","0.1096","","","0.2624","0.2873","","","","","","0.912","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101829","10.1617","0.0013","16.451","0.002","22.313","0.003","90","","90","","90","","3730.1","0.8","100","2","100","2","","","","","","","","6","P m m m","-P 2 2","47","","","","- C29 H14 Br N2 O6 Zn -","- C29 H14 Br N2 O6 Zn -","- C58 H28 Br2 N4 O12 Zn2 -","2","0.25","","Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp","Control over Catenation in Metal-Organic Frameworks via Rational Design of the Organic Building Block","Journal of the American Chemical Society","2010","132","","950","952","10.1021/ja909519e","","","1.54178","CuKα","","0.1236","0.0906","","","0.2187","0.2368","","","","","","0.981","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101830","14.199","","14.199","","39.0767","0.0005","90","","90","","120","","6822.82","0.09","223","2","223","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C90 H42 Ir2 N12 O20 Zn4 -","- C90 H42 Ir2 N12 O20 Zn4 -","- C270 H126 Ir6 N36 O60 Zn12 -","3","0.166667","","Zhigang Xie; Liqing Ma; Kathryn E. deKrafft; Athena Jin; Wenbin Lin","Porous Phosphorescent Coordination Polymers for Oxygen Sensing","Journal of the American Chemical Society","2010","132","","922","923","10.1021/ja909629f","","","1.54178","CuKα","","0.0419","0.0414","","","0.1254","0.1259","","","","","","1.001","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101831","17.1946","0.0003","18.1317","0.0003","27.9639","0.0006","71.293","0.002","90","","90","","8257.7","0.3","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C174 H84 Ir4 N18 O36 Zn6 -","- C174 H84 Ir4 N18 O36 Zn6 -","- C348 H168 Ir8 N36 O72 Zn12 -","2","1","","Zhigang Xie; Liqing Ma; Kathryn E. deKrafft; Athena Jin; Wenbin Lin","Porous Phosphorescent Coordination Polymers for Oxygen Sensing","Journal of the American Chemical Society","2010","132","","922","923","10.1021/ja909629f","","","1.54178","CuKα","","0.1852","0.0849","","","0.1873","0.2399","","","","","","1.035","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101832","13.7071","0.0002","17.0996","0.0003","17.8304","0.0003","90.467","0.001","109.629","0.0009","90.097","0.001","3936.16","0.11","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H42 Ir2 N8 O19 Zn2.5 -","- C78 H42 Ir2 N8 O19 Zn2.5 -","- C156 H84 Ir4 N16 O38 Zn5 -","2","1","","Zhigang Xie; Liqing Ma; Kathryn E. deKrafft; Athena Jin; Wenbin Lin","Porous Phosphorescent Coordination Polymers for Oxygen Sensing","Journal of the American Chemical Society","2010","132","","922","923","10.1021/ja909629f","","","1.54178","CuKα","","0.0588","0.0417","","","0.1063","0.1107","","","","","","0.975","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101833","19.121","0.003","21.195","0.003","21.618","0.003","90","","90","","90","","8761","2","113","2","113","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C95 H90 B F24 Ir N O P -","- C95 H90 B F24 Ir N O P -","- C380 H360 B4 F96 Ir4 N4 O4 P4 -","4","1","","Shen Li; Shou-Fei Zhu; Jian-Hua Xie; Song Song; Can-Ming Zhang; Qi-Lin Zhou","Enantioselective Hydrogenation of α-Aryloxy and α-Alkoxy α,β-Unsaturated Carboxylic Acids Catalyzed by Chiral Spiro Iridium/Phosphino-Oxazoline Complexes","Journal of the American Chemical Society","2010","132","","1172","1179","10.1021/ja909810k","","","0.7107","MoKα","","0.0588","0.0496","","","0.0847","0.088","","","","","","1.044","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101834","10.796","0.0002","10.796","0.0002","16.8101","0.0005","90","","90","","120","","1696.78","0.07","140","2","140","2","","","","","","","","6","P 32","P 32","145","","","","- C20 H18 Fe2 N2 O6 S2 -","- C20 H18 Fe2 N2 O6 S2 -","- C60 H54 Fe6 N6 O18 S6 -","3","1","","Dafa Chen; Rosario Scopelliti; Xile Hu","Synthesis and Reactivity of Iron Acyl Complexes Modeling the Active Site of [Fe]-Hydrogenase","Journal of the American Chemical Society","2010","132","","928","929","10.1021/ja9100485","","","0.71073","MoKα","","0.0326","0.0266","","","0.0468","0.0479","","","","","","0.973","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101835","11.4641","0.0005","17.338","0.0008","13.0286","0.0006","90","","103.027","0.005","90","","2523","0.2","140","2","140","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Fe N O3 P S -","- C28 H24 Fe N O3 P S -","- C112 H96 Fe4 N4 O12 P4 S4 -","4","1","","Dafa Chen; Rosario Scopelliti; Xile Hu","Synthesis and Reactivity of Iron Acyl Complexes Modeling the Active Site of [Fe]-Hydrogenase","Journal of the American Chemical Society","2010","132","","928","929","10.1021/ja9100485","","","0.71073","MoKα","","0.0593","0.0388","","","0.0839","0.0886","","","","","","1.038","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101836","15.205","0.0005","11.602","0.0004","32.716","0.0006","90","","95.385","0.002","90","","5745.9","0.3","120","0.1","120","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","E-1,1,4,4-Tetrakis[bis(trimethylsilyl)methyl]- 1,4-diisopropyl-2-diethylamino-2-tetrasilene","","- C38 H101 N Si12 -","- C38 H101 N Si12 -","- C152 H404 N4 Si48 -","4","1","","Katsuhiko Takeuchi; Masao Ikoshi; Masaaki Ichinohe; Akira Sekiguchi","Addition of Amines and Hydroborane to the Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) Giving Amino- and Boryl-Substituted Disilenes","Journal of the American Chemical Society","2010","132","","930","931","10.1021/ja910157h","","","0.7107","MoKα","","0.0696","0.0529","","","0.1392","0.1504","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101837","20.579","0.0009","17.723","0.0006","19.808","0.0008","90","","119.906","0.002","90","","6262.4","0.4","150","0.1","150","0.1","","","","","","","","4","C 1 c 1","C -2yc","9","","trans-1,1,4,4-tetrakis[bis(trimethylsilyl)methyl]- 1,4-diisopropyl-2-(N,N-diphenylamino)-2-tetrasilene","","- C46 H101 N Si12 -","- C46 H100 N Si12 -","- C184 H400 N4 Si48 -","4","1","","Katsuhiko Takeuchi; Masao Ikoshi; Masaaki Ichinohe; Akira Sekiguchi","Addition of Amines and Hydroborane to the Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) Giving Amino- and Boryl-Substituted Disilenes","Journal of the American Chemical Society","2010","132","","930","931","10.1021/ja910157h","","","0.7107","MoKα","","0.0543","0.0447","","","0.1188","0.1239","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101838","15.421","0.0005","11.592","0.0004","37.112","0.0007","90","","98.946","0.002","90","","6553.4","0.3","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","E-1,1,4,4-Tetrakis[bis(trimethylsilyl)methyl]-1,4-diisopropyl- 2-(9-borabicyclo[3.3.1]nonan-9-yl]-2-tetrasilene","","- C49 H113 B Si12 -","- C49 H113 B Si12 -","- C196 H452 B4 Si48 -","4","1","","Katsuhiko Takeuchi; Masao Ikoshi; Masaaki Ichinohe; Akira Sekiguchi","Addition of Amines and Hydroborane to the Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) Giving Amino- and Boryl-Substituted Disilenes","Journal of the American Chemical Society","2010","132","","930","931","10.1021/ja910157h","","","0.7107","MoKα","","0.0711","0.0506","","","0.1365","0.1476","","","","","","1.051","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101839","25.0154","0.0013","11.3144","0.0006","22.0186","0.0011","90","","109.649","0.002","90","","5869.1","0.5","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27 H44 F O2 P Pd Si -","- C27 H44 F O2 P Pd Si -","- C216 H352 F8 O16 P8 Pd8 Si8 -","8","1","","Scott E. Denmark; Russell C. Smith","Mechanistic Duality in Palladium-Catalyzed Cross-Coupling Reactions of Aryldimethylsilanolates. Intermediacy of an 8-Si-4 Arylpalladium(II) Silanolate","Journal of the American Chemical Society","2010","132","","1243","1245","10.1021/ja907049y","","","0.71073","MoKα","","0.0429","0.0281","","","0.0611","0.0668","","","","","","1.029","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101840","12.5239","0.0003","12.6398","0.0004","15.2157","0.0004","90.909","0.002","105.17","0.001","103.595","0.002","2251.87","0.11","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H50 O2 P2 Pd Si -","- C52 H50 O2 P2 Pd Si -","- C104 H100 O4 P4 Pd2 Si2 -","2","1","","Scott E. Denmark; Russell C. Smith","Mechanistic Duality in Palladium-Catalyzed Cross-Coupling Reactions of Aryldimethylsilanolates. Intermediacy of an 8-Si-4 Arylpalladium(II) Silanolate","Journal of the American Chemical Society","2010","132","","1243","1245","10.1021/ja907049y","","","0.71073","MoKα","","0.0522","0.0353","","","0.0778","0.0847","","","","","","1.016","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4101841","5.5286","0.0002","7.7518","0.0003","19.4144","0.0006","90","","91.466","0.002","90","","831.76","0.05","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H20 O2 -","- C22 H20 O2 -","- C44 H40 O4 -","2","1","","Sha Lou; Gregory C. Fu","Nickel/Bis(oxazoline)-Catalyzed Asymmetric Kumada Reactions of Alkyl Electrophiles: Cross-Couplings of Racemic α-Bromoketones","Journal of the American Chemical Society","2010","132","","1264","1266","10.1021/ja909689t","","","1.54178","CuKα","","0.0385","0.0376","","","0.1044","0.1049","","","","","","1.055","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101842","10.0926","0.0011","7.019","0.0008","10.2938","0.0011","90","","108.555","0.003","90","","691.31","0.13","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H16 O4 S -","- C13 H16 O4 S -","- C26 H32 O8 S2 -","2","1","","Christopher J. Flynn; Curtis J. Elcoate; Simon E. Lawrence; Anita R. Maguire","Highly Enantioselective Intramolecular Copper Catalyzed C-H Insertion Reactions of α-Diazosulfones","Journal of the American Chemical Society","2010","132","","1184","1185","10.1021/ja909713a","","","0.71073","MoKα","","0.0376","0.0305","","","0.0714","0.0759","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101843","5.7607","0.0007","11.1384","0.0016","20.346","0.003","90","","90","","90","","1305.5","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 O4 S -","- C13 H16 O4 S -","- C52 H64 O16 S4 -","4","1","","Christopher J. Flynn; Curtis J. Elcoate; Simon E. Lawrence; Anita R. Maguire","Highly Enantioselective Intramolecular Copper Catalyzed C-H Insertion Reactions of α-Diazosulfones","Journal of the American Chemical Society","2010","132","","1184","1185","10.1021/ja909713a","","","0.71073","MoKα","","0.0774","0.0441","","","0.0911","0.105","","","","","","0.999","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101844","5.794","0.004","14.547","0.014","18.538","0.013","90","","90","","90","","1562","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 O3 S -","- C18 H18 O3 S -","- C72 H72 O12 S4 -","4","1","","Christopher J. Flynn; Curtis J. Elcoate; Simon E. Lawrence; Anita R. Maguire","Highly Enantioselective Intramolecular Copper Catalyzed C-H Insertion Reactions of α-Diazosulfones","Journal of the American Chemical Society","2010","132","","1184","1185","10.1021/ja909713a","","","0.71073","MoKα","","0.0681","0.0406","","","0.0778","0.087","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101845","13.8993","0.0005","5.3222","0.00019","21.5004","0.0009","90","","107.142","0.002","90","","1519.84","0.1","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(S)-(+)-Benzyloxyacetic acid 1-(toluene-4-sulfonyl)-4 -undecylidenepyrrolidin-3-yl ester","","- C31 H43 N O5 S -","- C31 H43 N O5 S -","- C62 H86 N2 O10 S2 -","2","1","","Rie Tanaka; Keiichi Noguchi; Ken Tanaka","Rhodium-Catalyzed Asymmetric Reductive Cyclization of Heteroatom-Linked 5-Alkynals with Heteroatom-Substituted Acetaldehydes","Journal of the American Chemical Society","2010","132","","1238","1239","10.1021/ja9104655","","","1.54187","CuKα","","0.1097","0.0658","","","0.1525","0.1985","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101846","14.2115","0.0015","20.2651","0.0019","18.9643","0.0019","90","","96.746","0.002","90","","5423.9","0.9","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C61 H78 N5 V -","- C61 H78 N5 V -","- C244 H312 N20 V4 -","4","1","","Ba L. Tran; Maren Pink; Xinfeng Gao; Hyunsoo Park; Daniel J. Mindiola","Low-Coordinate and Neutral Nitrido Complexes of Vanadium","Journal of the American Chemical Society","2010","132","","1458","1459","10.1021/ja908303k","","","0.71073","MoKα","","0.0882","0.0501","","","0.1104","0.1262","","","","","","1.009","","","","has coordinates","198632","2020-10-21","18:00:00","" "4101847","10.48","0.002","18.768","0.004","20.844","0.004","90","","103.704","0.005","90","","3983.1","1.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H55 N4 O V -","- C44 H55 N4 O V -","- C176 H220 N16 O4 V4 -","4","1","","Ba L. Tran; Maren Pink; Xinfeng Gao; Hyunsoo Park; Daniel J. Mindiola","Low-Coordinate and Neutral Nitrido Complexes of Vanadium","Journal of the American Chemical Society","2010","132","","1458","1459","10.1021/ja908303k","","x-ray","0.71073","MoKα","","0.0611","0.046","","","0.1219","0.1346","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101848","15.0353","0.0006","12.8334","0.0005","24.9918","0.001","90","","105.174","0.001","90","","4654.1","0.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H64 N5 V -","- C52 H64 N5 V -","- C208 H256 N20 V4 -","4","1","","Ba L. Tran; Maren Pink; Xinfeng Gao; Hyunsoo Park; Daniel J. Mindiola","Low-Coordinate and Neutral Nitrido Complexes of Vanadium","Journal of the American Chemical Society","2010","132","","1458","1459","10.1021/ja908303k","","","0.71073","MoKα","","0.0784","0.0455","","","0.1005","0.1137","","","","","","1.021","","","","has coordinates","198632","2020-10-21","18:00:00","" "4101849","10.5702","0.0015","18.793","0.003","20.862","0.003","90","","103.966","0.003","90","","4021.6","1","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H55 N6 V -","- C43 H55 N6 V -","- C172 H220 N24 V4 -","4","1","","Ba L. Tran; Maren Pink; Xinfeng Gao; Hyunsoo Park; Daniel J. Mindiola","Low-Coordinate and Neutral Nitrido Complexes of Vanadium","Journal of the American Chemical Society","2010","132","","1458","1459","10.1021/ja908303k","","","0.71073","MoKα","","0.1034","0.0564","","","0.1347","0.1689","","","","","","1.055","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00","" "4101850","11.0075","0.0011","18.0498","0.0019","11.1488","0.0011","90","","103.942","0.007","90","","2149.8","0.4","120","2","120","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C24 H39 F24 N9 O P4 Ru -","- C24 H39 F24 N9 O P4 Ru -","- C48 H78 F48 N18 O2 P8 Ru2 -","2","1","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.0656","0.0476","","","0.0936","0.1015","","","","","","1.025","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101851","16.86","0.07","18.6","0.03","14.35","0.05","90","","95","0.3","90","","4483","3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 F24 N8 P4 Ru -","- C32 H38 F24 N8 P4 Ru -","- C128 H152 F96 N32 P16 Ru4 -","4","1","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.2326","0.1418","","","0.3328","0.3951","","","","","","1.029","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101852","61.18","0.02","28.994","0.01","30.362","0.01","90","","90","","90","","53858","3","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","Dr B. J. Coe","","- C152.25 H165.88 B4 N11.38 O5.38 Ru -","- C132 H122 B4 N8 O2 Ru -","- C2112 H1952 B64 N128 O32 Ru16 -","16","1","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.1476","0.0949","","","0.2268","0.2447","","","","","","0.861","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101853","16.4397","0.0015","7.3508","0.0006","18.6167","0.0016","90","","90","","90","","2249.7","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H11 I N2 -","- C11 H11 I N2 -","- C88 H88 I8 N16 -","8","1","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.0452","0.0355","","","0.0797","0.0838","","","","","","1.12","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101854","11.07","0.0009","19.987","0.0015","12.901","0.001","90","","111.99","0.001","90","","2646.8","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 I N2 O0.5 -","- C13 H14 I N2 O0.5 -","- C104 H112 I8 N16 O4 -","8","2","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.0457","0.0302","","","0.0617","0.0664","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101855","16.0499","0.0016","6.9437","0.0007","16.4241","0.0016","90","","115.326","0.002","90","","1654.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Cl2 N2 O -","- C18 H18 Cl2 N2 O -","- C72 H72 Cl8 N8 O4 -","4","1","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.0614","0.0476","","","0.1372","0.1433","","","","","","1.361","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101856","25.521","0.017","14.223","0.01","15.13","0.01","90","","113.409","0.013","90","","5040","6","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C40 H46 F24 N8 P4 Ru -","- C40 H46 F24 N8 P4 Ru -","- C160 H184 F96 N32 P16 Ru4 -","4","1","","Benjamin J. Coe; Simon P. Foxon; Elizabeth C. Harper; Madeleine Helliwell; James Raftery; Catherine A. Swanson; Bruce S. Brunschwig; Koen Clays; Edith Franz; Javier Garín; Jesús Orduna; Peter N. Horton; Michael B. Hursthouse","Evolution of Linear Absorption and Nonlinear Optical Properties in V-Shaped Ruthenium(II)-Based Chromophores","Journal of the American Chemical Society","2010","132","","1706","1723","10.1021/ja908667p","","","0.71073","MoKα","","0.1911","0.1104","","","0.2623","0.3121","","","","","","1.04","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101857","8.436","0.0012","17.851","0.003","20.117","0.003","90","","90","","90","","3029.4","0.8","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H43 Co N5 -","- C33 H43 Co N5 -","- C132 H172 Co4 N20 -","4","1","","Amanda C. Bowman; Carsten Milsmann; Crisita Carmen Hojilla Atienza; Emil Lobkovsky; Karl Wieghardt; Paul J. Chirik","Synthesis and Molecular and Electronic Structures of Reduced Bis(imino)pyridine Cobalt Dinitrogen Complexes: Ligand versus Metal Reduction","Journal of the American Chemical Society","2010","132","","1676","1684","10.1021/ja908955t","","","0.71073","MoKα","","0.0606","0.0416","","","0.0742","0.0806","","","","","","1.027","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101858","12.3808","0.0005","7.1865","0.0002","17.5078","0.0008","90","","98.452","0.002","90","","1540.83","0.1","297.1","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C19 H22 O -","- C19 H22 O -","- C76 H88 O4 -","4","1","","Vanessa M. Marx; D. Jean Burnell","Nazarov Cyclizations of an Allenyl Vinyl Ketone with Interception of the Oxyallyl Cation Intermediate for the Formation of Carbon-Carbon Bonds","Journal of the American Chemical Society","2010","132","","1685","1689","10.1021/ja909073r","","","0.7107","MoKα","","","0.0526","","","","0.0693","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101859","8.044","0.002","15.913","0.005","3.4891","0.001","90","","100.08","0.02","90","","439.7","0.2","293","2","293","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Bi Cd4 O10 -","- B3 Bi Cd4 O10 -","- B6 Bi2 Cd8 O20 -","2","0.5","","Wei-Long Zhang; Wen-Dan Cheng; Hao Zhang; Lei Geng; Chen-Sheng Lin; Zhang-Zhen He","A Strong Second-Harmonic Generation Material Cd4BiO(BO3)3 Originating from 3-Chromophore Asymmetric Structures","Journal of the American Chemical Society","2010","132","","1508","1509","10.1021/ja9091209","","","0.71073","MoKα","","0.0411","0.0383","","","0.0806","0.0829","","","","","","1.042","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101860","16.7809","0.0008","20.8853","0.001","8.7101","0.0004","90","","95.594","0.003","90","","3038.1","0.2","118.1","","118.1","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C52 H34 F24 N4 O16 Ru4 -","- C52 H52 F24 N4 O16 Ru4 -","- C104 H104 F48 N8 O32 Ru8 -","2","0.25","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.7107","MoKα","","","0.0452","","","","0.1523","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101861","20.058","0.002","20.031","0.002","8.5425","0.001","90","","99.986","0.007","90","","3380.2","0.6","193.1","","193.1","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C38 H16 Br2 Cl4 F24 N4 O16 Ru4 -","- C38 H16 Br2 Cl4.04 F24 N4 O16 Ru4 -","- C76 H32 Br4 Cl8.08 F48 N8 O32 Ru8 -","2","0.25","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.71069","MoKα","","","0.1119","","","","0.2893","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101862","17.402","0.01","20.705","0.01","8.722","0.005","90","","95.629","0.008","90","","3127","3","103.1","","103.1","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C47.8 H27.8 Cl2.8 F26 N4 O16 Ru4 -","- C47.8 H16 Cl2.8 F26 N4 O16 Ru4 -","- C95.6 H32 Cl5.6 F52 N8 O32 Ru8 -","2","0.25","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.71075","MoKα","","","0.038","","","","0.088","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101863","17.542","0.014","20.644","0.016","8.788","0.007","90","","96.627","0.013","90","","3161","4","117.1","","117.1","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C52 H30 F28 N4 O16 Ru4 -","- C52 H45 F28 N4 O16 Ru4 -","- C104 H90 F56 N8 O32 Ru8 -","2","0.25","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.7107","MoKα","","","0.0681","","","","0.1286","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101864","16.825","0.003","20.753","0.004","8.5773","0.0015","90","","95.607","0.003","90","","2980.6","0.9","103.1","","103.1","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C52 H34 F24 N4 O16 Rh4 -","- C52 H12 F24 N4 O16 Rh4 -","- C104 H24 F48 N8 O32 Rh8 -","2","0.25","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.71075","MoKα","","","0.0381","","","","0.0945","","","","","","1.074","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101865","17.555","0.007","20.578","0.008","8.505","0.004","90","","95.622","0.007","90","","3058","2","103.1","","103.1","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C50.2 H30.2 Cl1.2 F26 N4 O16 Rh4 -","- C50.2 H16 Cl1.2 F26 N4 O16 Rh4 -","- C100.4 H32 Cl2.4 F52 N8 O32 Rh8 -","2","0.25","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.71075","MoKα","","","0.0691","","","","0.2026","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101866","8.734","0.004","20.41","0.008","17.895","0.008","90","","96.128","0.006","90","","3172","2","93.1","","93.1","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H18 Cl8 F28 N4 O16 Rh4 -","- C40 H18 Cl8 F28 N4 O16 Rh4 -","- C80 H36 Cl16 F56 N8 O32 Rh8 -","2","0.5","","Hitoshi Miyasaka; Natsuko Motokawa; Satoshi Matsunaga; Masahiro Yamashita; Kunihisa Sugimoto; Tatsuya Mori; Naoki Toyota; Kim R. Dunbar","Control of Charge Transfer in a Series of Ru2II,II/TCNQ Two-Dimensional Networks by Tuning the Electron Affinity of TCNQ Units: A Route to Synergistic Magnetic/Conducting Materials","Journal of the American Chemical Society","2010","132","","1532","1544","10.1021/ja909489s","","","0.7107","MoKα","","","0.0557","","","","0.1374","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101867","5.543","0.0001","8.2574","0.0001","10.6426","0.0002","71.438","0.001","75.465","0.001","89.918","0.001","445.363","0.013","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C24 H19 N2 O -","- C24 H20 N2 O -","- C24 H20 N2 O -","1","1","","Jonathan A. Brekan; Troy E. Reynolds; Karl A. Scheidt","Enantioselective Synthesis of Substituted Indanones from Silyloxyallenes","Journal of the American Chemical Society","2010","132","","1472","1473","10.1021/ja909669e","","","0.71073","MoKα","","0.0383","0.0369","","","0.1007","0.102","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101868","9.6045","0.0004","15.7113","0.0008","16.1606","0.0006","74.298","0.004","87.94","0.003","76.826","0.004","2284.97","0.18","350","2","350","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H40 Fe2 N12 O S4 -","- C41 H37 Fe2 N12 O S4 -","- C82 H74 Fe4 N24 O2 S8 -","2","1","","Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng; Zhiping Zheng","Solvent-Induced Transformation of Single Crystals of a Spin-Crossover (SCO) Compound to Single Crystals with Two Distinct SCO Centers","Journal of the American Chemical Society","2010","132","","1558","1566","10.1021/ja909695f","","","0.71073","MoKα","","0.0629","0.0429","","","0.1173","0.1242","","","","","","1.071","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101869","11.9461","0.0003","11.7266","0.0004","17.3306","0.0005","90","","91.759","0.002","90","","2426.65","0.12","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Fe N6 S2 -","- C20 H18 Fe N6 S2 -","- C80 H72 Fe4 N24 S8 -","4","1","","Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng; Zhiping Zheng","Solvent-Induced Transformation of Single Crystals of a Spin-Crossover (SCO) Compound to Single Crystals with Two Distinct SCO Centers","Journal of the American Chemical Society","2010","132","","1558","1566","10.1021/ja909695f","","","0.71073","MoKα","","0.1004","0.0869","","","0.2467","0.258","","","","","","1.068","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101870","12.1789","0.0003","11.878","0.0003","17.7127","0.0004","90","","93.391","0.002","90","","2557.85","0.11","260","2","260","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Fe N6 S2 -","- C20 H18 Fe N6 S2 -","- C80 H72 Fe4 N24 S8 -","4","1","","Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng; Zhiping Zheng","Solvent-Induced Transformation of Single Crystals of a Spin-Crossover (SCO) Compound to Single Crystals with Two Distinct SCO Centers","Journal of the American Chemical Society","2010","132","","1558","1566","10.1021/ja909695f","","","0.71073","MoKα","","0.0739","0.0588","","","0.1925","0.2006","","","","","","1.063","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101871","9.3957","0.0004","15.4425","0.0007","15.7179","0.0006","74.117","0.004","87.735","0.003","75.846","0.004","2125.98","0.17","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H40 Fe2 N12 O S4 -","- C41 H37 Fe2 N12 O S4 -","- C82 H74 Fe4 N24 O2 S8 -","2","1","","Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng; Zhiping Zheng","Solvent-Induced Transformation of Single Crystals of a Spin-Crossover (SCO) Compound to Single Crystals with Two Distinct SCO Centers","Journal of the American Chemical Society","2010","132","","1558","1566","10.1021/ja909695f","","","0.71073","MoKα","","0.0822","0.0393","","","0.0641","0.0694","","","","","","0.842","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101872","9.5965","0.0005","15.7142","0.0008","15.8899","0.0007","73.598","0.004","86.862","0.004","76.098","0.004","2231.1","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H40 Fe2 N12 O S4 -","- C41 H37 Fe2 N12 O S4 -","- C82 H74 Fe4 N24 O2 S8 -","2","1","","Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng; Zhiping Zheng","Solvent-Induced Transformation of Single Crystals of a Spin-Crossover (SCO) Compound to Single Crystals with Two Distinct SCO Centers","Journal of the American Chemical Society","2010","132","","1558","1566","10.1021/ja909695f","","","0.71073","MoKα","","0.1581","0.0504","","","0.0708","0.0866","","","","","","0.801","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101873","5.9","0.002","11.571","0.005","23.062","0.009","90","","90","","90","","1574.4","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 Cl3 N O3 -","- C14 H14 Cl3 N O3 -","- C56 H56 Cl12 N4 O12 -","4","1","","Stéphane Beaumont; Elizabeth A. Ilardi; Lucas R. Monroe; Armen Zakarian","Valence Tautomerism in Titanium Enolates: Catalytic Radical Haloalkylation and Application in the Total Synthesis of Neodysidenin","Journal of the American Chemical Society","2010","132","","1482","1483","10.1021/ja910154f","","","0.71073","MoKα","","0.0453","0.0369","","","0.0982","0.103","","","","","","1.18","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101874","5.887","0.004","11.304","0.007","13.23","0.008","90","","98.187","0.009","90","","871.4","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C11 H15 Cl6 N O3 -","- C11 H15 Cl6 N O3 -","- C22 H30 Cl12 N2 O6 -","2","1","","Stéphane Beaumont; Elizabeth A. Ilardi; Lucas R. Monroe; Armen Zakarian","Valence Tautomerism in Titanium Enolates: Catalytic Radical Haloalkylation and Application in the Total Synthesis of Neodysidenin","Journal of the American Chemical Society","2010","132","","1482","1483","10.1021/ja910154f","","","0.71073","MoKα","","0.055","0.0399","","","0.0858","0.092","","","","","","0.932","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101875","10.9585","0.0004","7.9293","0.0003","15.5064","0.0006","90","","107.736","0.0004","90","","1283.36","0.08","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H39 N O3 Si -","- C24 H39 N O3 Si -","- C48 H78 N2 O6 Si2 -","2","1","","Tim G. Elford; Dennis G. Hall","Total Synthesis of (+)-Chinensiolide B via Tandem Allylboration/Lactonization","Journal of the American Chemical Society","2010","132","","1488","1489","10.1021/ja9104478","","","0.71073","MoKα","","0.0338","0.0319","","","0.0848","0.0868","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101876","47.7085","0.0002","81.9437","0.0004","10.5045","0.0001","90","","90","","90","","41066.4","0.5","150","2","150","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C29 H32 Cl F12 N6 P2 Ru -","- C29 H32 Cl F12 N6 P2 Ru -","- C1392 H1536 Cl48 F576 N288 P96 Ru48 -","48","3","","Sipke H. Wadman; Remco W. A. Havenith; Martin Lutz; Anthony L. Spek; Gerard P. M. van Klink; Gerard van Koten","Selective para-Halogenation and Dimerization of N,C,N'-Arylruthenium(II) and -(III) 2,2':6',2''-Terpyridine Cations","Journal of the American Chemical Society","2010","132","","1914","1924","10.1021/ja9073276","","","0.71073","MoKα","","0.0422","0.0322","","","0.0676","0.0721","","","","","","1.034","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101877","15.334","0.004","8.573","0.003","24.431","0.007","90","","90","","90","","3211.7","1.7","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","meso-1,1'-(ditertbutylethylenyl)ferrocene","","","- C20 H28 Fe -","- C20 H28 Fe -","- C160 H224 Fe8 -","8","1","","David E. Herbert; Joe B. Gilroy; Anne Staubitz; Mairi F. Haddow; Jeremy N. Harvey; Ian Manners","Strain-Induced Cleavage of Carbon-Carbon Bonds: Bridge Rupture Reactions of Group 8 Dicarba[2]metallocenophanes","Journal of the American Chemical Society","2010","132","","1988","1998","10.1021/ja9087049","","","0.71073","MoKα","","0.0494","0.0334","","","0.1001","0.1426","","","","","","1.34","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101878","31.1903","0.0013","9.7393","0.0004","8.3897","0.0003","90","","97.722","0.002","90","","2525.44","0.17","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","rac-1,1'-ditertbutylethylenylferrocene","","","- C20 H28 Fe -","- C20 H28 Fe -","- C120 H168 Fe6 -","6","1.5","","David E. Herbert; Joe B. Gilroy; Anne Staubitz; Mairi F. Haddow; Jeremy N. Harvey; Ian Manners","Strain-Induced Cleavage of Carbon-Carbon Bonds: Bridge Rupture Reactions of Group 8 Dicarba[2]metallocenophanes","Journal of the American Chemical Society","2010","132","","1988","1998","10.1021/ja9087049","","","0.71073","MoKα","","0.0741","0.0592","","","0.1421","0.1507","","","","","","1.043","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101879","8.0839","0.0006","10.4761","0.0008","8.6654","0.0007","90","","91.849","0.005","90","","733.47","0.1","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H24 Ru -","- C18 H24 Ru -","- C36 H48 Ru2 -","2","1","","David E. Herbert; Joe B. Gilroy; Anne Staubitz; Mairi F. Haddow; Jeremy N. Harvey; Ian Manners","Strain-Induced Cleavage of Carbon-Carbon Bonds: Bridge Rupture Reactions of Group 8 Dicarba[2]metallocenophanes","Journal of the American Chemical Society","2010","132","","1988","1998","10.1021/ja9087049","","","0.71073","MoKα","","0.05","0.0394","","","0.1016","0.1093","","","","","","0.776","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101880","15.377","0.0004","8.678","0.0002","24.7818","0.0006","90","","90","","90","","3306.92","0.14","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C20 H28 Ru -","- C20 H28 Ru -","- C160 H224 Ru8 -","8","1","","David E. Herbert; Joe B. Gilroy; Anne Staubitz; Mairi F. Haddow; Jeremy N. Harvey; Ian Manners","Strain-Induced Cleavage of Carbon-Carbon Bonds: Bridge Rupture Reactions of Group 8 Dicarba[2]metallocenophanes","Journal of the American Chemical Society","2010","132","","1988","1998","10.1021/ja9087049","","","0.71073","MoKα","","0.0308","0.0246","","","0.0658","0.0696","","","","","","1.143","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101881","10.4394","0.0012","8.2881","0.0009","9.7006","0.0011","90","","90","","90","","839.32","0.16","100","2","100","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C20 H28 Ru -","- C20 H28 Ru -","- C40 H56 Ru2 -","2","0.5","","David E. Herbert; Joe B. Gilroy; Anne Staubitz; Mairi F. Haddow; Jeremy N. Harvey; Ian Manners","Strain-Induced Cleavage of Carbon-Carbon Bonds: Bridge Rupture Reactions of Group 8 Dicarba[2]metallocenophanes","Journal of the American Chemical Society","2010","132","","1988","1998","10.1021/ja9087049","","","0.71073","MoKα","","0.022","0.0207","","","0.0465","0.0486","","","","","","1.088","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101882","18.014","0.0002","27.2308","0.0005","19.7247","0.0003","90","","92.588","0.001","90","","9665.8","0.3","293","2","293","2","","","","","","","","7","P 1 c 1","P -2yc","7","","","","- C30 H138 K9 Mo23 N5 O113 S24 -","- C30 H30 K9 Mo23 N5 O113 S24 -","- C60 H60 K18 Mo46 N10 O226 S48 -","2","1","","Sylvain Duval; Sébastien Floquet; Corine Simonnet-Jégat; Jérôme Marrot; Rosa Ngo Biboum; Bineta Keita; Louis Nadjo; Mohamed Haouas; Francis Taulelle; Emmanuel Cadot","Capture of the [Mo~3~S~4~]^4+^ Cluster within a {Mo~18~} Macrocycle Yielding a Supramolecular Assembly Stabilized by a Dynamic H-Bond Network","Journal of the American Chemical Society","2010","132","","2069","2077","10.1021/ja909762p","","","0.71073","MoKα","","0.0633","0.0512","","","0.1405","0.1474","","","","","","1.059","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101883","20.4851","0.0012","20.4851","0.0012","29.203","0.002","90","","90","","90","","12254.7","1.3","293","2","293","2","","","","","","","","8","P 4/n c c :2","-P 4a 2ac","130","","","","- C24 H56 K2 Mo4 N4 Na2 O42 S4 -","- C24 H24 K Mo4 N4 O32 S4 -","- C192 H192 K8 Mo32 N32 O256 S32 -","8","0.5","","Sylvain Duval; Sébastien Floquet; Corine Simonnet-Jégat; Jérôme Marrot; Rosa Ngo Biboum; Bineta Keita; Louis Nadjo; Mohamed Haouas; Francis Taulelle; Emmanuel Cadot","Capture of the [Mo~3~S~4~]^4+^ Cluster within a {Mo~18~} Macrocycle Yielding a Supramolecular Assembly Stabilized by a Dynamic H-Bond Network","Journal of the American Chemical Society","2010","132","","2069","2077","10.1021/ja909762p","","","0.71073","MoKα","","0.12","0.0691","","","0.2074","0.2486","","","","","","1.099","","","","has coordinates","176432","2020-10-21","18:00:00","" "4101884","8.2106","0.0014","6.7252","0.0012","12.488","0.002","90","","96.472","0.003","90","","685.2","0.2","297","2","297","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H12 N4 O3 S -","- C13 H12 N4 O3 S -","- C26 H24 N8 O6 S2 -","2","0.5","","Peihua Xi; Fan Yang; Song Qin; Dongbing Zhao; Jingbo Lan; Ge Gao; Changwei Hu; Jingsong You","Palladium(II)-Catalyzed Oxidative C-H/C-H Cross-Coupling of Heteroarenes","Journal of the American Chemical Society","2010","132","","1822","1824","10.1021/ja909807f","","x-ray","0.71073","MoKα","","0.0529","0.0454","","","0.1332","0.1438","","","","","","1.094","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101885","6.0697","0.0002","11.6015","0.0003","12.9255","0.0005","90","","90.523","0.003","90","","910.15","0.05","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 N2 O S -","- C9 H8 N2 O S -","- C36 H32 N8 O4 S4 -","4","1","","Peihua Xi; Fan Yang; Song Qin; Dongbing Zhao; Jingbo Lan; Ge Gao; Changwei Hu; Jingsong You","Palladium(II)-Catalyzed Oxidative C-H/C-H Cross-Coupling of Heteroarenes","Journal of the American Chemical Society","2010","132","","1822","1824","10.1021/ja909807f","","x-ray","0.71073","MoKα","","0.0542","0.0351","","","0.0913","0.095","","","","","","0.941","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101886","23.644","0.008","8.032","0.003","29.052","0.009","90","","110.535","0.005","90","","5167","3","200","2","200","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 B F3 N5 O6 Ru S -","- C18 H20 B F3 N5 O6 Ru S -","- C144 H160 B8 F24 N40 O48 Ru8 S8 -","8","1","","Brian L. Conley; Travis J. Williams","Thermochemistry and Molecular Structure of a Remarkable Agostic Interaction in a Heterobifunctional Ruthenium-Boron Complex","Journal of the American Chemical Society","2010","132","","1764","1765","10.1021/ja909858a","","","0.71073","MoKα","","0.104","0.0561","","","0.1236","0.1421","","","","","","0.984","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101887","8.9877","0.0008","13.6367","0.0013","17.3641","0.0016","90","","103.424","0.002","90","","2070","0.3","144","2","144","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 B Cl N2 Ru -","- C22 H28 B Cl N2 Ru -","- C88 H112 B4 Cl4 N8 Ru4 -","4","1","","Brian L. Conley; Travis J. Williams","Thermochemistry and Molecular Structure of a Remarkable Agostic Interaction in a Heterobifunctional Ruthenium-Boron Complex","Journal of the American Chemical Society","2010","132","","1764","1765","10.1021/ja909858a","","","0.71073","MoKα","","0.0421","0.0322","","","0.076","0.08","","","","","","1.058","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101888","8.055","0.016","9.457","0.018","15.79","0.03","96.57","0.04","91.22","0.04","95.44","0.03","1189","4","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C19 H23 B F3 N5 O3 Ru S -","- C19 H23 B F3 N5 O3 Ru S -","- C38 H46 B2 F6 N10 O6 Ru2 S2 -","2","1","","Brian L. Conley; Travis J. Williams","Thermochemistry and Molecular Structure of a Remarkable Agostic Interaction in a Heterobifunctional Ruthenium-Boron Complex","Journal of the American Chemical Society","2010","132","","1764","1765","10.1021/ja909858a","","","0.71073","MoKα","","0.2026","0.0921","","","0.1887","0.2468","","","","","","1.059","","","","has coordinates,has disorder","178764","2020-10-21","18:00:00","" "4101889","25.137","0.017","6.351","0.004","19.808","0.013","90","","116.975","0.008","90","","2818","3","153.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H17 N O -","- C17 H17 N O -","- C136 H136 N8 O8 -","8","1","","Tetsuaki Fujihara; Yuko Katafuchi; Tomohiro Iwai; Jun Terao; Yasushi Tsuji","Palladium-Catalyzed Intermolecular Addition of Formamides to Alkynes","Journal of the American Chemical Society","2010","132","","2094","2098","10.1021/ja910038p","","","0.7107","MoKα","","","0.0659","","","","0.1528","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101890","5.867","0.002","10.838","0.004","14.128","0.006","79.302","0.007","87.32","0.007","88.987","0.008","881.7","0.6","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H26 O4 -","- C19 H26 O4 -","- C38 H52 O8 -","2","1","","Zheng, Huaiji; Zheng, Jiyue; Yu, Binxun; Chen, Qiang; Wang, Xiaolei; He, Yongping; Yang, Zhen; She, Xuegong","Pt-Catalyzed Tandem 1,2-Acyloxy Migration/Intramolecular [3 + 2] Cycloaddition of Enynyl Esters","Journal of the American Chemical Society","2010","132","6","1788","1789","10.1021/ja910346m","","","0.71073","MoKα","","0.1352","0.0723","","","0.1994","0.2361","","","","","","1.045","","","","has coordinates","210879","2020-10-21","18:00:00","" "4101891","8.2627","0.0004","9.2103","0.0004","11.3983","0.0004","91.863","0.002","101.511","0.002","100.929","0.002","832.34","0.06","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H24 O4 -","- C19 H24 O4 -","- C38 H48 O8 -","2","1","","Zheng, Huaiji; Zheng, Jiyue; Yu, Binxun; Chen, Qiang; Wang, Xiaolei; He, Yongping; Yang, Zhen; She, Xuegong","Pt-Catalyzed Tandem 1,2-Acyloxy Migration/Intramolecular [3 + 2] Cycloaddition of Enynyl Esters","Journal of the American Chemical Society","2010","132","6","1788","1789","10.1021/ja910346m","","","0.71073","MoKα","","0.0681","0.0446","","","0.1071","0.1239","","","","","","1.043","","","","has coordinates","210879","2020-10-21","18:00:00","" "4101892","9.4926","0.0019","11.463","0.003","12.601","0.003","92.641","0.012","102.774","0.011","90.617","0.011","1335.5","0.5","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C13 H22 O3 -","- C13 H22 O3 -","- C52 H88 O12 -","4","2","","Zheng, Huaiji; Zheng, Jiyue; Yu, Binxun; Chen, Qiang; Wang, Xiaolei; He, Yongping; Yang, Zhen; She, Xuegong","Pt-Catalyzed Tandem 1,2-Acyloxy Migration/Intramolecular [3 + 2] Cycloaddition of Enynyl Esters","Journal of the American Chemical Society","2010","132","6","1788","1789","10.1021/ja910346m","","","0.71073","MoKα","","0.2156","0.0714","","","0.1407","0.2018","","","","","","0.929","","","","has coordinates","210879","2020-10-21","18:00:00","" "4101893","12.9463","0.0013","13.1712","0.0014","14.2459","0.0015","102.253","0.008","106.079","0.008","95.609","0.008","2249.1","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C16.5 H23 K2 N1.5 O5.75 -","- C16.5 H23 K2 N1.5 O5.75 -","- C66 H92 K8 N6 O23 -","4","2","","Charles L. Perrin; Jonathan S. Lau; Yeong-Joon Kim; Phaneendrasai Karri; Curtis Moore; Arnold L. Rheingold","Asymmetry of the ""Strongest"" OHO Hydrogen Bond, in the Monoanion of (\±)-α,α'-Di-tert-butylsuccinate","Journal of the American Chemical Society","2010","132","","2099","2100","10.1021/ja9104733","","","1.54178","CuKα","","0.1268","0.0808","","","0.2183","0.2644","","","","","","1.039","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101894","10.3628","0.0005","11.1182","0.0005","13.0439","0.0006","89.47","0.003","88.254","0.003","80.848","0.002","1483.03","0.12","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H36 Al Br0.5 Cl3 P -","- C30 H33 Al Br0.5 Cl3 P -","- C60 H66 Al2 Br Cl6 P2 -","2","1","","Gabriel Ménard; Douglas W. Stephan","Room Temperature Reduction of CO2 to Methanol by Al-Based Frustrated Lewis Pairs and Ammonia Borane","Journal of the American Chemical Society","2010","132","","1796","1797","10.1021/ja9104792","","","0.71073","MoKα","","0.0834","0.0563","","","0.1516","0.1671","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101895","10.5729","0.0004","11.2503","0.0004","13.1735","0.0005","84.716","0.002","85.767","0.002","76.403","0.002","1514.37","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H40 Al Br3 P -","- C30 H40 Al Br3 P -","- C60 H80 Al2 Br6 P2 -","2","1","","Gabriel Ménard; Douglas W. Stephan","Room Temperature Reduction of CO2 to Methanol by Al-Based Frustrated Lewis Pairs and Ammonia Borane","Journal of the American Chemical Society","2010","132","","1796","1797","10.1021/ja9104792","","","0.71073","MoKα","","0.0786","0.0467","","","0.1198","0.1333","","","","","","1.025","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101896","10.5382","0.001","20.0664","0.0015","31.987","0.003","90","","90","","90","","6764.1","1","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H33 Al2 Cl6 O2 P -","- C28 H33 Al2 Cl6 O2 P -","- C224 H264 Al16 Cl48 O16 P8 -","8","1","","Gabriel Ménard; Douglas W. Stephan","Room Temperature Reduction of CO2 to Methanol by Al-Based Frustrated Lewis Pairs and Ammonia Borane","Journal of the American Chemical Society","2010","132","","1796","1797","10.1021/ja9104792","","","0.71073","MoKα","","0.2184","0.1023","","","0.2189","0.2715","","","","","","1.018","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101897","10.7976","0.0006","10.9304","0.0006","16.1191","0.001","100.641","0.003","90.487","0.003","107.466","0.003","1779.34","0.18","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H33 Al2 Br6 O2 P -","- C28 H33 Al2 Br6 O2 P -","- C56 H66 Al4 Br12 O4 P2 -","2","1","","Gabriel Ménard; Douglas W. Stephan","Room Temperature Reduction of CO2 to Methanol by Al-Based Frustrated Lewis Pairs and Ammonia Borane","Journal of the American Chemical Society","2010","132","","1796","1797","10.1021/ja9104792","","","0.71073","MoKα","","0.0951","0.0457","","","0.1161","0.1329","","","","","","1.062","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101898","13.57","0.0007","15.0537","0.0008","15.6353","0.0008","102.707","0.003","93.952","0.003","102.129","0.003","3023.9","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H35 Al Br4 P -","- C27 H33 Al Br4 P -","- C108 H132 Al4 Br16 P4 -","4","2","","Gabriel Ménard; Douglas W. Stephan","Room Temperature Reduction of CO2 to Methanol by Al-Based Frustrated Lewis Pairs and Ammonia Borane","Journal of the American Chemical Society","2010","132","","1796","1797","10.1021/ja9104792","","","0.71073","MoKα","","0.0651","0.0428","","","0.0996","0.1101","","","","","","1.016","","","","has coordinates","178764","2020-10-21","18:00:00","" "4101899","9.1227","0.0011","18.873","0.002","20.343","0.002","90","","90","","90","","3502.5","0.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H17 N O4 -","- C20 H17 N O4 -","- C160 H136 N8 O32 -","8","1","","Chang Ho Oh; Swastik Karmakar; HyoSeung Park; YoungCheon Ahn; Jung Wook Kim","Domino Process in Silver-Catalyzed Reactions of N-Arylformimidates and Active Methylene Compounds Involving Cycloisomerization and 1,3-Alkenyl Shift","Journal of the American Chemical Society","2010","132","","1792","1793","10.1021/ja9106226","","","0.71073","MoKα","","0.1149","0.0565","","","0.1012","0.1282","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101900","18.7639","0.0003","16.9382","0.0003","21.0542","0.0004","90","","106.241","0.001","90","","6424.6","0.2","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C56 H52 Be F6 N6 O17 Re2 S2 -","- C56 H52 Be F6 N6 O17 Re2 S2 -","- C224 H208 Be4 F24 N24 O68 Re8 S8 -","4","1","","Troy E. Knight; James K. McCusker","Orbital-Specific Energy Transfer","Journal of the American Chemical Society","2010","132","","2208","2221","10.1021/ja907303t","","","1.54178","CuKα","","0.0507","0.0478","","","0.1297","0.1319","","","","","","1.053","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101901","10.3213","0.0012","24.532","0.003","12.1608","0.0014","90","","104.027","0.002","90","","2987.3","0.6","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C52 H42 Cu F6 N8 O16 Re2 S2 -","- C52 H42 Cu F6 N8 O16 Re2 S2 -","- C104 H84 Cu2 F12 N16 O32 Re4 S4 -","2","0.5","","Troy E. Knight; James K. McCusker","Orbital-Specific Energy Transfer","Journal of the American Chemical Society","2010","132","","2208","2221","10.1021/ja907303t","","","0.71073","MoKα","","0.0225","0.0189","","","0.0432","0.0443","","","","","","1.005","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101902","13.863","0.002","30.022","0.004","6.2454","0.0009","90","","90","","90","","2599.3","0.6","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C10.5 H16 Cl I N O3 -","- C10.5 H14 Cl I N O3 -","- C84 H112 Cl8 I8 N8 O24 -","8","1","","Xinqiang Fang; Kun Liu; Chaozhong Li","Efficient Regio- and Stereoselective Formation of Azocan-2-ones via 8-EndoCyclization of α-Carbamoyl Radicals","Journal of the American Chemical Society","2010","132","","2274","2283","10.1021/ja9082649","","","0.71073","MoKα","","0.1607","0.0772","","","0.2335","0.2632","","","","","","0.934","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101903","11.536","0.003","6.2833","0.0014","16.804","0.004","90","","104.543","0.004","90","","1179","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 I N O3 -","- C10 H14 I N O3 -","- C40 H56 I4 N4 O12 -","4","1","","Xinqiang Fang; Kun Liu; Chaozhong Li","Efficient Regio- and Stereoselective Formation of Azocan-2-ones via 8-EndoCyclization of α-Carbamoyl Radicals","Journal of the American Chemical Society","2010","132","","2274","2283","10.1021/ja9082649","","","0.71073","MoKα","","0.0838","0.0551","","","0.1276","0.1396","","","","","","0.878","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101904","6.84","0.008","7.013","0.008","13.178","0.015","79.04","0.02","89.21","0.02","73.583","0.019","594.8","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H14 I N O3 -","- C10 H14 I N O3 -","- C20 H28 I2 N2 O6 -","2","1","","Xinqiang Fang; Kun Liu; Chaozhong Li","Efficient Regio- and Stereoselective Formation of Azocan-2-ones via 8-EndoCyclization of α-Carbamoyl Radicals","Journal of the American Chemical Society","2010","132","","2274","2283","10.1021/ja9082649","","","0.71073","MoKα","","0.0983","0.0641","","","0.1408","0.156","","","","","","0.894","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101905","7.9889","0.001","8.9128","0.0012","22.255","0.003","90","","90","","90","","1584.6","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 I N O3 -","- C15 H18 I N O3 -","- C60 H72 I4 N4 O12 -","4","1","","Xinqiang Fang; Kun Liu; Chaozhong Li","Efficient Regio- and Stereoselective Formation of Azocan-2-ones via 8-EndoCyclization of α-Carbamoyl Radicals","Journal of the American Chemical Society","2010","132","","2274","2283","10.1021/ja9082649","","","0.71073","MoKα","","0.0705","0.0578","","","0.1488","0.1574","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101906","19.0493","0.0007","11.8023","0.0004","10.8159","0.0004","90","","90","","90","","2431.69","0.15","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C12 H15 N O4 S -","- C12 H15 N O4 S -","- C96 H120 N8 O32 S8 -","8","2","","Armin H. Stoll; Simon B. Blakey","Rhodium Catalyzed Allene Amination: Diastereoselective Synthesis of Aminocyclopropanes via a 2-Amidoallylcation Intermediate","Journal of the American Chemical Society","2010","132","","2108","2109","10.1021/ja908538t","","","1.54178","CuKα","","0.0224","0.022","","","0.056","0.0563","","","","","","1.04","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101907","12.6837","0.0003","8.7119","0.0003","13.9765","0.0004","90","","110.965","0.001","90","","1442.15","0.07","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H19 N O5 S -","- C11 H19 N O5 S -","- C44 H76 N4 O20 S4 -","4","1","","Armin H. Stoll; Simon B. Blakey","Rhodium Catalyzed Allene Amination: Diastereoselective Synthesis of Aminocyclopropanes via a 2-Amidoallylcation Intermediate","Journal of the American Chemical Society","2010","132","","2108","2109","10.1021/ja908538t","","","1.54178","CuKα","","0.0692","0.065","","","0.1919","0.1965","","","","","","1.009","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101908","6.9683","0.0013","21.374","0.004","12.566","0.003","90","","91.091","0.001","90","","1871.2","0.7","172","2","172","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H22 N2 O5 S -","- C19 H22 N2 O5 S -","- C76 H88 N8 O20 S4 -","4","1","","Armin H. Stoll; Simon B. Blakey","Rhodium Catalyzed Allene Amination: Diastereoselective Synthesis of Aminocyclopropanes via a 2-Amidoallylcation Intermediate","Journal of the American Chemical Society","2010","132","","2108","2109","10.1021/ja908538t","","","0.71073","MoKα","","0.0748","0.0471","","","0.1119","0.1252","","","","","","1.081","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101909","8.5714","0.0008","8.9832","0.0009","9.6979","0.001","90","","114.317","0.007","90","","680.48","0.12","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H17 N O4 S -","- C13 H17 N O4 S -","- C26 H34 N2 O8 S2 -","2","1","","Armin H. Stoll; Simon B. Blakey","Rhodium Catalyzed Allene Amination: Diastereoselective Synthesis of Aminocyclopropanes via a 2-Amidoallylcation Intermediate","Journal of the American Chemical Society","2010","132","","2108","2109","10.1021/ja908538t","","","1.54178","CuKα","","0.0729","0.0464","","","0.1129","0.1457","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101910","9.7851","0.0003","9.8986","0.0003","10.742","0.0003","73.79","0.0015","71.6838","0.0014","79.3001","0.0013","942.99","0.05","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H24 Fe5 N4 O40 P8 -","- C10 H24 Fe5 N4 O40 P8 -","- C10 H24 Fe5 N4 O40 P8 -","1","0.5","","Fiona R. Kizewski; Paul Boyle; Dean Hesterberg; James D. Martin","Mixed Anion (Phosphate/Oxalate) Bonding to Iron(III) Materials","Journal of the American Chemical Society","2010","132","","2301","2308","10.1021/ja908807b","","","0.71073","MolybdenumKα","","0.044","0.037","","0.051","","0.051","","","","","","1.48","","","","has coordinates","192276","2020-10-21","18:00:00","" "4101911","17.982","0.005","16.3","0.005","10.747","0.002","90","","116.82","0.03","90","","2811.2","1.5","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C12 H8 O3 -","- C12 H8 O3 -","- C144 H96 O36 -","12","3","","Ori Gidron; Yael Diskin-Posner; Michael Bendikov","α-Oligofurans","Journal of the American Chemical Society","2010","132","","2148","2150","10.1021/ja9093346","","","0.71073","MoKα","","0.0529","0.0403","","","0.1045","0.1137","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00","" "4101912","19.4403","0.0016","5.2922","0.0004","8.9457","0.0008","90","","99.719","0.005","90","","907.14","0.13","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H14 O6 -","- C24 H14 O6 -","- C48 H28 O12 -","2","0.5","","Ori Gidron; Yael Diskin-Posner; Michael Bendikov","α-Oligofurans","Journal of the American Chemical Society","2010","132","","2148","2150","10.1021/ja9093346","","","0.71073","MoKα","","0.1807","0.0501","","","0.0949","0.1337","","","","","","0.925","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101913","11.2338","0.0017","5.3584","0.0007","10.9863","0.0016","90","","114.828","0.005","90","","600.2","0.15","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 O4 -","- C16 H10 O4 -","- C32 H20 O8 -","2","0.5","","Ori Gidron; Yael Diskin-Posner; Michael Bendikov","α-Oligofurans","Journal of the American Chemical Society","2010","132","","2148","2150","10.1021/ja9093346","","","0.71073","MoKα","","0.0837","0.0428","","","0.0974","0.1167","","","","","","1.026","","","","has coordinates","176432","2020-10-21","18:00:00","" "4101914","14.5159","0.0002","6.9687","0.0001","17.3259","0.0002","90","","90","","90","","1752.64","0.04","153","2","153","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C20 H21 B F2 O3 -","- C20 H21 B F2 O3 -","- C80 H84 B4 F8 O12 -","4","0.5","","Guoqing Zhang; Jiwei Lu; Michal Sabat; Cassandra L. Fraser","Polymorphism and Reversible Mechanochromic Luminescence for Solid-State Difluoroboron Avobenzone","Journal of the American Chemical Society","2010","132","","2160","2162","10.1021/ja9097719","","","0.71073","MoKα","","0.0606","0.054","","","0.1795","0.1879","","","","","","1.017","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101915","24.448","0.003","7.0594","0.0008","10.29","0.001","90","","94.303","0.004","90","","1770.9","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 B F2 O3 -","- C20 H21 B F2 O3 -","- C80 H84 B4 F8 O12 -","4","1","","Guoqing Zhang; Jiwei Lu; Michal Sabat; Cassandra L. Fraser","Polymorphism and Reversible Mechanochromic Luminescence for Solid-State Difluoroboron Avobenzone","Journal of the American Chemical Society","2010","132","","2160","2162","10.1021/ja9097719","","","0.71073","MoKα","","0.1939","0.0956","","","0.2312","0.2719","","","","","","1.295","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101916","28.464","0.003","14.0417","0.0014","9.3917","0.0009","90","","90","","90","","3753.7","0.7","193","2","193","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Tris(N,N-dimethylaminodiboranato)erbium(III)","","- C12 H72 B12 Er2 N6 -","- C12 H72 B12 Er2 N6 -","- C48 H288 B48 Er8 N24 -","4","1","","Scott R. Daly; Do Young Kim; Yu Yang; John R. Abelson; Gregory S. Girolami","Lanthanide N,N-Dimethylaminodiboranates: Highly Volatile Precursors for the Deposition of Lanthanide-Containing Thin Films","Journal of the American Chemical Society","2010","132","","2106","2107","10.1021/ja9098005","","","0.71073","MoKα","","0.1403","0.0476","","","0.0612","0.0762","","","","","","0.712","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101917","12.3657","0.0005","10.8176","0.0005","14.6115","0.0006","90","","96.022","0.002","90","","1943.75","0.14","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H36 B6 N3 Pr -","- C6 H36 B6 N3 Pr -","- C24 H144 B24 N12 Pr4 -","4","1","","Scott R. Daly; Do Young Kim; Yu Yang; John R. Abelson; Gregory S. Girolami","Lanthanide N,N-Dimethylaminodiboranates: Highly Volatile Precursors for the Deposition of Lanthanide-Containing Thin Films","Journal of the American Chemical Society","2010","132","","2106","2107","10.1021/ja9098005","","","0.71073","MoKα","","0.0206","0.017","","","0.0401","0.0421","","","","","","1.049","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101918","15.8615","0.0006","10.1549","0.0004","11.3788","0.0004","90","","96.744","0.001","90","","1820.12","0.12","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H36 B6 N3 Sm -","- C6 H36 B6 N3 Sm -","- C24 H144 B24 N12 Sm4 -","4","1","","Scott R. Daly; Do Young Kim; Yu Yang; John R. Abelson; Gregory S. Girolami","Lanthanide N,N-Dimethylaminodiboranates: Highly Volatile Precursors for the Deposition of Lanthanide-Containing Thin Films","Journal of the American Chemical Society","2010","132","","2106","2107","10.1021/ja9098005","","","0.71073","MoKα","","0.0321","0.0314","","","0.0843","0.0849","","","","","","1.15","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101919","3.8333","0.0011","3.8333","0.0011","12.554","0.004","90","","90","","90","","184.47","0.1","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- Cu0.21 Ga0.05 La0.198 Ni0.74 O4.21 Pr1.802 -","- Cu0.21 Ga0.05 La0.198 Ni0.74 O4.21 Pr1.802 -","- Cu0.42 Ga0.1 La0.396 Ni1.48 O8.42 Pr3.604 -","2","0.0625","","Masatomo Yashima; Nuansaeng Sirikanda; Tatsumi Ishihara","Crystal Structure, Diffusion Path, and Oxygen Permeability of a Pr2NiO4- Based Mixed Conductor (Pr0.9La0.1)2(Ni0.74Cu0.21Ga0.05)O4+δ","Journal of the American Chemical Society","2010","132","","2385","2392","10.1021/ja909820h","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101920","3.8245","0.002","3.8245","0.002","12.5592","0.0064","90","","90","","90","","183.7","0.16","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- Cu0.15 Ga0.05 La0.198 Ni0.8 O4.232 Pr1.802 -","- Cu0.15 Ga0.05 La0.198 Ni0.8 O4.232 Pr1.802 -","- Cu0.3 Ga0.1 La0.396 Ni1.6 O8.464 Pr3.604 -","2","0.0625","","Masatomo Yashima; Nuansaeng Sirikanda; Tatsumi Ishihara","Crystal Structure, Diffusion Path, and Oxygen Permeability of a Pr2NiO4- Based Mixed Conductor (Pr0.9La0.1)2(Ni0.74Cu0.21Ga0.05)O4+δ","Journal of the American Chemical Society","2010","132","","2385","2392","10.1021/ja909820h","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101921","3.836","0.002","3.836","0.002","12.611","0.0066","90","","90","","90","","185.57","0.17","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- Cu0.22 Ga0.05 La Ni0.73 O4.208 Pr -","- Cu0.22 Ga0.05 La2 Ni0.73 O4.208 Pr2 -","- Cu0.44 Ga0.1 La4 Ni1.46 O8.416 Pr4 -","2","0.0625","","Masatomo Yashima; Nuansaeng Sirikanda; Tatsumi Ishihara","Crystal Structure, Diffusion Path, and Oxygen Permeability of a Pr2NiO4- Based Mixed Conductor (Pr0.9La0.1)2(Ni0.74Cu0.21Ga0.05)O4+δ","Journal of the American Chemical Society","2010","132","","2385","2392","10.1021/ja909820h","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101922","3.8557","0.0023","3.8557","0.0023","12.6765","0.0075","90","","90","","90","","188.45","0.19","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- Cu0.23 Ga0.05 La0.198 Ni0.72 O4.176 Pr1.802 -","- Cu0.23 Ga0.05 La0.198 Ni0.72 O4.176 Pr1.802 -","- Cu0.46 Ga0.1 La0.396 Ni1.44 O8.352 Pr3.604 -","2","0.0625","","Masatomo Yashima; Nuansaeng Sirikanda; Tatsumi Ishihara","Crystal Structure, Diffusion Path, and Oxygen Permeability of a Pr2NiO4- Based Mixed Conductor (Pr0.9La0.1)2(Ni0.74Cu0.21Ga0.05)O4+δ","Journal of the American Chemical Society","2010","132","","2385","2392","10.1021/ja909820h","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101923","3.8746","0.0026","3.8746","0.0026","12.7384","0.0087","90","","90","","90","","191.2","0.2","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- Cu0.21 Ga0.05 La0.198 Ni0.74 O4.152 Pr1.802 -","- Cu0.21 Ga0.05 La0.198 Ni0.74 O4.152 Pr1.802 -","- Cu0.42 Ga0.1 La0.396 Ni1.48 O8.304 Pr3.604 -","2","0.0625","","Masatomo Yashima; Nuansaeng Sirikanda; Tatsumi Ishihara","Crystal Structure, Diffusion Path, and Oxygen Permeability of a Pr2NiO4- Based Mixed Conductor (Pr0.9La0.1)2(Ni0.74Cu0.21Ga0.05)O4+δ","Journal of the American Chemical Society","2010","132","","2385","2392","10.1021/ja909820h","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101924","39.112","0.003","18.9019","0.0012","27.3436","0.0018","90","","114.308","0.001","90","","18423","2","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C88 H16 Cu2 F40 N8 O2 -","- C88 H16 Cu2 F40 N8 O2 -","- C704 H128 Cu16 F320 N64 O16 -","8","1","","Shohei Saito; Ko Furukawa; Atsuhiro Osuka","Fully π-Conjugated Helices from Oxidative Cleavage of meso-Aryl-Substituted Expanded Porphyrins","Journal of the American Chemical Society","2010","132","","2128","2129","10.1021/ja909929s","","","0.71073","MoKα","","0.0779","0.0555","","","0.1429","0.1528","","","","","","0.972","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101925","14.78","0.005","15.482","0.005","20.108","0.005","97.239","0.005","95.604","0.005","117.085","0.005","4001","2","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C80 H20 Cl3 Cu2 F35 N7 O2 -","- C80 H20 Cl3 Cu2 F35 N7 O2 -","- C160 H40 Cl6 Cu4 F70 N14 O4 -","2","1","","Shohei Saito; Ko Furukawa; Atsuhiro Osuka","Fully π-Conjugated Helices from Oxidative Cleavage of meso-Aryl-Substituted Expanded Porphyrins","Journal of the American Chemical Society","2010","132","","2128","2129","10.1021/ja909929s","","","0.71069","MoKα","","0.1267","0.0856","","","0.2262","0.2429","","","","","","1.087","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101926","7.4212","0.0002","9.9724","0.0003","23.8171","0.0006","90","","90","","90","","1762.64","0.08","298.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 Fe O P -","- C20 H23 Fe O P -","- C80 H92 Fe4 O4 P4 -","4","1","","Masamichi Ogasawara; Susumu Watanabe; Kiyohiko Nakajima; Tamotsu Takahashi","Enantioselective Synthesis of Planar-Chiral Phosphaferrocenes by Molybdenum-Catalyzed Asymmetric Interannular Ring-Closing Metathesis","Journal of the American Chemical Society","2010","132","","2136","2137","10.1021/ja910348z","","","0.71075","MoKα","","","0.0529","","","","0.0503","","","","","","0.995","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101927","10.342","0.0008","13.7425","0.0011","15.7297","0.0013","83.491","0.001","81.063","0.001","68.663","0.001","2053.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H63 N4 Nb O3 -","- C42 H63 N4 Nb O3 -","- C84 H126 N8 Nb2 O6 -","2","1","","Jared S. Silvia; Christopher C. Cummins","Ligand-Based Reduction of CO2 to CO Mediated by an Anionic Niobium Nitride Complex","Journal of the American Chemical Society","2010","132","","2169","2171","10.1021/ja910445r","","","0.71073","MoKα","","0.0515","0.037","","","0.0793","0.0861","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101928","15.8479","0.0017","19.368","0.002","20.954","0.002","90","","107.012","0.002","90","","6150.2","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H94 N4 Na Nb O10 -","- C60 H94 N4 Na Nb O10 -","- C240 H376 N16 Na4 Nb4 O40 -","4","1","","Jared S. Silvia; Christopher C. Cummins","Ligand-Based Reduction of CO2 to CO Mediated by an Anionic Niobium Nitride Complex","Journal of the American Chemical Society","2010","132","","2169","2171","10.1021/ja910445r","","","0.71073","MoKα","","0.0916","0.0429","","","0.0865","0.1058","","","","","","1.002","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101929","19.4174","0.0015","12.2901","0.001","16.7769","0.0013","90","","96.863","0.002","90","","3975","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H61 N4 Nb O3.5 -","- C41 H61 N4 Nb O3.5 -","- C164 H244 N16 Nb4 O14 -","4","1","","Jared S. Silvia; Christopher C. Cummins","Ligand-Based Reduction of CO2 to CO Mediated by an Anionic Niobium Nitride Complex","Journal of the American Chemical Society","2010","132","","2169","2171","10.1021/ja910445r","","","0.71073","MoKα","","0.0696","0.0424","","","0.0907","0.1037","","","","","","1.022","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101930","24.8859","0.0014","24.8859","0.0014","15.1743","0.0017","90","","90","","90","","9397.6","1.3","173","2","173","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C37.5 H41.5 N4.5 O12.5 Zn3 -","- C37.5 H38 N4.5 O12.5 Zn3 -","- C300 H304 N36 O100 Zn24 -","8","1","","Ming-Hua Zeng; Qiang-Xin Wang; Yan-Xi Tan; Sheng Hu; Hai-Xia Zhao; La-Sheng Long; Mohamedally Kurmoo","Rigid Pillars and Double Walls in a Porous Metal-Organic Framework: Single-Crystal to Single-Crystal, Controlled Uptake and Release of Iodine and Electrical Conductivity","Journal of the American Chemical Society","2010","132","","2561","2563","10.1021/ja908293n","","","0.71073","MoKα","","0.0886","0.0468","","","0.1126","0.1437","","","","","","1.138","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101931","17.6776","0.001","17.6776","0.001","15.133","0.0018","90","","90","","90","","4729","0.7","173","2","173","2","","","","","","","","5","P -4 c 2","P -4 -2c","116","","","","- C30 H24 N2 O10 Zn3 -","- C30 H24 N2 O10 Zn3 -","- C120 H96 N8 O40 Zn12 -","4","0.5","","Ming-Hua Zeng; Qiang-Xin Wang; Yan-Xi Tan; Sheng Hu; Hai-Xia Zhao; La-Sheng Long; Mohamedally Kurmoo","Rigid Pillars and Double Walls in a Porous Metal-Organic Framework: Single-Crystal to Single-Crystal, Controlled Uptake and Release of Iodine and Electrical Conductivity","Journal of the American Chemical Society","2010","132","","2561","2563","10.1021/ja908293n","","","0.71073","MoKα","","0.0499","0.0422","","","0.1363","0.1455","","","","","","1.125","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101932","9.6137","0.0019","9.816","0.002","12.382","0.003","72.737","0.004","67.724","0.003","70.553","0.004","999.9","0.4","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H18 Cl2 O4 S -","- C21 H18 Cl2 O4 S -","- C42 H36 Cl4 O8 S2 -","2","1","","Jarrod W. Johnson; Michael Gretes; Valerie J. Goodfellow; Laura Marrone; Miriam L. Heynen; Natalie C. J. Strynadka; Gary I. Dmitrienko","Cyclobutanone Analogues of β-Lactams Revisited: Insights into Conformational Requirements for Inhibition of Serine- and Metallo-β-Lactamases","Journal of the American Chemical Society","2010","132","","2558","2560","10.1021/ja9086374","","","0.71073","MoKα","","0.0393","0.0361","","","0.0881","0.09","","","","","","1.243","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101933","7.6143","0.0004","7.8046","0.0004","9.7974","0.0005","81.357","0.001","86.361","0.001","72.665","0.001","549.36","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H8 Cl2 O4 S -","- C8 H8 Cl2 O4 S -","- C16 H16 Cl4 O8 S2 -","2","1","","Jarrod W. Johnson; Michael Gretes; Valerie J. Goodfellow; Laura Marrone; Miriam L. Heynen; Natalie C. J. Strynadka; Gary I. Dmitrienko","Cyclobutanone Analogues of β-Lactams Revisited: Insights into Conformational Requirements for Inhibition of Serine- and Metallo-β-Lactamases","Journal of the American Chemical Society","2010","132","","2558","2560","10.1021/ja9086374","","","0.71073","MoKα","","0.0472","0.0408","","","0.094","0.0982","","","","","","1.181","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101934","12.0074","0.0017","9.2141","0.0013","10.8132","0.0016","90","","112.413","0.002","90","","1106","0.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 Cl2 O4 S -","- C8 H8 Cl2 O4 S -","- C32 H32 Cl8 O16 S4 -","4","1","","Jarrod W. Johnson; Michael Gretes; Valerie J. Goodfellow; Laura Marrone; Miriam L. Heynen; Natalie C. J. Strynadka; Gary I. Dmitrienko","Cyclobutanone Analogues of β-Lactams Revisited: Insights into Conformational Requirements for Inhibition of Serine- and Metallo-β-Lactamases","Journal of the American Chemical Society","2010","132","","2558","2560","10.1021/ja9086374","","","0.71073","MoKα","","0.0621","0.0414","","","0.0736","0.0819","","","","","","1.165","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101935","7.464","0.003","10.568","0.004","11.51","0.004","90","","101.187","0.005","90","","890.7","0.6","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H4 Cl2 O3 S -","- C7 H4 Cl2 O3 S -","- C28 H16 Cl8 O12 S4 -","4","1","","Jarrod W. Johnson; Michael Gretes; Valerie J. Goodfellow; Laura Marrone; Miriam L. Heynen; Natalie C. J. Strynadka; Gary I. Dmitrienko","Cyclobutanone Analogues of β-Lactams Revisited: Insights into Conformational Requirements for Inhibition of Serine- and Metallo-β-Lactamases","Journal of the American Chemical Society","2010","132","","2558","2560","10.1021/ja9086374","","","0.71073","MoKα","","0.0352","0.0316","","","0.0982","0.1012","","","","","","1.319","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101936","10.0564","0.0004","9.5585","0.0004","17.2269","0.0007","90","","98.8441","0.0018","90","","1636.23","0.12","15","2","15","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0671","0.0482","","","0.1319","0.1493","","","","","","1.071","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101937","10.0768","0.0004","9.5915","0.0004","17.2589","0.0006","90","","98.9481","0.0004","90","","1647.8","0.11","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0557","0.0465","","","0.1304","0.1385","","","","","","1.064","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101938","10.085","0.0003","9.592","0.0003","17.2635","0.0005","90","","98.9476","0.0004","90","","1649.67","0.09","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0563","0.0468","","","0.1311","0.1392","","","","","","1.066","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101939","10.0893","0.0004","19.1848","0.0007","17.2652","0.0006","90","","98.9288","0.0006","90","","3301.4","0.2","115","2","115","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C192 H128 B4 N8 O8 -","4","1","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.1023","0.0794","","","0.2356","0.2682","","","","","","1.082","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101940","10.0928","0.0004","19.1906","0.0007","17.2656","0.0006","90","","98.9185","0.0006","90","","3303.7","0.2","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C192 H128 B4 N8 O8 -","4","1","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0908","0.0688","","","0.2053","0.2319","","","","","","1.069","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101941","10.0971","0.0003","19.2119","0.0006","17.2693","0.0006","90","","98.9174","0.0005","90","","3309.48","0.18","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C192 H128 B4 N8 O8 -","4","1","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0822","0.0606","","","0.1788","0.2007","","","","","","1.059","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101942","10.0955","0.0003","19.2247","0.0006","17.2688","0.0006","90","","98.9312","0.0005","90","","3310.94","0.18","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C192 H128 B4 N8 O8 -","4","1","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0763","0.0596","","","0.1705","0.1911","","","","","","1.037","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101943","10.0904","0.0003","19.262","0.0006","17.2721","0.0005","90","","98.9678","0.0005","90","","3315.99","0.17","165","2","165","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C192 H128 B4 N8 O8 -","4","1","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0871","0.0595","","","0.1745","0.2013","","","","","","1.05","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101944","10.0865","0.0003","9.6443","0.0003","17.2734","0.0005","90","","98.9999","0.0005","90","","1659.62","0.09","175","2","175","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.057","0.0457","","","0.132","0.1418","","","","","","1.086","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101945","10.0856","0.0003","9.6576","0.0003","17.2759","0.0005","90","","99.0203","0.0004","90","","1661.91","0.09","185","2","185","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0566","0.0452","","","0.128","0.1374","","","","","","1.086","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101946","10.0785","0.0004","9.6735","0.0004","17.2616","0.0007","90","","99.0046","0.0007","90","","1662.17","0.12","200","2","200","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0613","0.0466","","","0.1291","0.1397","","","","","","1.087","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101947","10.0913","0.0005","9.7249","0.0005","17.2789","0.0008","90","","99.1054","0.0008","90","","1674.33","0.14","250","2","250","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0602","0.0454","","","0.1293","0.1411","","","","","","1.089","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101948","10.0982","0.001","9.7433","0.001","17.2806","0.0017","90","","99.1317","0.0016","90","","1678.7","0.3","270","2","270","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0605","0.0449","","","0.1271","0.1401","","","","","","1.065","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101949","10.096","0.002","9.766","0.002","17.292","0.004","90","","99.234","0.003","90","","1682.9","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C48 H32 B N2 O2 -","- C48 H32 B N2 O2 -","- C96 H64 B2 N4 O4 -","2","0.5","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.0591","0.0461","","","0.135","0.1481","","","","","","1.073","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101950","26.407","0.004","18.084","0.003","24.867","0.004","90","","113.731","0.008","90","","10871","3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C72.6 H53.2 B2 Cl1.2 N2 O2 -","- C72.6 H53.2 B2 Cl1.2 N2 O2 -","- C580.8 H425.6 B16 Cl9.6 N16 O16 -","8","1","","Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon","Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical","Journal of the American Chemical Society","2010","132","","2684","2694","10.1021/ja908768a","","","0.71073","MoKα","","0.071","0.0547","","","0.1492","0.1631","","","","","","1.049","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101951","9.534","0.0009","11.8513","0.0012","41.303","0.004","90","","93.213","0.002","90","","4659.5","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C55 H56 O4 Zr -","- C52 H56 O4 Zr -","- C208 H224 O16 Zr4 -","4","1","","Yuetao Zhang; Yalan Ning; Lucia Caporaso; Luigi Cavallo; Eugene Y.-X. Chen","Catalyst-Site-Controlled Coordination Polymerization of Polar Vinyl Monomers to Highly Syndiotactic Polymers","Journal of the American Chemical Society","2010","132","","2695","2709","10.1021/ja908818y","","","0.71073","MoKα","","0.1076","0.0555","","","0.1279","0.1517","","","","","","0.986","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101952","10.831","0.0004","12.479","0.0004","14.1278","0.0005","90.664","0.002","111.403","0.002","113.539","0.002","1601.97","0.11","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H44 O4 Si Zr -","- C34 H44 O4 Si Zr -","- C68 H88 O8 Si2 Zr2 -","2","1","","Yuetao Zhang; Yalan Ning; Lucia Caporaso; Luigi Cavallo; Eugene Y.-X. Chen","Catalyst-Site-Controlled Coordination Polymerization of Polar Vinyl Monomers to Highly Syndiotactic Polymers","Journal of the American Chemical Society","2010","132","","2695","2709","10.1021/ja908818y","","","0.71073","MoKα","","0.0383","0.0299","","","0.0737","0.078","","","","","","1.03","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101953","21.9236","","21.9236","","10.0361","","90","","90","","120","","4177.53","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C10 H14 O -","- C10 H14 O -","- C180 H252 O18 -","18","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101954","20.0129","","20.0129","","11.9485","","90","","90","","120","","4144.42","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C10 H14 O -","- C10 H14 O -","- C180 H252 O18 -","18","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101955","14.6614","","14.6614","","22.7128","","90","","90","","120","","4228.17","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C10 H14 O -","- C10 H14 O -","- C180 H252 O18 -","18","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101956","21.1499","","21.1499","","10.9707","","90","","90","","120","","4249.93","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C10 H14 O -","- C10 H14 O -","- C180 H252 O18 -","18","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101957","8.3762","","5.1455","","21.9095","","90","","109.281","","90","","891.327","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101958","23.4015","","23.4015","","9.2166","","90","","90","","120","","4371.08","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C10 H14 O -","- C10 H14 O -","- C180 H252 O18 -","18","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101959","17.1461","","5.0284","","11.0202","","90","","109.469","","90","","895.808","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101960","4.5362","","12.2286","","16.2915","","90","","90","","90","","903.712","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101961","22.7159","","22.7159","","9.2069","","90","","90","","120","","4114.38","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C10 H14 O -","- C10 H14 O -","- C180 H252 O18 -","18","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101962","23.2015","","8.6198","","4.5444","","90","","90","","90","","908.845","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101963","12.1203","","16.1584","","4.6365","","90","","90","","90","","908.034","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101964","17.8291","","4.5894","","24.0942","","90","","69.6837","","90","","1848.86","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 O -","- C10 H14 O -","- C80 H112 O8 -","8","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101965","17.1957","","4.6403","","12.03","","90","","109.939","","90","","902.369","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101966","22.8234","","4.7105","","17.6462","","90","","73.2208","","90","","1816.36","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- C10 H14 O -","- C10 H14 O -","- C80 H112 O8 -","8","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101967","26.4489","","4.6486","","16.7492","","90","","116.586","","90","","1841.57","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 O -","- C10 H14 O -","- C80 H112 O8 -","8","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101968","19.9525","","4.5351","","11.0565","","90","","68.2256","","90","","929.083","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101969","24.2387","","4.6525","","18.1098","","90","","115.793","","90","","1838.79","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- C10 H14 O -","- C10 H14 O -","- C80 H112 O8 -","8","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101970","24.4512","","4.6442","","16.7109","","90","","105.874","","90","","1825.26","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 O -","- C10 H14 O -","- C80 H112 O8 -","8","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101971","12.5972","","4.7007","","16.3407","","90","","109.644","","90","","911.31","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","","Elodie Salager; Graeme M. Day; Robin S. Stein; Chris J. Pickard; Bénédicte Elena; Lyndon Emsley","Powder Crystallography by Combined Crystal Structure Prediction and High-Resolution 1H Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2010","132","","2564","2566","10.1021/ja909449k","","","","","","","","","","","","","","","","","","","","","has coordinates","209425","2020-10-21","18:00:00","" "4101972","26.465","0.005","15.938","0.003","17.596","0.003","90","","100.824","0.002","90","","7290","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30.5 H47 Cl6 N2 P Ru -","- C30.5 H47 Cl6 N2 P Ru -","- C244 H376 Cl48 N16 P8 Ru8 -","8","1","","Erin M. Leitao; Edwin F. van der Eide; Patricio E. Romero; Warren, E. Piers; Robert McDonald","Kinetic and Thermodynamic Analysis of Processes Relevant to Initiation of Olefin Metathesis by Ruthenium Phosphonium Alkylidene Catalysts","Journal of the American Chemical Society","2010","132","","2784","2794","10.1021/ja910112m","","","0.71073","MoKα","","0.051","0.0429","","","0.1155","0.1215","","","","","","1.071","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101973","14.2155","0.0018","21.905","0.003","16.828","0.002","90","","105.471","0.002","90","","5050.2","1.1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H55 Cl12 N2 P Ru -","- C36 H53 Cl6 N2 P Ru -","- C144 H212 Cl24 N8 P4 Ru4 -","4","1","","Erin M. Leitao; Edwin F. van der Eide; Patricio E. Romero; Warren, E. Piers; Robert McDonald","Kinetic and Thermodynamic Analysis of Processes Relevant to Initiation of Olefin Metathesis by Ruthenium Phosphonium Alkylidene Catalysts","Journal of the American Chemical Society","2010","132","","2784","2794","10.1021/ja910112m","","","0.71073","MoKα","","0.0669","0.0493","","","0.131","0.1397","","","","","","1.036","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101974","10.4582","0.0007","11.9788","0.0008","12.9774","0.0008","91.148","0.001","97.368","0.001","111.967","0.001","1491.19","0.17","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H31 Cl2 Mn N7 O8 -","- C23 H31 Cl2 Mn N7 O8 -","- C46 H62 Cl4 Mn2 N14 O16 -","2","1","","Robert A. Geiger; Swarup Chattopadhyay; Victor W. Day; Timothy A. Jackson","A Series of Peroxomanganese(III) Complexes Supported by Tetradentate Aminopyridyl Ligands: Detailed Spectroscopic and Computational Studies","Journal of the American Chemical Society","2010","132","","2821","2831","10.1021/ja910235g","","","0.71073","MoKα","","0.0649","0.0467","","","0.106","0.1123","","","","","","1.019","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101975","9.8008","0.0005","17.9804","0.001","15.157","0.0008","90","","96.511","0.001","90","","2653.8","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Br2 Cl2 Mn N4 O9 -","- C20 H26 Br2 Cl2 Mn N4 O9 -","- C80 H104 Br8 Cl8 Mn4 N16 O36 -","4","1","","Robert A. Geiger; Swarup Chattopadhyay; Victor W. Day; Timothy A. Jackson","A Series of Peroxomanganese(III) Complexes Supported by Tetradentate Aminopyridyl Ligands: Detailed Spectroscopic and Computational Studies","Journal of the American Chemical Society","2010","132","","2821","2831","10.1021/ja910235g","","","0.71073","MoKα","","0.0603","0.0402","","","0.0854","0.0908","","","","","","1.017","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101976","18.169","0.002","9.8793","0.0013","14.5449","0.0019","90","","104.277","0.002","90","","2530.1","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H29 Cl2 Mn N5 O8 -","- C21 H29 Cl2 Mn N5 O8 -","- C84 H116 Cl8 Mn4 N20 O32 -","4","1","","Robert A. Geiger; Swarup Chattopadhyay; Victor W. Day; Timothy A. Jackson","A Series of Peroxomanganese(III) Complexes Supported by Tetradentate Aminopyridyl Ligands: Detailed Spectroscopic and Computational Studies","Journal of the American Chemical Society","2010","132","","2821","2831","10.1021/ja910235g","","","0.71073","MoKα","","0.0617","0.0479","","","0.1004","0.1065","","","","","","1.043","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101977","13.6307","0.0012","10.7548","0.001","17.2017","0.0016","90","","109.022","0.001","90","","2384","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H28 Cl2 Mn N4 O10 -","- C19 H28 Cl2 Mn N4 O10 -","- C76 H112 Cl8 Mn4 N16 O40 -","4","0.5","","Robert A. Geiger; Swarup Chattopadhyay; Victor W. Day; Timothy A. Jackson","A Series of Peroxomanganese(III) Complexes Supported by Tetradentate Aminopyridyl Ligands: Detailed Spectroscopic and Computational Studies","Journal of the American Chemical Society","2010","132","","2821","2831","10.1021/ja910235g","","","0.71073","MoKα","","0.0538","0.0532","","","0.1254","0.1258","","","","","","1.107","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101978","8.0826","0.0017","8.2727","0.0017","11.499","0.002","93.787","0.002","96.492","0.002","91.748","0.002","761.7","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H23 N O2 S -","- C17 H23 N O2 S -","- C34 H46 N2 O4 S2 -","2","1","","Michal Szostak; Jeffrey Aubé","Synthesis, Structural Analysis, and Reactivity of Bridged Orthoamides by Intramolecular Schmidt Reaction","Journal of the American Chemical Society","2010","132","","2530","2531","10.1021/ja910654t","","","0.71073","MoKα","","0.0578","0.0503","","","0.1251","0.1312","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00","" "4101979","6.596","0.011","13.08","0.02","11.167","0.018","90","","101.73","0.02","90","","943","3","94","2","94","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H5 Cl N2 O4 -","- C9 H5 Cl N2 O4 -","- C36 H20 Cl4 N8 O16 -","4","1","","Chambers C. Hughes; William Fenical","Total Synthesis of the Ammosamides","Journal of the American Chemical Society","2010","132","","2528","2529","10.1021/ja9106572","","","0.71073","MoKα","","0.0484","0.0377","","","0.0952","0.1029","","","","","","1.052","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101980","5.4308","0.0009","15.24","0.003","12.964","0.002","90","","98.362","0.003","90","","1061.6","0.3","223.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H23 Br O7 -","- C23 H23 Br O7 -","- C46 H46 Br2 O14 -","2","1","","Christina M. Woo; Liang Lu; Shivajirao L. Gholap; Devin R. Smith; Seth B. Herzon","Development of a Convergent Entry to the Diazofluorene Antitumor Antibiotics: Enantioselective Synthesis of Kinamycin F","Journal of the American Chemical Society","2010","132","","2540","2541","10.1021/ja910769j","","","0.71075","MoKα","","","0.049","","","","0.1152","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00","" "4101981","12.2291","0.0001","13.0394","0.0002","16.4212","0.0003","94.7085","0.0008","106.87","0.0006","104.595","0.0006","2390.68","0.06","103","2","103","","","","","","","","","4","P -1","-P 1","2","","","","- C74 H162 O2 Si16 -","- C74 H162 O2 Si16 -","- C74 H162 O2 Si16 -","1","0.5","","Joon Soo Han; Takahiro Sasamori; Yoshiyuki Mizuhata; Norihiro Tokitoh","Reactivity of an Aryl-Substituted Silicon-Silicon Triple Bond: Reactions of a 1,2-Diaryldisilyne with Alkenes","Journal of the American Chemical Society","2010","132","","2546","2547","10.1021/ja9108566","","","0.71075","MoKα","","0.0388","0.0358","","","0.0965","0.0994","","","","","","1.02","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4101982","12.9267","0.0001","12.9267","0.0001","52.8783","0.0005","90","","90","","90","","8835.94","0.13","103","2","103","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C66 H144 Si16 -","- C66 H144 Si16 -","- C264 H576 Si64 -","4","0.5","","Joon Soo Han; Takahiro Sasamori; Yoshiyuki Mizuhata; Norihiro Tokitoh","Reactivity of an Aryl-Substituted Silicon-Silicon Triple Bond: Reactions of a 1,2-Diaryldisilyne with Alkenes","Journal of the American Chemical Society","2010","132","","2546","2547","10.1021/ja9108566","","","0.71069","MoKα","","0.0444","0.0436","","","0.1115","0.1121","","","","","","1.217","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4101983","12.4662","0.0002","20.0362","0.0003","20.7134","0.0004","107.94","0.0008","104.952","0.0008","98.7788","0.0007","4601.42","0.14","103","2","103","2","","","","","","","","3","P -1","-P 1","2","","","","- C72 H158 Si16 -","- C72 H158 Si16 -","- C144 H316 Si32 -","2","1","","Joon Soo Han; Takahiro Sasamori; Yoshiyuki Mizuhata; Norihiro Tokitoh","Reactivity of an Aryl-Substituted Silicon-Silicon Triple Bond: Reactions of a 1,2-Diaryldisilyne with Alkenes","Journal of the American Chemical Society","2010","132","","2546","2547","10.1021/ja9108566","","","0.71069","MoKα","","0.0699","0.0546","","","0.1472","0.158","","","","","","1.023","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4101984","20.401","0.003","12.8736","0.0018","24.692","0.003","90","","96.779","0.002","90","","6439.6","1.5","85","2","85","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C28 H32 Cl2 F8 N2 O3 Pd S -","- C28 H32 Cl2 F8 N2 O3 Pd S -","- C224 H256 Cl16 F64 N16 O24 Pd8 S8 -","8","1","","Nicholas D. Ball; Jeff W. Kampf; Melanie S. Sanford","Aryl-CF3 Bond-Forming Reductive Elimination from Palladium(IV)","Journal of the American Chemical Society","2010","132","","2878","2879","10.1021/ja100955x","","","0.71073","MoKα","","0.0921","0.0674","","","0.1202","0.1274","","","","","","1.159","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101985","24.61","0.002","11.1558","0.0009","22.8484","0.0019","90","","111.649","0.001","90","","5830.4","0.8","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H40 Co8 N2 O26 Pt4 -","- C42 H40 Co8 N2 O26 Pt3.9986 -","- C168 H160 Co32 N8 O104 Pt15.9944 -","4","0.5","","Cristina Femoni; Maria Carmela Iapalucci; Giuliano Longoni; Joanna Wolowska; Stefano Zacchini; Piero Zanello; Serena Fedi; Mauro Riccò; Daniele Pontiroli; Marcello Mazzani","Magnetic Behavior of Odd- and Even-Electron Metal Carbonyl Clusters: The Case Study of [Co8Pt4C2(CO)24]n- (n = 1, 2) Carbide Cluster","Journal of the American Chemical Society","2010","132","","2919","2927","10.1021/ja907608c","","","0.71073","MoKα","","0.0524","0.0431","","","0.1121","0.1192","","","","","","1.03","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101986","19.0519","0.0013","11.716","0.0008","11.4645","0.0008","90","","104.814","0.001","90","","2474","0.3","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C36 H16 Co8 N O24 Pt4 -","- C37 H16 Co8 N O24 Pt4.0014 -","- C74 H32 Co16 N2 O48 Pt8.0028 -","2","0.25","","Cristina Femoni; Maria Carmela Iapalucci; Giuliano Longoni; Joanna Wolowska; Stefano Zacchini; Piero Zanello; Serena Fedi; Mauro Riccò; Daniele Pontiroli; Marcello Mazzani","Magnetic Behavior of Odd- and Even-Electron Metal Carbonyl Clusters: The Case Study of [Co8Pt4C2(CO)24]n- (n = 1, 2) Carbide Cluster","Journal of the American Chemical Society","2010","132","","2919","2927","10.1021/ja907608c","","","0.71073","MoKα","","0.0289","0.0228","","","0.0506","0.0528","","","","","","1.056","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101987","11.1326","0.0004","30.3345","0.0011","21.2296","0.0008","90","","99.722","0.001","90","","7066.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57.5 H52 Co8 N2 O26 Pt4 -","- C57.5 H52 Co7.99 N2 O26 Pt4 -","- C230 H208 Co31.96 N8 O104 Pt16 -","4","1","","Cristina Femoni; Maria Carmela Iapalucci; Giuliano Longoni; Joanna Wolowska; Stefano Zacchini; Piero Zanello; Serena Fedi; Mauro Riccò; Daniele Pontiroli; Marcello Mazzani","Magnetic Behavior of Odd- and Even-Electron Metal Carbonyl Clusters: The Case Study of [Co8Pt4C2(CO)24]n- (n = 1, 2) Carbide Cluster","Journal of the American Chemical Society","2010","132","","2919","2927","10.1021/ja907608c","","","0.71073","MoKα","","0.1378","0.0607","","","0.1434","0.1818","","","","","","1.02","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101988","22.16888","0.00019","4.71127","0.00005","20.16462","0.00023","90","","126.403","0.0005","90","","1695.1","0.03","","","295","","","","","","","","from green tea","3","C 1 2 1","C 2y","5","catechin","(+)-catechin","","- C15 H23 O10.5 -","- C15 H15 O10.5 -","- C60 H60 O42 -","4","1","","James K. Harper; Jennifer A. Doebbler; Elisabeth Jacques; David M. Grant; Robert B. Von Dreele","A Combined Solid-State NMR and Synchrotron X-ray Diffraction Powder Study on the Structure of the Antioxidant (+)-Catechin 4.5-hydrate.","Journal of the American Chemical Society","2010","132","","2928","2937","10.1021/ja907671p","powder diffraction","x-ray","0.813386","","","","","","","","","0.2215","","1.36","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00","" "4101989","7.7377","0.0015","23.547","0.005","11.699","0.002","90","","102.15","0.03","90","","2083.8","0.7","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C26 H26 N2 O3 -","- C26 H26 N2 O3 -","- C104 H104 N8 O12 -","4","1","","Erica L. Campbell; Andrea M. Zuhl; Christopher M. Liu; Dale L. Boger","Total Synthesis of (+)-Fendleridine (Aspidoalbidine) and (+)-1-Acetylaspidoalbidine","Journal of the American Chemical Society","2010","132","","3009","3012","10.1021/ja908819q","","","0.71073","MoKα","","0.1441","0.0707","","","0.0709","0.0866","","","","","","1.001","","","","has coordinates","178765","2020-10-21","18:00:00","" "4101990","7.9428","0.0016","27.42","0.006","40.909","0.008","90","","90","","90","","8910","3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H36.67 N2 O4.33 S2 -","- C30 H35.3333 N2 O4.33333 S2 -","- C360 H424 N24 O52 S24 -","12","3","","Erica L. Campbell; Andrea M. Zuhl; Christopher M. Liu; Dale L. Boger","Total Synthesis of (+)-Fendleridine (Aspidoalbidine) and (+)-1-Acetylaspidoalbidine","Journal of the American Chemical Society","2010","132","","3009","3012","10.1021/ja908819q","","","0.71073","MoKα","","0.1836","0.099","","","0.2048","0.251","","","","","","0.994","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101991","15.727","0.003","16.547","0.003","18.515","0.004","90.84","0.03","92.62","0.03","117.68","0.03","4258.9","1.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C103.12 H153.28 Cl9.37 N20 O5.08 S20 Sn12 -","- C103.118 H151.118 Cl9.354 N20 O5.086 S20 Sn12 -","- C103.118 H151.118 Cl9.354 N20 O5.086 S20 Sn12 -","1","0.5","","Zohreh Hassanzadeh Fard; Mohammad Reza Halvagar; Stefanie Dehnen","Directed Formation of an Organotin Sulfide Cavitand and Its Transformation into a Rugby-Ball-like Capsule","Journal of the American Chemical Society","2010","132","","2848","2849","10.1021/ja908917w","","","0.71073","MoKα","","0.187","0.0749","","","0.1392","0.1691","","","","","","0.756","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101992","19.434","0.004","28.124","0.006","19.367","0.004","90","","103","0.03","90","","10314","4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C75 H114 Cl6 N15 O4.5 S8 Sn8 -","- C75 H104 Cl6 N15 O4.5 S8 Sn8 -","- C300 H416 Cl24 N60 O18 S32 Sn32 -","4","1","","Zohreh Hassanzadeh Fard; Mohammad Reza Halvagar; Stefanie Dehnen","Directed Formation of an Organotin Sulfide Cavitand and Its Transformation into a Rugby-Ball-like Capsule","Journal of the American Chemical Society","2010","132","","2848","2849","10.1021/ja908917w","","","0.71073","MoKα","","0.0524","0.0464","","","0.1119","0.1143","","","","","","1.156","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4101993","14.142","0.0007","13.4738","0.0006","19.9129","0.0009","90","","115.044","0.001","90","","3437.6","0.3","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H52 O10 Ti2 -","- C30 H52 O10 Ti2 -","- C120 H208 O40 Ti8 -","4","1","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.0462","0.0309","","","0.0779","0.0862","","","","","","1.026","","","","has coordinates","211196","2020-10-21","18:00:00","" "4101994","23.498","0.008","23.498","0.008","17.407","0.004","90","","90","","120","","8324","4","90","2","90","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C40 H32 O12 Ti2 -","- C40 H32 O12 Ti2 -","- C360 H288 O108 Ti18 -","9","0.5","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.0828","0.0448","","","0.1158","0.1313","","","","","","1.349","","","","has coordinates","270822","2021-11-23","08:35:17","" "4101995","11.7389","0.0019","12.886","0.002","18.312","0.002","94.758","0.004","90.202","0.005","116.344","0.004","2471.3","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H61 N3 O14 Ti3 -","- C39 H61 N3 O14 Ti3 -","- C78 H122 N6 O28 Ti6 -","2","1","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.0715","0.0465","","","0.1378","0.1621","","","","","","1.001","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101996","11.8121","0.0015","19.17","0.002","20.403","0.004","90","","94.052","0.006","90","","4608.5","1.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H58 N2 O16 Ti4 -","- C32 H58 N2 O16 Ti4 -","- C128 H232 N8 O64 Ti16 -","4","0.5","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.0858","0.0497","","","0.1149","0.1471","","","","","","1.064","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101997","29.6492","0.0016","29.6492","0.0016","26.4727","0.0015","90","","90","","120","","20153.7","1.9","90","2","90","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C68 H82 N6 O24 Ti6 -","- C68 H82 N6 O24 Ti6 -","- C612 H738 N54 O216 Ti54 -","9","0.5","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.0808","0.0511","","","0.1491","0.1794","","","","","","1.126","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101998","13.665","0.0017","15.023","0.003","23.14","0.005","89.508","0.006","74.253","0.006","64.397","0.005","4090.7","1.3","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C73 H102 O23 Ti6 -","- C73 H102 O23 Ti6 -","- C146 H204 O46 Ti12 -","2","1","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.131","0.0498","","","0.1236","0.1721","","","","","","1.047","","","","has coordinates,has disorder","178765","2020-10-21","18:00:00","" "4101999","15.899","0.003","23.957","0.006","32.134","0.009","99.821","0.005","98.285","0.005","104.358","0.01","11459","5","90","2","90","2","","","","","","","","3","P -1","-P 1","2","","","","- C84 O48 Ti17 -","- C84 O48 Ti17 -","- C336 O192 Ti68 -","4","2","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.2354","0.0849","","","0.2307","0.3272","","","","","","0.997","","","","has coordinates","178765","2020-10-21","18:00:00","" "4102000","27.8184","0.0009","27.8184","0.0009","13.4328","0.0004","90","","90","","90","","10395.2","0.6","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C72 H128 N4 O48 Ti17 -","- C72 H128 N4 O48 Ti17 -","- C288 H512 N16 O192 Ti68 -","4","0.25","","Jason B. Benedict; Philip Coppens","The Crystalline Nanocluster Phase as a Medium for Structural and Spectroscopic Studies of Light Absorption of Photosensitizer Dyes on Semiconductor Surfaces","Journal of the American Chemical Society","2010","132","","2938","2944","10.1021/ja909600w","","","0.71073","MoKα","","0.1176","0.0757","","","0.2077","0.2579","","","","","","1.142","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102001","11.5552","0.001","10.8939","0.001","16.3676","0.0014","90","","97.288","0.002","90","","2043.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 F N O4 S2 -","- C21 H20 F N O4 S2 -","- C84 H80 F4 N4 O16 S8 -","4","1","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.0666","0.0493","","","0.1259","0.1352","","","","","","1.029","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102002","8.353","0.004","12.674","0.007","9.879","0.005","90","","108.004","0.01","90","","994.6","0.9","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H18 F N O4 S2 -","- C21 H18 F N O4 S2 -","- C42 H36 F2 N2 O8 S4 -","2","1","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.1524","0.1248","","","0.2978","0.323","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102003","17.108","0.004","8.685","0.002","27.413","0.006","90","","96.397","0.005","90","","4047.7","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 F N O4 S2 -","- C22 H20 F N O4 S2 -","- C176 H160 F8 N8 O32 S16 -","8","2","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.106","0.0526","","","0.1017","0.115","","","","","","0.814","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102004","13.417","0.0011","17.6111","0.0014","8.6693","0.0007","90","","90","","90","","2048.5","0.3","293","2","293","2","","","","","","","","6","P b a 2","P 2 -2ab","32","","","","- C22 H20 F N O4 S2 -","- C22 H20 F N O4 S2 -","- C88 H80 F4 N4 O16 S8 -","4","1","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.047","0.0426","","","0.0992","0.1015","","","","","","0.99","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102005","14.7686","0.0012","7.8219","0.0006","17.1905","0.0014","90","","100.447","0.002","90","","1952.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 F2 N O4 S2 -","- C20 H17 F2 N O4 S2 -","- C80 H68 F8 N4 O16 S8 -","4","1","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.0494","0.0425","","","0.1142","0.1184","","","","","","1.037","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102006","8.6167","0.0014","10.7071","0.0017","12.271","0.002","78.669","0.003","84.33","0.003","66.61","0.002","1018.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H20 F N O4 S2 -","- C21 H20 F N O4 S2 -","- C42 H40 F2 N2 O8 S4 -","2","1","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.0498","0.0435","","","0.1207","0.1254","","","","","","1.034","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102007","8.3529","0.001","9.3193","0.0011","13.692","0.0017","105.759","0.002","94.136","0.002","102.117","0.002","993.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H18 F N O4 S2 -","- C21 H18 F N O4 S2 -","- C42 H36 F2 N2 O8 S4 -","2","1","","Shuifa Qiu; Tao Xu; Juan Zhou; Yinlong Guo; Guosheng Liu","Palladium-Catalyzed Intermolecular Aminofluorination of Styrenes","Journal of the American Chemical Society","2010","132","","2856","2857","10.1021/ja909716k","","","0.71073","MoKα","","0.0558","0.0456","","","0.1153","0.1211","","","","","","0.975","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102008","30.357","0.002","22.0294","0.0016","38.924","0.004","90","","104.353","0.002","90","","25218","4","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C104 H28 F64 N8 O16 -","- C104 H28 F64 N8 O16 -","- C832 H224 F512 N64 O128 -","8","1","","Jong Min Lim; Jae-Yoon Shin; Yasuo Tanaka; Shohei Saito; Atsuhiro Osuka; Dongho Kim","Protonated [4n]π and [4n+2]π Octaphyrins Choose Their Möbius/Hückel Aromatic Topology","Journal of the American Chemical Society","2010","132","","3105","3114","10.1021/ja909744z","","","0.71073","MoKα","","0.139","0.0939","","","0.2698","0.2905","","","","","","1.062","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102009","34.518","0.005","25.907","0.004","15.38","0.002","90","","108.491","0.003","90","","13044","3","90","2","90","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C92 H24 F46 N8 O5 -","- C92 H24 F46 N8 O5 -","- C368 H96 F184 N32 O20 -","4","0.5","","Jong Min Lim; Jae-Yoon Shin; Yasuo Tanaka; Shohei Saito; Atsuhiro Osuka; Dongho Kim","Protonated [4n]π and [4n+2]π Octaphyrins Choose Their Möbius/Hückel Aromatic Topology","Journal of the American Chemical Society","2010","132","","3105","3114","10.1021/ja909744z","","","0.71073","MoKα","","0.1243","0.0725","","","0.1916","0.2108","","","","","","0.861","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102010","28.184","0.004","11.7485","0.0011","21.651","0.003","90","","97.261","0.018","90","","7111.6","1.6","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dilithium[(μ-1,4-butadiyne)bis(tricarbonyl{1,2-bis(diphenylphosphino)ethane}tungsten)]","","- C78 H80 Li2 O10 P4 W2 -","- C78 H80 Li2 O10 P4 W2 -","- C312 H320 Li8 O40 P16 W8 -","4","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.0591","0.0326","","","0.0658","0.071","","","","","","0.872","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102011","24.5678","0.0002","13.6187","0.0001","20.6625","0.0001","90","","92.2971","0.0006","90","","6907.73","0.08","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","[(μ-but-2-yn-1,4-diylidyne)bis(dicarbonyl{1,2-bis(diphenylphosphino)ethane}iodotungsten)]","","- C62 H52 Cl4 I2 O4 P4 W2 -","- C62 H52 Cl4 I2 O4 P4 W2 -","- C248 H208 Cl16 I8 O16 P16 W8 -","4","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.0388","0.0246","","","0.0809","0.0857","","","","","","1.108","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102012","9.5159","0.0002","9.9084","0.0002","18.0985","0.0003","79.654","0.002","84.718","0.002","75.752","0.002","1625.03","0.06","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","[tricarbonyl(1,2-bis{diphenylphosphino}ethane)-2-phenylethynyltungsten)]","","- C37 H29 I O3 P2 W -","- C37 H29 I O3 P2 W -","- C74 H58 I2 O6 P4 W2 -","2","1","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.0233","0.0194","","","0.0446","0.0452","","","","","","1.026","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102013","11.6313","0.0005","8.9452","0.0004","27.3906","0.001","90","","94.231","0.004","90","","2842.1","0.2","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[(μ-2,3-dimethylbut-2-en-1,4-diylidyne)bis(dicarbonyl{1,2-bis(diphenylphosphino)ethane}iodotungsten)]","","- C62 H54 I2 O4 P4 W2 -","- C62 H54 I2 O4 P4 W2 -","- C124 H108 I4 O8 P8 W4 -","2","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.1029","0.0505","","","0.1203","0.1564","","","","","","0.986","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102014","19.357","0.003","11.0318","0.001","30.138","0.004","90","","107.685","0.014","90","","6131.6","1.4","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","[(μ-2,3-dimethylbut-2-en-1,4-diylidyne)bis(dicarbonyl{1,2-bis(diphenylphosphino)ethane}chlorotungsten)]","","- C64 H57 Cl2 N O4 P4 W2 -","- C64 H57 Cl2 N O4 P4 W2 -","- C256 H228 Cl8 N4 O16 P16 W8 -","4","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.0438","0.0388","","","0.1022","0.1052","","","","","","1.057","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102015","24.9296","0.0002","12.9619","0.0002","20.4535","0.0002","90","","92.7816","0.001","90","","6601.45","0.13","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[(μ-but-2-yn-1,4-diylidyne)bis(dicarbonyl{1,2-bis(diphenylphosphino)ethane} chlorotungsten)]","","- C66 H54 Cl2 O4 P4 W2 -","- C66 H54 Cl2 O4 P4 W2 -","- C264 H216 Cl8 O16 P16 W8 -","4","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.044","0.0288","","","0.0804","0.0849","","","","","","1.038","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102016","13.1172","0.0002","13.7047","0.0003","22.2271","0.0005","103.552","0.002","92.316","0.002","116.301","0.002","3434.31","0.14","183","2","183","2","","","","","","","","7","P -1","-P 1","2","","[(μ-but-2-yn-1,4-diylidyne)bis(dicarbonyl{1,2-bis(diphenylphosphino)ethane}isothiocyanatetungsten)]","","- C73 H66 N2 O4 P4 S2 W2 -","- C73 H66 N2 O4 P4 S2 W2 -","- C146 H132 N4 O8 P8 S4 W4 -","2","1","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.0849","0.0404","","","0.0804","0.0928","","","","","","0.951","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102017","34.7541","0.0003","13.2842","0.0001","20.1653","0.0002","90","","96.467","0.001","90","","9250.68","0.14","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[(μ-but-2-yn-1,4-diylidyne)bis(di{1,2-bis(diphenylphosphino)ethane}iodotungsten)]","","- C434 H388 Cl4 I8 P32 W8 -","- C434 H388 Cl4 I8 P32 W8 -","- C434 H388 Cl4 I8 P32 W8 -","1","0.125","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.0328","0.0254","","","0.0675","0.069","","","","","","1.1","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102018","18.7529","0.0006","23.9809","0.0007","19.4363","0.0007","90","","115.899","0.004","90","","7862.9","0.5","183","2","183","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[(μ-but-2-yn-1,4-diylidyne(dicarbonyl(tri{1,2-bis(diphenylphosphinoethane)})diiodo-ditungsten)]","","- C169 H146 Cl2 I4 O4 P12 W4 -","- C169 H146 Cl2 I4 O4 P12 W4 -","- C338 H292 Cl4 I8 O8 P24 W8 -","2","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.1012","0.0462","","","0.1017","0.1371","","","","","","1.117","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102019","16.9627","0.0002","16.7625","0.0002","36.087","0.0001","90","","118.139","0.001","90","","9048.1","0.18","183","2","183","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","[(μ-but-2-yn-1,4-diylidyne)(dicarbonyl)(tri{1,2-bis (diphenylphosphinoethane)})diiodo-ditungsten)] hexafluorophosphate","","- C185 H178 Cl2 F12 I4 O8 P14 W4 -","- C185 H178 Cl2 F12 I4 O8 P14 W4 -","- C370 H356 Cl4 F24 I8 O16 P28 W8 -","2","0.5","","Sergey N. Semenov; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","Electronic Communication in Dinuclear C4-Bridged Tungsten Complexes","Journal of the American Chemical Society","2010","132","","3115","3127","10.1021/ja909764x","","","0.71073","MoKα","","0.1383","0.0583","","","0.1331","0.1621","","","","","","0.934","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102020","14.9937","0.0004","8.5295","0.0003","32.9024","0.001","90","","91.939","0.003","90","","4205.4","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","10,25-Diphenyl-5,15,20,30-tetramesityl-A,D-di-p-benzi[28]hexaphyrin(1.1.1.1.1.1)bis(trifluoroacetic acid) salt, tetrakis(trifluoroacetic acid) solvate","","- C94 H78 F18 N4 O12 -","- C94 H78 F18 N4 O12 -","- C188 H156 F36 N8 O24 -","2","0.5","","Marcin Stępień; Bartosz Szyszko; Lechosław Latos-Grażyński","Three-Level Topology Switching in a Molecular Möbius Band","Journal of the American Chemical Society","2010","132","","3140","3152","10.1021/ja909913y","","","0.71073","MoKα","","0.1311","0.0647","","","0.1436","0.1605","","","","","","0.904","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102021","13.8174","0.0011","15.2926","0.0012","16.7367","0.0013","90","","91.214","0.006","90","","3535.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C38 H52 N2 Si Ni","","","- C38 H52 N2 Ni Si -","- C38 H52 N2 Ni Si -","- C152 H208 N8 Ni4 Si4 -","4","1","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","MoKα","","0.1336","0.0393","","","0.0546","0.0639","","","","","","0.683","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102022","8.9717","0.0002","16.5067","0.0004","22.7886","0.0007","90","","100.494","0.003","90","","3318.39","0.15","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","LSi=Ni-(h6-C6H6)","","","- C35 H46 N2 Ni Si -","- C35 H46 N2 Ni Si -","- C140 H184 N8 Ni4 Si4 -","4","1","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","","","0.0608","0.0416","","","0.0863","0.0923","","","","","","1.051","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102023","13.4204","0.0005","16.5796","0.0006","15.4482","0.0006","90","","92.315","0.004","90","","3434.5","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H50 N2 S Si -","- C36 H50 N2 S Si -","- C144 H200 N8 S4 Si4 -","4","1","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","","","0.0833","0.0555","","","0.114","0.1243","","","","","","1.083","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102024","9.8033","0.0002","19.9945","0.0004","16.6768","0.0003","90","","100.85","0.002","90","","3210.42","0.11","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","LSi(SH)-Ni(CO)3","","","- C32 H42 N2 Ni O3 S Si -","- C32 H42 N2 Ni O3 S Si -","- C128 H168 N8 Ni4 O12 S4 Si4 -","4","1","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","MoKα","","0.0698","0.0402","","","0.0833","0.0909","","","","","","0.973","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102025","8.822","0.0003","20.0098","0.0004","9.7785","0.0003","90","","111.974","0.003","90","","1600.76","0.09","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","HLSi(NH2)-Ni(CO)3","","","- C32 H43 N3 Ni O3 Si -","- C32 H43 N3 Ni O3 Si -","- C64 H86 N6 Ni2 O6 Si2 -","2","0.5","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","MoKα","","0.0684","0.0466","","","0.0932","0.0998","","","","","","1.103","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102026","39.9171","0.0009","10.9265","0.0002","18.2378","0.0004","90","","94.946","0.002","90","","7924.9","0.3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","HLSi(NHiPr)-Ni(CO)3 * C6H6","","","- C41 H55 N3 Ni O3 Si -","- C41 H55 N3 Ni O3 Si -","- C328 H440 N24 Ni8 O24 Si8 -","8","1","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","MoKα","","0.0463","0.0342","","","0.0742","0.0777","","","","","","1.041","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102027","21.5161","0.0007","11.0448","0.0004","15.4285","0.0005","90","","98.676","0.003","90","","3624.5","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","HLSi(HN-NHPh)-Ni(CO)3","","","- C38 H48 N4 Ni O3 Si -","- C38 H48 N4 Ni O3 Si -","- C152 H192 N16 Ni4 O12 Si4 -","4","1","","Antje Meltzer; Shigeyoshi Inoue; Carsten Präsang; Matthias Driess","Steering S-H and N-H Bond Activation by a Stable N-Heterocyclic Silylene: Different Addition of H2S, NH3, and Organoamines on a Silicon(II) Ligand versus Its Si(II)\ρightarrowNi(CO)3Complex","Journal of the American Chemical Society","2010","132","","3038","3046","10.1021/ja910305p","","","0.71073","MoKα","","0.1717","0.0785","","","0.0807","0.0981","","","","","","0.987","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102028","26.313","0.004","26.313","0.004","31.709","0.005","90","","90","","90","","21954","6","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C119.52 H156.96 N52.56 O94.8 Pd6 -","- C119.52 H156.96 N52.56 O94.804 Pd6 -","- C478.08 H627.84 N210.24 O379.216 Pd24 -","4","0.25","","Takashi Murase; Shinnosuke Horiuchi; Makoto Fujita","Naphthalene Diels-Alder in a Self-Assembled Molecular Flask","Journal of the American Chemical Society","2010","132","","2866","2867","10.1021/ja9107275","","","0.71073","MoKα","","0.1495","0.0684","","","0.1842","0.2501","","","","","","1.006","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102029","26.222","0.003","26.222","0.003","31.65","0.006","90","","90","","90","","21762","5","90","2","90","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C132 H173 N48.9 O92.89 Pd6 -","- C132 H173 N48.9 O92.884 Pd6 -","- C528 H692 N195.6 O371.536 Pd24 -","4","0.25","","Takashi Murase; Shinnosuke Horiuchi; Makoto Fujita","Naphthalene Diels-Alder in a Self-Assembled Molecular Flask","Journal of the American Chemical Society","2010","132","","2866","2867","10.1021/ja9107275","","","0.71073","MoKα","","0.1109","0.0655","","","0.1725","0.2122","","","","","","1.068","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102030","8.2992","0.0005","9.2248","0.0013","27.3952","0.0005","90","","90","","90","","2097.3","0.3","88.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C19 H29 F N O5 P -","- C19 H29 F N O5 P -","- C76 H116 F4 N4 O20 P4 -","4","1","","Yasuhiro Yamashita; Xun-Xiang Guo; Ryuta Takashita; Shū Kobayashi","Chiral Silver Amide-Catalyzed Enantioselective [3 + 2] Cycloaddition of α-Aminophosphonates with Olefins","Journal of the American Chemical Society","2010","132","","3262","3263","10.1021/ja100101n","","","0.71075","MoKα","","","0.0512","","","","0.073","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102031","8.6413","0.0001","17.5979","0.0002","18.4606","0.0002","90","","90","","90","","2807.28","0.05","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","RajanBabu 1754","","","- C29 H30 Cl2 Co P2 -","- C29 H30 Cl2 Co P2 -","- C116 H120 Cl8 Co4 P8 -","4","1","","Rakesh K. Sharma; T. V. RajanBabu","Asymmetric Hydrovinylation of Unactivated Linear 1,3-Dienes","Journal of the American Chemical Society","2010","132","","3295","3297","10.1021/ja1004703","","x-ray","0.71073","MoKα","","0.0461","0.0301","","","0.0565","0.0609","","","","","","1.048","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102032","17.2321","0.0002","9.5331","0.0001","18.4717","0.0002","90","","91.638","0.001","90","","3033.2","0.06","150","2","150","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","RajanBabu 1745","","","- C31 H32 Cl2 Co O2 P2 -","- C31 H32 Cl2 Co O2 P2 -","- C124 H128 Cl8 Co4 O8 P8 -","4","2","","Rakesh K. Sharma; T. V. RajanBabu","Asymmetric Hydrovinylation of Unactivated Linear 1,3-Dienes","Journal of the American Chemical Society","2010","132","","3295","3297","10.1021/ja1004703","","x-ray","0.71073","MoKα","","0.0515","0.0375","","","0.0744","0.0795","","","","","","1.014","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102033","9.7744","0.0004","10.3565","0.0004","14.9063","0.0006","92.554","0.002","104.359","0.002","105.481","0.002","1398.82","0.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H72 B3 F4 O6 P2 Re -","- C56 H72 B3 F4 O6 P2 Re -","- C56 H72 B3 F4 O6 P2 Re -","1","0.5","","Alexander J. M. Miller; Jay A. Labinger; John E. Bercaw","Homogeneous CO Hydrogenation: Dihydrogen Activation Involves a Frustrated Lewis Pair Instead of a Platinum Complex","Journal of the American Chemical Society","2010","132","","3301","3303","10.1021/ja100574n","","","0.71073","MoKα","","0.0311","0.0306","","","0.0591","0.0592","","","","","","2.373","","","","has coordinates","211332","2020-10-21","18:00:00","" "4102034","7.3944","0.0005","9.7049","0.0007","21.9189","0.0015","90","","90","","90","","1572.94","0.19","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H24 Br N -","- C17 H24 Br N -","- C68 H96 Br4 N4 -","4","1","","Tatsuya Ito; Larry E. Overman; Jocelyn Wang","Enantioselective Synthesis of Angularly Substituted 1-Azabicyclic Ring Systems: Dynamic Kinetic Resolution Using Aza-Cope Rearrangements","Journal of the American Chemical Society","2010","132","","3272","3273","10.1021/ja100607z","","","0.71073","MoKα","","0.0197","0.0189","","","0.0464","0.0467","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102035","14.767","0.002","9.1855","0.0012","16.607","0.003","90","","105.692","0.006","90","","2168.7","0.6","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C32 H20 O3 -","- C32 H20 O3 -","- C128 H80 O12 -","4","0.5","","Steven E. Wheeler; Anne J. McNeil; Peter Müller; Timothy M. Swager; K. N. Houk","Probing Substituent Effects in Aryl-Aryl Interactions Using Stereoselective Diels-Alder Cycloadditions","Journal of the American Chemical Society","2010","132","","3304","3311","10.1021/ja903653j","","","0.71073","MoKα","","0.0471","0.0427","","","0.113","0.1187","","","","","","1.051","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102036","9.319","0.003","10.361","0.003","13.908","0.003","86.862","0.008","87.431","0.007","66.934","0.007","1233.3","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H24 O5 -","- C34 H24 O5 -","- C68 H48 O10 -","2","1","","Steven E. Wheeler; Anne J. McNeil; Peter Müller; Timothy M. Swager; K. N. Houk","Probing Substituent Effects in Aryl-Aryl Interactions Using Stereoselective Diels-Alder Cycloadditions","Journal of the American Chemical Society","2010","132","","3304","3311","10.1021/ja903653j","","","0.71073","MoKα","","0.0676","0.0503","","","0.1341","0.1479","","","","","","1.072","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102037","10.1757","0.0003","25.7175","0.0008","10.2216","0.0003","90","","118.376","0.001","90","","2353.53","0.12","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H24 O3 -","- C34 H24 O3 -","- C136 H96 O12 -","4","1","","Steven E. Wheeler; Anne J. McNeil; Peter Müller; Timothy M. Swager; K. N. Houk","Probing Substituent Effects in Aryl-Aryl Interactions Using Stereoselective Diels-Alder Cycloadditions","Journal of the American Chemical Society","2010","132","","3304","3311","10.1021/ja903653j","","","0.71073","MoKα","","0.0451","0.0394","","","0.1042","0.1093","","","","","","1.027","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102038","9.4171","0.0003","10.5841","0.0003","13.7962","0.0004","87.083","0.001","83.008","0.001","82.652","0.001","1352.78","0.07","142","2","142","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H26 Cl2 O3 -","- C35 H26 Cl2 O3 -","- C70 H52 Cl4 O6 -","2","1","","Steven E. Wheeler; Anne J. McNeil; Peter Müller; Timothy M. Swager; K. N. Houk","Probing Substituent Effects in Aryl-Aryl Interactions Using Stereoselective Diels-Alder Cycloadditions","Journal of the American Chemical Society","2010","132","","3304","3311","10.1021/ja903653j","","","0.71073","MoKα","","0.0516","0.0442","","","0.1204","0.1277","","","","","","1.03","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102039","9.264","0.005","10.318","0.006","13.601","0.008","84.916","0.009","86.667","0.009","67.45","0.008","1195.5","1.2","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H18 Br2 O3 -","- C32 H18 Br2 O3 -","- C64 H36 Br4 O6 -","2","1","","Steven E. Wheeler; Anne J. McNeil; Peter Müller; Timothy M. Swager; K. N. Houk","Probing Substituent Effects in Aryl-Aryl Interactions Using Stereoselective Diels-Alder Cycloadditions","Journal of the American Chemical Society","2010","132","","3304","3311","10.1021/ja903653j","","","0.71073","MoKα","","0.0447","0.0371","","","0.0964","0.1017","","","","","","1.05","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102040","23.1603","0.0012","23.1603","0.0012","23.1603","0.0012","90","","90","","90","","12423.2","1.1","123","2","123","2","","","","","","","","7","I m -3","-I 2 2 3","204","","","","- C144 H175 Co4 N36 O165 P3 W36 -","- C144 H132 Co4 N36 O165 P3 W36 -","- C288 H264 Co8 N72 O330 P6 W72 -","2","0.0416667","","Chunying Duan; Meilin Wei; Dong Guo; Cheng He; Qingjin Meng","Crystal Structures and Properties of Large Protonated Water Clusters Encapsulated by Metal-Organic Frameworks","Journal of the American Chemical Society","2010","132","","3321","3330","10.1021/ja907023c","","","0.71073","MoKα","","0.057","0.0516","","","0.2052","0.2115","","","","","","1.013","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102041","23.2292","0.0011","23.2292","0.0011","23.2292","0.0011","90","","90","","90","","12534.4","1","123","2","123","2","","","","","","","","7","I m -3","-I 2 2 3","204","","","","- C144 H189 Co4 Mo36 N36 O172 P3 -","- C144 H188.96 Co4 Mo36 N36 O172 P3 -","- C288 H377.92 Co8 Mo72 N72 O344 P6 -","2","0.0416667","","Chunying Duan; Meilin Wei; Dong Guo; Cheng He; Qingjin Meng","Crystal Structures and Properties of Large Protonated Water Clusters Encapsulated by Metal-Organic Frameworks","Journal of the American Chemical Society","2010","132","","3321","3330","10.1021/ja907023c","","","0.71073","MoKα","","0.037","0.0287","","","0.0646","0.0669","","","","","","1.047","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102042","23.1496","0.0007","23.1496","0.0007","23.1496","0.0007","90","","90","","90","","12406","0.6","123","2","123","2","","","","","","","","7","I m -3","-I 2 2 3","204","","","","- C144 H175 Co4 Mo36 N36 O165 P3 -","- C144 H132 Co4 Mo36 N36 O165 P3 -","- C288 H264 Co8 Mo72 N72 O330 P6 -","2","0.0416667","","Chunying Duan; Meilin Wei; Dong Guo; Cheng He; Qingjin Meng","Crystal Structures and Properties of Large Protonated Water Clusters Encapsulated by Metal-Organic Frameworks","Journal of the American Chemical Society","2010","132","","3321","3330","10.1021/ja907023c","","","0.71073","MoKα","","0.0776","0.0444","","","0.0636","0.0679","","","","","","1.062","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102043","23.1704","0.0011","23.1704","0.0011","23.1704","0.0011","90","","90","","90","","12439.4","1","123","2","123","2","","","","","","","","8","I m -3","-I 2 2 3","204","","","","- C144 H186 Co4 K Mo36 N36 O171 P3 -","- C144 H132 Co4 K1.04 Mo36 N36 O171.04 P3 -","- C288 H264 Co8 K2.08 Mo72 N72 O342.08 P6 -","2","0.0416667","","Chunying Duan; Meilin Wei; Dong Guo; Cheng He; Qingjin Meng","Crystal Structures and Properties of Large Protonated Water Clusters Encapsulated by Metal-Organic Frameworks","Journal of the American Chemical Society","2010","132","","3321","3330","10.1021/ja907023c","","","0.71073","MoKα","","0.0964","0.0497","","","0.0697","0.0753","","","","","","1.042","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102044","13.723","0.002","17.458","0.003","5.0756","0.0008","90","","90","","90","","1216","0.3","295","2","295","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C4.92 F0.82 N1.64 O48 Si24 -","- C4.8 F0.8 N1.6 O48 Si24 -","- C4.8 F0.8 N1.6 O48 Si24 -","1","0.125","","Claudio M. Zicovich-Wilson; Felipe Gándara; Angeles Monge; Miguel A. Camblor","In SituTransformation of TON Silica Zeolite into the Less Dense ITW: Structure-Direction Overcoming Framework Instability in the Synthesis of SiO2 Zeolites","Journal of the American Chemical Society","2010","132","","3461","3471","10.1021/ja9094318","","","0.71073","MoKα","","0.0789","0.0618","","","0.149","0.1572","","","","","","1.056","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102045","5.557","0.003","5.557","0.003","5.557","0.003","90","","90","","90","","171.6","0.16","100","","100","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- As0.5 Li0.5 Se -","- As0.5 Li0.5 Se -","- As2 Li2 Se4 -","4","0.0208333","","Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis","Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study","Journal of the American Chemical Society","2010","132","","3484","3495","10.1021/ja9094846","","","0.71073","MoKα","","0.0401","0.0401","","","0.1007","0.1007","","","","","","1.388","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102046","12.2872","0.0014","5.5419","0.0007","5.5533","0.0006","90","","113.117","0.008","90","","347.79","0.07","100","","100","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- As Li Se2 -","- As Li Se2 -","- As4 Li4 Se8 -","4","1","","Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis","Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study","Journal of the American Chemical Society","2010","132","","3484","3495","10.1021/ja9094846","","","0.71073","MoKα","","0.0283","0.0237","","","0.0465","0.0475","","","","","","1.099","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102047","11.682","0.002","5.9021","0.0007","11.8231","0.0019","90","","90.446","0.013","90","","815.2","0.2","100","","100","","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- As Na Se2 -","- As Na Se2 -","- As8 Na8 Se16 -","8","4","","Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis","Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study","Journal of the American Chemical Society","2010","132","","3484","3495","10.1021/ja9094846","","","0.71073","MoKα","","0.0653","0.0501","","","0.1169","0.1363","","","","","","1.13","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102048","5.55073","","5.58029","","5.57706","","92.72","","90.8322","","91.516","","172.471","","","","","","","","","","","","","3","P 1","P 1","1","","","","- As Li Se2 -","- As Li Se2 -","- As2 Li2 Se4 -","2","2","","Tarun K. Bera; Joon I. Jang; Jung-Hwan Song; Christos D. Malliakas; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis","Soluble Semiconductors AAsSe2 (A = Li, Na) with a Direct-Band-Gap and Strong Second Harmonic Generation: A Combined Experimental and Theoretical Study","Journal of the American Chemical Society","2010","132","","3484","3495","10.1021/ja9094846","","","","","","","","","","","","","","","","","","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102049","5.7166","0.0006","13.6438","0.0014","15.1053","0.0015","90","","111.446","0.004","90","","1096.6","0.2","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- As Br F12 Kr2 O -","- As Br F12 Kr2 O -","- As4 Br4 F48 Kr8 O4 -","4","1","","David S. Brock; Jonathan J. Casalis de Pury; Hélène P. A. Mercier; Gary J. Schrobilgen; Bernard Silvi","A Rare Example of a Krypton Difluoride Coordination Compound: [BrOF2][AsF6].2KrF2","Journal of the American Chemical Society","2010","132","","3533","3542","10.1021/ja9098559","","","0.71073","MoKα","","0.086","0.0693","","","0.1671","0.1715","","","","","","1.629","","","","has coordinates","211196","2020-10-21","18:00:00","" "4102050","11.1675","0.001","12.1446","0.0011","13.048","0.001","105.494","0.002","104.912","0.002","108.973","0.002","1493.2","0.2","93.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C39 H31 N2 O P -","- C39 H30 N2 O P -","- C78 H60 N4 O2 P2 -","2","1","","Yi-Jing Chen; Kazutaka Seki; Yasuhiro Yamashita; Shū Kobayashi","Catalytic Carbon-Carbon Bond-Forming Reactions of Aminoalkane Derivatives with Imines","Journal of the American Chemical Society","2010","132","","3244","3245","10.1021/ja909909q","","","0.71075","MoKα","","","0.0533","","","","0.0558","","","","","","4.785","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102051","27.2249","0.0011","27.2249","0.0011","27.2249","0.0011","90","","90","","90","","20179","1.4","293","2","293","2","","","","","","","","6","F -4 3 m","F -4 2 3","216","CIS-11","catena-(undeca(N,N-Dibutylamine) bis(tripentacontasulfido-hepta-copper-octaicosa-indium))","","- C88 H220 Cu7 In28 N11 S53 -","- Cu6.46 In28.54 N59.4 S53 -","- Cu25.84 In114.16 N237.6 S212 -","4","0.0416667","","Le Wang; Tao Wu; Fan Zuo; Xiang Zhao; Xianhui Bu; Jianzhong Wu; Pingyun Feng","Assembly of Supertetrahedral T5 Copper-Indium Sulfide Clusters into a Super-Supertetrahedron of Infinite Order","Journal of the American Chemical Society","2010","132","","3283","3285","10.1021/ja9100672","","","0.71073","MoKα","","0.1346","0.098","","","0.292","0.3683","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102052","10.2956","0.0019","13.561","0.003","19.581","0.004","98.865","0.003","99.28","0.003","107.251","0.003","2516.9","0.9","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H21 Fe N19 Ni2 O2 S8 -","- C39 H21 Fe N19 Ni2 O2 S8 -","- C78 H42 Fe2 N38 Ni4 O4 S16 -","2","1","","Masayuki Nihei; Hirotaka Tahira; Nobukazu Takahashi; Yusuke Otake; Yasuhisa Yamamura; Kazuya Saito; Hiroki Oshio","Multiple Bistability and Tristability with Dual Spin-State Conversions in [Fe(dpp)2][Ni(mnt)2]2.MeNO2","Journal of the American Chemical Society","2010","132","","3553","3560","10.1021/ja910122r","","","0.71073","MoKα","","0.0473","0.037","","","0.0877","0.0919","","","","","","0.949","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102053","9.468","0.002","14.068","0.003","20.122","0.004","99.947","0.003","99.118","0.003","105.503","0.004","2484","0.9","140","2","140","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H21 Fe N19 Ni2 O2 S8 -","- C39 H21 Fe N19 Ni2 O2 S8 -","- C78 H42 Fe2 N38 Ni4 O4 S16 -","2","1","","Masayuki Nihei; Hirotaka Tahira; Nobukazu Takahashi; Yusuke Otake; Yasuhisa Yamamura; Kazuya Saito; Hiroki Oshio","Multiple Bistability and Tristability with Dual Spin-State Conversions in [Fe(dpp)2][Ni(mnt)2]2.MeNO2","Journal of the American Chemical Society","2010","132","","3553","3560","10.1021/ja910122r","","","0.71073","MoKα","","0.0583","0.0411","","","0.0956","0.1031","","","","","","0.972","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102054","9.074","0.003","15.463","0.005","18.423","0.006","80.355","0.005","76.17","0.005","79.649","0.006","2448.1","1.4","205","2","205","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H21 Fe N19 Ni2 O2 S8 -","- C39 H21 Fe N19 Ni2 O2 S8 -","- C78 H42 Fe2 N38 Ni4 O4 S16 -","2","1","","Masayuki Nihei; Hirotaka Tahira; Nobukazu Takahashi; Yusuke Otake; Yasuhisa Yamamura; Kazuya Saito; Hiroki Oshio","Multiple Bistability and Tristability with Dual Spin-State Conversions in [Fe(dpp)2][Ni(mnt)2]2.MeNO2","Journal of the American Chemical Society","2010","132","","3553","3560","10.1021/ja910122r","","","0.71073","MoKα","","0.1209","0.0632","","","0.1374","0.1659","","","","","","1.028","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102055","10.384","0.002","13.594","0.003","19.583","0.004","98.371","0.004","99.279","0.004","106.424","0.004","2562.9","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H21 Fe N19 Ni2 O2 S8 -","- C39 H21 Fe N19 Ni2 O2 S8 -","- C78 H42 Fe2 N38 Ni4 O4 S16 -","2","1","","Masayuki Nihei; Hirotaka Tahira; Nobukazu Takahashi; Yusuke Otake; Yasuhisa Yamamura; Kazuya Saito; Hiroki Oshio","Multiple Bistability and Tristability with Dual Spin-State Conversions in [Fe(dpp)2][Ni(mnt)2]2.MeNO2","Journal of the American Chemical Society","2010","132","","3553","3560","10.1021/ja910122r","","","0.71073","MoKα","","0.1394","0.0609","","","0.118","0.1479","","","","","","0.905","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102056","18.397","0.009","19.306","0.009","21.597","0.01","97.65","0.01","95.067","0.009","104.091","0.008","7315","6","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H21 Fe N19 Ni2 O2 S8 -","- C39 H21 Fe N19 Ni2 O2 S8 -","- C234 H126 Fe6 N114 Ni12 O12 S48 -","6","3","","Masayuki Nihei; Hirotaka Tahira; Nobukazu Takahashi; Yusuke Otake; Yasuhisa Yamamura; Kazuya Saito; Hiroki Oshio","Multiple Bistability and Tristability with Dual Spin-State Conversions in [Fe(dpp)2][Ni(mnt)2]2.MeNO2","Journal of the American Chemical Society","2010","132","","3553","3560","10.1021/ja910122r","","","0.71073","MoKα","","0.161","0.085","","","0.2066","0.2548","","","","","","1.04","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102057","9.904","0.0008","21.441","0.003","21.8567","0.0018","90","","90","","90","","4641.3","0.8","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C82 H29 N O2 -","- C82 H29 N O2 -","- C328 H116 N4 O8 -","4","1","","Stéphane Campidelli; Philippe Bourgun; Boris Guintchin; Julien Furrer; Helen Stoeckli-Evans; Isabel M. Saez; John W. Goodby; Robert Deschenaux","Diastereoisomerically Pure Fulleropyrrolidines as Chiral Platforms for the Design of Optically Active Liquid Crystals","Journal of the American Chemical Society","2010","132","","3574","3581","10.1021/ja910128e","","","0.71073","MoKα","","0.1443","0.0727","","","0.1065","0.1273","","","","","","0.971","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102058","14.138","0.003","14.224","0.003","27.716","0.006","104.253","0.004","94.05","0.004","91.825","0.004","5382","2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","[(u-N)(U(N[t-Bu][3,5-Me2C6H3])3)2][B(3,5-(CF3)2C6H3)4]","","- C108 H128 B F24 N7 O U2 -","- C108 H128 B F24 N7 O U2 -","- C216 H256 B2 F48 N14 O2 U4 -","2","1","","Alexander R. Fox; Polly L. Arnold; Christopher C. Cummins","Uranium-Nitrogen Multiple Bonding: Isostructural Anionic, Neutral, and Cationic Uranium Nitride Complexes Featuring a Linear U=N=U Core","Journal of the American Chemical Society","2010","132","","3250","3251","10.1021/ja910364u","","x-ray","0.71073","MoKα","","0.0789","0.0401","","","0.0754","0.088","","","","","","1.021","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102059","19.0179","0.0009","21.6348","0.001","23.6014","0.0011","90","","94.932","0.001","90","","9674.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[N(n-Bu)4][(u-N)(U(N[t-Bu][3,5-Me2C6H3])3)2]","","","- C96 H164 N8 O2 U2 -","- C96 H164 N8 O2 U2 -","- C384 H656 N32 O8 U8 -","4","1","","Alexander R. Fox; Polly L. Arnold; Christopher C. Cummins","Uranium-Nitrogen Multiple Bonding: Isostructural Anionic, Neutral, and Cationic Uranium Nitride Complexes Featuring a Linear U=N=U Core","Journal of the American Chemical Society","2010","132","","3250","3251","10.1021/ja910364u","","","0.71073","MoKα","","0.1054","0.0418","","","0.074","0.0921","","","","","","1.019","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102060","11.9403","0.0008","13.8787","0.0009","13.8923","0.0016","111.12","0.001","101.095","0.002","105.745","0.001","1956","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(u-N)(U(N[t-Bu][3,5-Me2C6H3]3)2","","","- C76 H118 N7 O U2 -","- C76 H118 N7 O U2 -","- C76 H118 N7 O U2 -","1","0.5","","Alexander R. Fox; Polly L. Arnold; Christopher C. Cummins","Uranium-Nitrogen Multiple Bonding: Isostructural Anionic, Neutral, and Cationic Uranium Nitride Complexes Featuring a Linear U=N=U Core","Journal of the American Chemical Society","2010","132","","3250","3251","10.1021/ja910364u","","","0.71073","MoKα","","0.0438","0.0323","","","0.0748","0.0798","","","","","","1.039","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102061","16.0499","0.0016","6.9437","0.0007","16.4241","0.0016","90","","115.326","0.002","90","","1654.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Cl2 N2 O -","- C18 H18 Cl2 N2 O -","- C72 H72 Cl8 N8 O4 -","4","1","","Benjamin J. Coe; John Fielden; Simon P. Foxon; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Anna Samoc; Marek Samoc","Combining Very Large Quadratic and cubic Nonlinear Optical Responses in Extended, Tris-Chelate Metallochromophores with Six π-Conjugated Pyridinium Substituents","Journal of the American Chemical Society","2010","132","","3496","3513","10.1021/ja910538s","","","0.71073","MoKα","","0.0614","0.0476","","","0.1372","0.1433","","","","","","1.361","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102062","9.1252","0.0013","17.637","0.002","13.683","0.002","90","","109.478","0.005","90","","2076.1","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 F12 N6 O2 P2 -","- C42 H42 F12 N6 O2 P2 -","- C84 H84 F24 N12 O4 P4 -","2","0.5","","Benjamin J. Coe; John Fielden; Simon P. Foxon; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Anna Samoc; Marek Samoc","Combining Very Large Quadratic and cubic Nonlinear Optical Responses in Extended, Tris-Chelate Metallochromophores with Six π-Conjugated Pyridinium Substituents","Journal of the American Chemical Society","2010","132","","3496","3513","10.1021/ja910538s","","","0.71073","MoKα","","0.0802","0.0561","","","0.1595","0.1736","","","","","","1.123","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102063","7.2949","0.0004","18.2726","0.001","10.1245","0.0006","90","","94.891","0.001","90","","1344.65","0.13","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0394","0.0371","","","0.111","0.1129","","","","","","1.046","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102064","7.3033","0.0011","18.261","0.003","10.1272","0.0015","90","","94.841","0.002","90","","1345.8","0.4","165","2","165","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0421","0.0397","","","0.1289","0.1322","","","","","","1.014","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102065","7.3206","0.0004","18.2483","0.0011","10.1331","0.0006","90","","94.681","0.001","90","","1349.15","0.14","195","2","195","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0503","0.0476","","","0.153","0.1547","","","","","","1.166","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102066","7.31","0.005","18.28","0.011","10.145","0.006","90","","94.645","0.008","90","","1351.2","1.5","210","2","210","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.77749","synchrotron","","0.0467","0.0432","","","0.1415","0.1452","","","","","","1.094","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102067","7.355","0.004","18.215","0.009","10.152","0.005","90","","94.502","0.006","90","","1355.9","1.2","225","2","225","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0492","0.0455","","","0.1487","0.1512","","","","","","1.116","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102069","7.3378","0.001","18.201","0.003","10.1447","0.0014","90","","94.393","0.002","90","","1350.9","0.3","255","2","255","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.054","0.0495","","","0.1551","0.1581","","","","","","1.144","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102070","7.3413","0.0008","18.175","0.002","10.1557","0.0011","90","","94.32","0.002","90","","1351.2","0.3","270","","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0488","0.0439","","","0.1388","0.1428","","","","","","1.021","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102071","7.356","0.002","18.208","0.004","10.167","0.002","90","","94.277","0.014","90","","1358","0.5","285","2","285","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0695","0.057","","","0.165","0.1722","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102072","7.3333","0.0014","18.153","0.003","10.1729","0.0019","90","","94.379","0.004","90","","1350.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","Synchrotron","","0.1434","0.0765","","","0.1839","0.2013","","","","","","1.21","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102073","7.306","0.003","18.111","0.008","10.205","0.004","90","","94.248","0.007","90","","1346.6","1","330","2","330","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.578 S -","- C32 H12 Cu8 O42.312 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0766","0.0509","","","0.138","0.1497","","","","","","0.856","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102074","7.3333","0.0014","18.153","0.003","10.1729","0.0019","90","","94.379","0.004","90","","1350.3","0.4","305","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.715 S -","- C32 H12 Cu8 O42.86 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0644","0.0556","","","0.16","0.1662","","","","","","1.186","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102075","7.3354","0.0019","18.14","0.004","10.179","0.003","90","","94.337","0.004","90","","1350.6","0.6","310","2","310","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.676 S -","- C32 H12 Cu8 O42.704 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0638","0.0502","","","0.1482","0.1572","","","","","","1.044","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102076","7.3354","0.0019","18.14","0.004","10.179","0.003","90","","94.337","0.004","90","","1350.6","0.6","325","2","325","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H3 Cu2 O10.72 S -","- C8 H3 Cu2 O10.717 S -","- C32 H12 Cu8 O42.868 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0645","0.0507","","","0.151","0.16","","","","","","1.063","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102077","7.301","0.008","18.032","0.019","10.133","0.011","90","","94.307","0.018","90","","1330","2","320","2","320","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.66 S -","- C32 H12 Cu8 O42.64 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0862","0.0605","","","0.1652","0.1896","","","","","","1.094","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102078","7.301","0.007","18.048","0.016","10.21","0.009","90","","94.334","0.014","90","","1342","2","325","2","325","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.59 S -","- C32 H12 Cu8 O42.36 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0955","0.0616","","","0.1696","0.2019","","","","","","1.145","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102079","7.306","0.003","18.111","0.008","10.205","0.004","90","","94.248","0.007","90","","1346.6","1","330","2","330","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H Cu2 O11 S -","- C8 H3 Cu2 O11 S -","- C32 H12 Cu8 O44 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.078","0.0522","","","0.142","0.1536","","","","","","0.878","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102080","7.315","0.007","18.168","0.015","10.219","0.009","90","","94.163","0.015","90","","1355","2","335","2","335","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.58 S -","- C32 H12 Cu8 O42.32 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.1092","0.0627","","","0.1677","0.1974","","","","","","1.014","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102081","7.302","0.013","18.15","0.03","10.267","0.018","90","","94.01","0.03","90","","1357","4","340","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.43 S -","- C32 H12 Cu8 O41.72 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.2036","0.1235","","","0.3049","0.3754","","","","","","1.958","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102082","7.271","0.004","18.061","0.01","10.212","0.006","90","","94.234","0.01","90","","1337.4","1.3","345","2","345","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.312 S -","- C32 H12 Cu8 O41.248 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0935","0.0554","","","0.1442","0.1609","","","","","","0.934","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102083","7.283","0.003","18.119","0.009","10.262","0.005","90","","94.119","0.008","90","","1350.7","1.1","355","2","355","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.34 S -","- C32 H12 Cu8 O41.36 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.089","0.0531","","","0.145","0.1576","","","","","","0.941","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102084","7.252","0.008","18.068","0.019","10.23","0.01","90","","94.216","0.016","90","","1337","2","360","2","360","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cu2 O11 S -","- C8 H3 Cu2 O10.33 S -","- C32 H12 Cu8 O41.32 S4 -","4","1","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.1008","0.0628","","","0.158","0.1736","","","","","","1.009","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102085","13.814","0.005","19.437","0.01","12.067","0.006","90","","139.21","0.02","90","","2116.7","1.9","435","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H6 Cu4 O16 S2 -","- C8 H3 Cu2 O8 S -","- C64 H24 Cu16 O64 S8 -","8","2","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0883","0.049","","","0.1253","0.1569","","","","","","0.889","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102086","13.796","0.002","19.43","0.004","12.057","0.003","90","","139.172","0.01","90","","2113","0.9","445","2","445","2","101.31","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H6 Cu4 O16 S4 -","- C8 H3 Cu2 O8 S -","- C64 H24 Cu16 O64 S8 -","8","2","","Phoebe K. Allan; Bo Xiao; Simon J. Teat; Jason W. Knight; Russell E. Morris","In Situ Single-Crystal Diffraction Studies of the Structural Transition of Metal-Organic Framework Copper 5-Sulfoisophthalate, Cu-SIP-3","Journal of the American Chemical Society","2010","132","","3605","3611","10.1021/ja910600b","","","0.7749","synchrotron","","0.0769","0.0478","","","0.1223","0.1486","","","","","","0.873","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102087","6.265","0.002","9.606","0.003","15.868","0.005","90","","93.66","0.006","90","","953","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H20 B N -","- C8 H20 B N -","- C32 H80 B4 N4 -","4","1","","Patrick G. Campbell; Lev N. Zakharov; Daniel J. Grant; David A. Dixon; Shih-Yuan Liu","Hydrogen Storage by Boron-Nitrogen Heterocycles: A Simple Route for Spent Fuel Regeneration","Journal of the American Chemical Society","2010","132","","3289","3291","10.1021/ja9106622","","","0.71073","MoKα","","0.0561","0.0447","","","0.1118","0.1224","","","","","","1.038","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102088","9.883","0.005","11.83","0.006","22.453","0.01","90","","92.087","0.008","90","","2623","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H43 B K N O6 -","- C20 H43 B K N O6 -","- C80 H172 B4 K4 N4 O24 -","4","1","","Patrick G. Campbell; Lev N. Zakharov; Daniel J. Grant; David A. Dixon; Shih-Yuan Liu","Hydrogen Storage by Boron-Nitrogen Heterocycles: A Simple Route for Spent Fuel Regeneration","Journal of the American Chemical Society","2010","132","","3289","3291","10.1021/ja9106622","","","0.71073","MoKα","","0.117","0.0687","","","0.1669","0.1993","","","","","","1.022","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102089","18.934","0.004","27.616","0.006","20.473","0.005","90","","90","","90","","10705","4","103","2","103","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C58 H66 Cl4 N4 Pd -","- C58 H66 Cl4 N4 Pd -","- C464 H528 Cl32 N32 Pd8 -","8","1","","Yasunao Miyamura; Kazushi Kinbara; Yohei Yamamoto; Vakayil K. Praveen; Kenichi Kato; Masaki Takata; Atsushi Takano; Yushu Matsushita; Eunji Lee; Myongsoo Lee; Takuzo Aida","Shape-Directed Assembly of a ""Macromolecular Barb"" into Nanofibers: Stereospecific Cyclopolymerization of Isopropylidene Diallylmalonate","Journal of the American Chemical Society","2010","132","","3292","3294","10.1021/ja910901e","","","0.7107","MoKα","","0.0742","0.0642","","","0.1104","0.1134","","","","","","1.295","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102090","34.304","0.003","19.0827","0.0015","16.479","0.0013","90","","112.102","0.001","90","","9994.7","1.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C97 H162 N2 P6 Sc2 -","- C97 H162 N2 P6 Sc2 -","- C388 H648 N8 P24 Sc8 -","4","0.5","","Benjamin F. Wicker; Jennifer Scott; José G. Andino; Xinfeng Gao; Hyunsoo Park; Maren Pink; Daniel J. Mindiola","Phosphinidene Complexes of Scandium: Powerful PAr Group-Transfer Vehicles to Organic and Inorganic Substrates","Journal of the American Chemical Society","2010","132","","3691","3693","10.1021/ja100214e","","","0.71073","MoKα","","0.0807","0.0523","","","0.1429","0.1749","","","","","","1.13","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00","" "4102091","12.396","0.005","14.179","0.006","15.666","0.006","95.417","0.006","93.967","0.007","93.815","0.007","2727.2","1.9","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H77 Br Li N P3 Sc -","- C55 H77 Br Li N P3 Sc -","- C110 H154 Br2 Li2 N2 P6 Sc2 -","2","1","","Benjamin F. Wicker; Jennifer Scott; José G. Andino; Xinfeng Gao; Hyunsoo Park; Maren Pink; Daniel J. Mindiola","Phosphinidene Complexes of Scandium: Powerful PAr Group-Transfer Vehicles to Organic and Inorganic Substrates","Journal of the American Chemical Society","2010","132","","3691","3693","10.1021/ja100214e","","","0.71073","MoKα","","0.1213","0.072","","","0.1889","0.2167","","","","","","1.066","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00","" "4102092","11.8898","0.0012","21.318","0.003","22.944","0.003","90","","90","","90","","5815.5","1.3","150","2","150","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C56 H80 Br Li N O2.5 P3 Sc -","- C56 H80 Br Li N O2.5 P3 Sc -","- C224 H320 Br4 Li4 N4 O10 P12 Sc4 -","4","1","","Benjamin F. Wicker; Jennifer Scott; José G. Andino; Xinfeng Gao; Hyunsoo Park; Maren Pink; Daniel J. Mindiola","Phosphinidene Complexes of Scandium: Powerful PAr Group-Transfer Vehicles to Organic and Inorganic Substrates","Journal of the American Chemical Society","2010","132","","3691","3693","10.1021/ja100214e","","x-ray","0.71073","MoKα","","0.0795","0.0567","","","0.1377","0.151","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102093","9.7154","0.0004","11.6798","0.0005","14.9702","0.0006","97.349","0.001","107.577","0.001","110.254","0.001","1467.07","0.11","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C37 H35 P -","- C37 H35 P -","- C74 H70 P2 -","2","1","","Benjamin F. Wicker; Jennifer Scott; José G. Andino; Xinfeng Gao; Hyunsoo Park; Maren Pink; Daniel J. Mindiola","Phosphinidene Complexes of Scandium: Powerful PAr Group-Transfer Vehicles to Organic and Inorganic Substrates","Journal of the American Chemical Society","2010","132","","3691","3693","10.1021/ja100214e","","x-ray","0.71073","MoKα","","0.0546","0.0458","","","0.1249","0.1332","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102094","10.7145","0.0003","7.1225","0.0003","12.4937","0.0003","90","","109.575","0.0017","90","","898.34","0.05","103.1","","103.1","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H19 Br N2 O5 -","- C17 H19 Br N2 O5 -","- C34 H38 Br2 N4 O10 -","2","1","","Nicholas E. Shepherd; Hirooki Tanabe; Yingjie Xu; Shigeki Matsunaga; Masakatsu Shibasaki","Direct Catalytic Asymmetric Vinylogous Mannich-Type and Michael Reactions of an α,β-Unsaturated γ-Butyrolactam under Dinuclear Nickel Catalysis","Journal of the American Chemical Society","2010","132","","3666","3667","10.1021/ja1002636","","","1.54187","CuKα","","","0.0389","","","","0.079","","","","","","0.912","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102095","9.795","0.003","10.039","0.003","10.579","0.003","104.965","0.004","103.246","0.005","117.219","0.004","817.4","0.4","173","2","173","2","","","","","","","","6","P 1","P 1","1","","","","- C39 H32 Cu I O P2 -","- C39 H32 Cu I O P2 -","- C39 H32 Cu I O P2 -","1","1","","Jinkun Huang; Johann Chan; Ying Chen; Christopher J. Borths; Kyle D. Baucom; Robert D. Larsen; Margaret M. Faul","A Highly Efficient Palladium/Copper Cocatalytic System for Direct Arylation of Heteroarenes: An Unexpected Effect of Cu(Xantphos)I","Journal of the American Chemical Society","2010","132","","3674","3675","10.1021/ja100354j","","x-ray","0.71073","MoKα","","0.0311","0.0296","","","0.075","0.0763","","","","","","1.075","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102096","10.5819","0.0001","21.4447","0.0002","19.0361","0.0002","90","","96.936","0.001","90","","4288.17","0.07","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C47 H39 Cl2 Cu I N O P2 S -","- C47 H39 Cl2 Cu I N O P2 S -","- C188 H156 Cl8 Cu4 I4 N4 O4 P8 S4 -","4","1","","Jinkun Huang; Johann Chan; Ying Chen; Christopher J. Borths; Kyle D. Baucom; Robert D. Larsen; Margaret M. Faul","A Highly Efficient Palladium/Copper Cocatalytic System for Direct Arylation of Heteroarenes: An Unexpected Effect of Cu(Xantphos)I","Journal of the American Chemical Society","2010","132","","3674","3675","10.1021/ja100354j","","x-ray","1.54178","CuKα","","0.047","0.0448","","","0.1203","0.1216","","","","","","1.117","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102097","13.5197","0.0017","14.684","0.0018","17.417","0.002","85.975","0.003","73.27","0.002","84.93","0.002","3294.7","0.7","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H80 F5 N O2 P2 Pd -","- C58 H80 F5 N O2 P2 Pd -","- C116 H160 F10 N2 O4 P4 Pd2 -","2","1","","Yichen Tan; John F. Hartwig","Palladium-Catalyzed Amination of Aromatic C-H Bonds with Oxime Esters","Journal of the American Chemical Society","2010","132","","3676","3677","10.1021/ja100676r","","","0.71073","MoKα","","0.1028","0.0591","","","0.1476","0.1672","","","","","","0.886","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102098","7.4228","0.0014","8.1929","0.0018","14.838","0.004","104.299","0.018","100.577","0.018","95.938","0.017","849","0.4","210","2","210","2","","","","","","","","4","P -1","-P 1","2","","Tetra-potassium-aqua-ethanol-3,4,9,10-perylene-tetracarboxylate ethanol solvate'","","- C16 H12 K2 O7 -","- C16 H12 K2 O7 -","- C32 H24 K4 O14 -","2","1","","Minghua Huang; Uwe Schilde; Michael Kumke; Markus Antonietti; Helmut Cölfen","Polymer-Induced Self-Assembly of Small Organic Molecules into Ultralong Microbelts with Electronic Conductivity","Journal of the American Chemical Society","2010","132","","3700","3707","10.1021/ja906667x","","","0.71073","MoKα","","0.0432","0.0359","","","0.099","0.1034","","","","","","1.029","","","","has coordinates","178766","2020-10-21","18:00:00","" "4102099","12.72","0.002","12.902","0.002","22.267","0.004","85.756","0.008","83.34","0.007","63.273","0.007","3240.9","0.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Na(222)[Fe(TPP)Cl]","","","- C65 H70 Cl7 Fe N6 Na O6 -","- C65 H70 Cl7 Fe N6 Na O6 -","- C130 H140 Cl14 Fe2 N12 Na2 O12 -","2","1","","Chuanjiang Hu; Corinne D. Sulok; Florian Paulat; Nicolai Lehnert; Anna I. Twigg; Michael P. Hendrich; Charles E. Schulz; W. Robert Scheidt","Just a Proton: Distinguishing the Two Electronic States of Five-Coordinate High-Spin Iron(II) Porphyrinates with Imidazole/ate Coordination","Journal of the American Chemical Society","2010","132","","3737","3750","10.1021/ja907584x","","","0.71073","MoKα","","0.0447","0.0383","","","0.1032","0.119","","","","","","1.044","","","","has coordinates,has disorder","178766","2020-10-21","18:00:00","" "4102100","17.8096","0.0018","9.5907","0.001","12.3463","0.0013","90","","127.541","0.002","90","","1672.1","0.3","298","","298","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C32 H24 N2 O8 Rh2 -","- C32 H24 N2 O8 Rh2 -","- C64 H48 N4 O16 Rh4 -","2","0.25","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0478","0.039","","","0.094","0.0982","","","","","","1.103","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102101","17.713","0.011","9.623","0.006","19.575","0.012","90","","98.249","0.01","90","","3302","4","90","","90","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H24 N2 O8 Rh2 -","- C32 H24 N2 O8 Rh2 -","- C128 H96 N8 O32 Rh8 -","4","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0728","0.0564","","","0.1374","0.147","","","","","","1.049","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102102","9.541","0.002","10.3","0.002","11.038","0.002","70.192","0.004","66.179","0.004","63.002","0.004","867.9","0.3","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H24 N2 O14 Rh2 -","- C35 H24 N2 O14 Rh2 -","- C35 H24 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0621","0.0547","","","0.1433","0.1488","","","","","","1.047","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102103","17.998","0.016","9.697","0.008","18.903","0.017","90","","97.339","0.018","90","","3272","5","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H24 Cu2 N2 O8 -","- C32 H24 Cu2 N2 O8 -","- C128 H96 Cu8 N8 O32 -","4","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.094","0.0654","","","0.155","0.1704","","","","","","1.058","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102104","17.485","0.003","9.6876","0.0019","19.213","0.004","90","","98.432","0.004","90","","3219.3","1.1","90","","90","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H24 Cu2 N2 O8 -","- C32 H24 Cu2 N2 O8 -","- C128 H96 Cu8 N8 O32 -","4","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0827","0.0589","","","0.1342","0.1462","","","","","","1.034","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102105","9.6214","0.0015","10.2423","0.0016","10.9393","0.0017","70.584","0.003","66.008","0.003","63.084","0.003","863.5","0.2","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H24 Cu2 N2 O14 -","- C35 H24 Cu2 N2 O14 -","- C35 H24 Cu2 N2 O14 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0648","0.0575","","","0.162","0.1655","","","","","","1.185","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102106","10.463","0.003","10.502","0.003","15.753","0.005","79.896","0.007","80.852","0.007","87.276","0.007","1682.1","0.9","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 N2 O8 Rh2 -","- C33 H25 N2 O8 Rh2 -","- C66 H50 N4 O16 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0804","0.054","","","0.1236","0.1392","","","","","","1.03","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102107","10.2076","0.0009","10.4184","0.001","15.7516","0.0015","79.434","0.002","81.217","0.002","86.212","0.002","1626.2","0.3","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 N2 O8 Rh2 -","- C33 H25 N2 O8 Rh2 -","- C66 H50 N4 O16 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0744","0.055","","","0.1294","0.1463","","","","","","1.127","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102108","9.6162","0.0016","10.4953","0.0018","11.1475","0.0019","68.8","0.003","65.939","0.003","62.968","0.003","893.3","0.3","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H26 N2 O14 Rh2 -","- C36 H23 N2 O14 Rh2 -","- C36 H23 N2 O14 Rh2 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0853","0.0656","","","0.1623","0.1852","","","","","","1.199","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102109","10.401","0.004","10.481","0.004","15.71","0.005","80.792","0.008","82.183","0.007","87.447","0.007","1674.4","1.1","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 Cu2 N2 O8 -","- C33 H25 Cu2 N2 O8 -","- C66 H50 Cu4 N4 O16 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.1004","0.0697","","","0.1637","0.1792","","","","","","1.077","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102110","10.213","0.004","10.386","0.004","15.673","0.006","80.728","0.008","82.581","0.008","86.601","0.008","1625.8","1.1","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H26 Cu2 N2 O8 -","- C33 H25 Cu2 N2 O8 -","- C66 H50 Cu4 N4 O16 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.1368","0.0929","","","0.2019","0.2351","","","","","","1.091","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102111","9.748","0.006","10.547","0.007","11.23","0.011","67.951","0.007","64.28","","62.47","","900.1","1.2","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H26 Cu2 N2 O14 -","- C36 H23 Cu2 N2 O14 -","- C36 H23 Cu2 N2 O14 -","1","0.5","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.1614","0.113","","","0.2907","0.3269","","","","","","1.081","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102112","10.504","0.003","10.523","0.003","15.784","0.005","80.233","0.006","80.818","0.006","88.595","0.007","1697.3","0.9","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 N2 O8 Rh2 -","- C34 H28 N2 O8 Rh2 -","- C68 H56 N4 O16 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0476","0.0361","","","0.0749","0.084","","","","","","1.076","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102113","10.2633","0.0005","10.4611","0.0005","15.7171","0.0007","79.853","0.001","81.04","0.001","87.363","0.001","1640.51","0.13","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 N2 O8 Rh2 -","- C34 H28 N2 O8 Rh2 -","- C68 H56 N4 O16 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0323","0.0269","","","0.0588","0.0632","","","","","","1.039","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102114","10.317","0.0011","10.4309","0.0011","15.674","0.0016","80.248","0.002","81.189","0.002","87.87","0.002","1642.7","0.3","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C34.4 H28 N2 O8.79 Rh2 -","- C34.491 H28 N2 O8.982 Rh2 -","- C68.982 H56 N4 O17.964 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0939","0.0468","","","0.0994","0.1373","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102115","10.453","0.003","10.896","0.004","15.659","0.005","98.748","0.007","99.36","0.007","90.288","0.007","1738.5","1","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H28 N2 O12 Rh2 -","- C36 H28 N2 O12 Rh2 -","- C72 H56 N4 O24 Rh4 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.1706","0.1037","","","0.2456","0.2757","","","","","","0.952","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102116","10.484","0.003","10.515","0.003","15.681","0.005","81.244","0.006","82.174","0.006","88.84","0.007","1692.6","0.9","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 Cu2 N2 O8 -","- C34 H28 Cu2 N2 O8 -","- C68 H56 Cu4 N4 O16 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.0904","0.0627","","","0.1331","0.1495","","","","","","1.123","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102117","10.2611","0.0006","10.4184","0.0006","15.6335","0.0009","81.141","0.001","82.302","0.001","87.722","0.001","1636.16","0.16","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 Cu2 N2 O8 -","- C34 H28 Cu2 N2 O8 -","- C68 H56 Cu4 N4 O16 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.053","0.0432","","","0.0963","0.1049","","","","","","1.137","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102118","10.5149","0.001","10.3425","0.001","15.5194","0.0015","82.721","0.002","82.702","0.002","89.957","0.002","1660.4","0.3","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C34.65 H28 Cu2 N2 O9.29 -","- C34.645 H28 Cu2 N2 O9.29 -","- C69.29 H56 Cu4 N4 O18.58 -","2","1","","Satoshi Takamizawa; Ei-ichi Nataka; Takamasa Akatsuka; Ryosuke Miyake; Yoshiki Kakizaki; Hirotoshi Takeuchi; Goro Maruta; Sadamu Takeda","Crystal Transformation and Host Molecular Motions in CO2 Adsorption Process of a Metal Benzoate Pyrazine (MII= Rh, Cu)","Journal of the American Chemical Society","2010","132","","3783","3792","10.1021/ja9091598","","","0.71073","MoKα","","0.1213","0.0633","","","0.1317","0.1563","","","","","","0.986","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102119","10.0089","0.0003","13.3937","0.0004","21.0503","0.0007","90","","99.197","0.003","90","","2785.65","0.15","193","2","193","2","","","","","","","chemical synthesis","7","P 1 21/n 1","-P 2yn","14","TF04054","(Benzo[h]quinolinato){(2-nitrophenyl-sulfonyl)[(2-(pyridine-2-yl)phenyl] amido}-difluoropalladium(IV) Acetonitrile Solvate","","- C32 H23 F2 N5 O4 Pd S -","- C32 H23 F2 N5 O4 Pd S -","- C128 H92 F8 N20 O16 Pd4 S4 -","4","1","","Takeru Furuya; Diego Benitez; Ekaterina Tkatchouk; Alexandra E. Strom; Pingping Tang; William A. Goddard; Tobias Ritter","Mechanism of C-F Reductive Elimination from Palladium(IV) Fluorides","Journal of the American Chemical Society","2010","132","","3793","3807","10.1021/ja909371t","","","0.71073","MoKα","","0.0728","0.0383","","","0.0703","0.0829","","","","","","1.042","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102120","15.2325","0.0005","11.9436","0.0004","13.976","0.0005","90","","101.975","0.001","90","","2487.33","0.15","193","2","193","2","","","","","","","chemical synthesis","8","P 1 21/c 1","-P 2ybc","14","TPP-I-114","[(2-Nitrophenylsulfonyl)(2-(pyridine-2-yl)phenyl)amido](pyridine) palladium(II) Fluoride Dichloromethane Solvate","","- C23 H19 Cl2 F N4 O4 Pd S -","- C23 H19 Cl2 F N4 O4 Pd S -","- C92 H76 Cl8 F4 N16 O16 Pd4 S4 -","4","1","","Takeru Furuya; Diego Benitez; Ekaterina Tkatchouk; Alexandra E. Strom; Pingping Tang; William A. Goddard; Tobias Ritter","Mechanism of C-F Reductive Elimination from Palladium(IV) Fluorides","Journal of the American Chemical Society","2010","132","","3793","3807","10.1021/ja909371t","","","0.71073","MoKα","","0.0347","0.0257","","","0.0625","0.0674","","","","","","1.048","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102121","8.8778","0.0015","11.951","0.002","18.68","0.003","90","","90","","90","","1981.9","0.6","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","estrone derivative 11c","","","- C23 H28 O4 -","- C23 H28 O4 -","- C92 H112 O16 -","4","1","","Christoph Schotes; Antonio Mezzetti","Asymmetric Diels-Alder Reactions of Unsaturated β-Ketoesters Catalyzed by Chiral Ruthenium PNNP Complexes","Journal of the American Chemical Society","2010","132","","3652","3653","10.1021/ja910039e","","","0.71073","MoKα","","0.0673","0.0457","","","0.0731","0.078","","","","","","0.819","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102122","11.511","0.0007","13.8903","0.0008","20.6616","0.0012","96.886","0.001","93.755","0.001","113.085","0.001","2994.2","0.3","200","2","200","2","","","","","","","","8","P -1","-P 1","2","[Ru(3a)(PNNP)](PF6)2","","","- C56 H58 Cl4 F12 N2 O3 P4 Ru -","- C56 H58 Cl4 F12 N2 O3 P4 Ru -","- C112 H116 Cl8 F24 N4 O6 P8 Ru2 -","2","1","","Christoph Schotes; Antonio Mezzetti","Asymmetric Diels-Alder Reactions of Unsaturated β-Ketoesters Catalyzed by Chiral Ruthenium PNNP Complexes","Journal of the American Chemical Society","2010","132","","3652","3653","10.1021/ja910039e","","","0.71073","MoKα","","0.0559","0.0504","","","0.129","0.1337","","","","","","1.021","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102123","7.6079","0.0014","10.0378","0.0018","10.3899","0.0019","68.164","0.003","83.564","0.003","83.013","0.003","729.1","0.2","100","2","100","2","","","","","","","","3","P 1","P 1","1","Camphanic Acid Ester ent-14","","","- C33 H42 O7 -","- C33 H42 O7 -","- C33 H42 O7 -","1","1","","Christoph Schotes; Antonio Mezzetti","Asymmetric Diels-Alder Reactions of Unsaturated β-Ketoesters Catalyzed by Chiral Ruthenium PNNP Complexes","Journal of the American Chemical Society","2010","132","","3652","3653","10.1021/ja910039e","","","0.71073","MoKα","","0.0395","0.0384","","","0.0992","0.1002","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102124","12.2734","0.0015","7.0211","0.0009","13.0651","0.0017","90","","108.615","0.003","90","","1067","0.2","200","2","200","2","","","","","","","","3","P 1 21 1","P 2yb","4","Camphanic Acid Ester ent-16","","","- C23 H32 O6 -","- C23 H32 O6 -","- C46 H64 O12 -","2","1","","Christoph Schotes; Antonio Mezzetti","Asymmetric Diels-Alder Reactions of Unsaturated β-Ketoesters Catalyzed by Chiral Ruthenium PNNP Complexes","Journal of the American Chemical Society","2010","132","","3652","3653","10.1021/ja910039e","","","0.71073","MoKα","","0.0638","0.0461","","","0.0988","0.1203","","","","","","0.943","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102125","6.289","0.003","16.277","0.007","20.105","0.009","90","","98.535","0.008","90","","2035.3","1.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 N2 O3 S -","- C22 H20 N2 O3 S -","- C88 H80 N8 O12 S4 -","4","1","","Bo Qian; Shengmei Guo; Jianping Shao; Qiming Zhu; Lei Yang; Chungu Xia; Hanmin Huang","Palladium-Catalyzed Benzylic Addition of 2-Methyl Azaarenes to N-Sulfonyl Aldimines via C-H Bond Activation","Journal of the American Chemical Society","2010","132","","3650","3651","10.1021/ja910104n","","","0.71073","MoKα","","0.1412","0.0584","","","0.117","0.1475","","","","","","1.008","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102126","8.4123","0.0006","8.5007","0.0006","8.5524","0.0006","90.341","0.004","118.496","0.003","116.53","0.003","461.86","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H24 N2 O4 Pd -","- C18 H24 N2 O4 Pd -","- C18 H24 N2 O4 Pd -","1","0.5","","Bo Qian; Shengmei Guo; Jianping Shao; Qiming Zhu; Lei Yang; Chungu Xia; Hanmin Huang","Palladium-Catalyzed Benzylic Addition of 2-Methyl Azaarenes to N-Sulfonyl Aldimines via C-H Bond Activation","Journal of the American Chemical Society","2010","132","","3650","3651","10.1021/ja910104n","","","0.71073","MoKα","","0.0293","0.0286","","","0.0778","0.0784","","","","","","1.003","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102127","7.7112","0.0013","8.0808","0.0007","8.0888","0.0008","117.461","0.004","113.466","0.005","93.565","0.005","391.1","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Cl2 N2 Pd -","- C14 H18 Cl2 N2 Pd -","- C14 H18 Cl2 N2 Pd -","1","0.5","","Bo Qian; Shengmei Guo; Jianping Shao; Qiming Zhu; Lei Yang; Chungu Xia; Hanmin Huang","Palladium-Catalyzed Benzylic Addition of 2-Methyl Azaarenes to N-Sulfonyl Aldimines via C-H Bond Activation","Journal of the American Chemical Society","2010","132","","3650","3651","10.1021/ja910104n","","","0.71073","MoKα","","0.0226","0.0224","","","0.0596","0.0598","","","","","","1.072","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102128","10.209","0.003","13.82","0.004","14.469","0.004","90","","101.249","0.005","90","","2002.2","1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 N2 O2 S -","- C24 H22 N2 O2 S -","- C96 H88 N8 O8 S4 -","4","1","","Bo Qian; Shengmei Guo; Jianping Shao; Qiming Zhu; Lei Yang; Chungu Xia; Hanmin Huang","Palladium-Catalyzed Benzylic Addition of 2-Methyl Azaarenes to N-Sulfonyl Aldimines via C-H Bond Activation","Journal of the American Chemical Society","2010","132","","3650","3651","10.1021/ja910104n","","","0.71073","MoKα","","0.1141","0.0569","","","0.1263","0.1582","","","","","","0.972","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102129","20.083","0.003","22.576","0.004","34.101","0.006","81.279","0.009","88.262","0.009","82.512","0.009","15151","4","173","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C390 H515 Cd28 N42 O128 -","- C390 H531 Cd28 N42 O128 -","- C390 H531 Cd28 N42 O128 -","1","0.5","","Peter D. Frischmann; Glenn A. Facey; Phuong Y. Ghi; Amanda J. Gallant; David L. Bryce; Francesco Lelj; Mark J. MacLachlan","Capsule Formation, Carboxylate Exchange, and DFT Exploration of Cadmium Cluster Metallocavitands: Highly Dynamic Supramolecules","Journal of the American Chemical Society","2010","132","","3893","3908","10.1021/ja910419h","","","0.71073","MoKα","","0.1679","0.1158","","","0.2913","0.3266","","","","","","1.113","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102130","28.712","0.005","28.712","0.005","26.128","0.005","90","0.005","90","0.005","120","0.005","18654","6","173","2","293","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C33 H33 Cd3.5 N3 O14 -","- C33 H34.5 Cd3.5 N3 O14 -","- C396 H414 Cd42 N36 O168 -","12","0.333333","","Peter D. Frischmann; Glenn A. Facey; Phuong Y. Ghi; Amanda J. Gallant; David L. Bryce; Francesco Lelj; Mark J. MacLachlan","Capsule Formation, Carboxylate Exchange, and DFT Exploration of Cadmium Cluster Metallocavitands: Highly Dynamic Supramolecules","Journal of the American Chemical Society","2010","132","","3893","3908","10.1021/ja910419h","","","0.71069","MoKα","","0.1358","0.0911","","","0.2626","0.2992","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102131","9.694","0.005","13.247","0.006","13.861","0.007","90.283","0.008","97.568","0.007","99.833","0.008","1737.9","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","(Et3NH)[ReV(O)(PPh3)(ox)2]1.5EtOH","","","- C31 H40 N O10.5 P Re -","- C31 H40 N O10.5 P Re -","- C62 H80 N2 O21 P2 Re2 -","2","1","","Cameron A. Lippert; Stephen A. Arnstein; C. David Sherrill; Jake D. Soper","Redox-Active Ligands Facilitate Bimetallic O2 Homolysis at Five-Coordinate Oxorhenium(V) Centers","Journal of the American Chemical Society","2010","132","","3879","3892","10.1021/ja910500a","","","0.71073","MoKα","","0.0304","0.0278","","","0.0724","0.0738","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102132","13.6961","0.0017","23.198","0.003","15.4092","0.0019","90","","114.484","0.002","90","","4455.6","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Et3NH)[ReV(O)(apPh)2]0.25MeOH","","","- C46.25 H67 N3 O3.25 Re -","- C46.25 H67 N3 O3.25 Re -","- C185 H268 N12 O13 Re4 -","4","1","","Cameron A. Lippert; Stephen A. Arnstein; C. David Sherrill; Jake D. Soper","Redox-Active Ligands Facilitate Bimetallic O2 Homolysis at Five-Coordinate Oxorhenium(V) Centers","Journal of the American Chemical Society","2010","132","","3879","3892","10.1021/ja910500a","","","0.71073","MoKα","","0.0557","0.0433","","","0.0898","0.0951","","","","","","1.018","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102133","21.305","0.0004","11.085","0.0002","39.1021","0.0007","90","","90","","90","","9234.6","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","(Et4N)[ReVII(O)2(apPh)2]","","","- C48 H70 N3 O4 Re -","- C48 H70 N3 O4 Re -","- C384 H560 N24 O32 Re8 -","8","1","","Cameron A. Lippert; Stephen A. Arnstein; C. David Sherrill; Jake D. Soper","Redox-Active Ligands Facilitate Bimetallic O2 Homolysis at Five-Coordinate Oxorhenium(V) Centers","Journal of the American Chemical Society","2010","132","","3879","3892","10.1021/ja910500a","","","1.54178","CuKα","","0.0367","0.027","","","0.0609","0.0645","","","","","","1.022","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102134","18.014","0.004","24.694","0.005","26.113","0.005","90","","90","","90","","11616","4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H37.75 N2 O7 -","- C31 H37.75 N2 O7 -","- C496 H604 N32 O112 -","16","4","","Daisuke Kato; Yoshikazu Sasaki; Dale L. Boger","Asymmetric Total Synthesis of Vindoline","Journal of the American Chemical Society","2010","132","","3685","3687","10.1021/ja910695e","","","0.71073","MoKα","","0.152","0.0784","","","0.1919","0.2458","","","","","","0.992","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102135","7.8185","0.0016","8.3688","0.0017","22.032","0.004","90","","95","0.03","90","","1436.1","0.5","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H36 N2 O7 -","- C30 H36 N2 O7 -","- C60 H72 N4 O14 -","2","1","","Daisuke Kato; Yoshikazu Sasaki; Dale L. Boger","Asymmetric Total Synthesis of Vindoline","Journal of the American Chemical Society","2010","132","","3685","3687","10.1021/ja910695e","","","0.71073","MoKα","","0.0979","0.0758","","","0.1988","0.219","","","","","","0.908","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102136","19.509","0.005","7.3756","0.0019","9.32","0.003","90","","90","","90","","1341.1","0.7","173","2","173","2","","","","","","","","5","I m m a","-I 2b 2","74","","","","- C3.25 H2.25 Mn0.25 N0.25 O1.25 -","- C3.25 H2.25 Mn0.25 N0.25 O1.25 -","- C52 H36 Mn4 N4 O20 -","16","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0524","0.0455","","","0.1133","0.118","","","","","","1.094","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102137","7.3206","0.0004","18.7916","0.0012","11.0189","0.0007","90","","90","","90","","1515.82","0.16","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C7 H5.5 Mn0.5 N0.5 O2.5 -","- C7 H5.5 Mn0.5 N0.5 O2.5 -","- C56 H44 Mn4 N4 O20 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0264","0.0248","","","0.0617","0.0627","","","","","","1.098","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102138","7.4362","0.0012","10.2754","0.0016","10.923","0.003","114.436","0.004","104.89","0.004","96.042","0.003","712.8","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H13 Mn N O5 -","- C15 H13 Mn N O5 -","- C30 H26 Mn2 N2 O10 -","2","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0729","0.048","","","0.1094","0.1222","","","","","","1.027","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102139","18.2088","0.0011","17.7065","0.0011","13.3781","0.0008","90","","128.438","0.001","90","","3378.5","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H15 Mn N2 O6 -","- C16 H15 Mn N2 O6 -","- C128 H120 Mn8 N16 O48 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0602","0.0475","","","0.1377","0.1465","","","","","","1.079","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102140","13.502","0.002","10.1978","0.0015","17.707","0.003","90","","90","","90","","2438.1","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Mn2 N2 O10 -","- C22 H22 Mn2 N2 O10 -","- C88 H88 Mn8 N8 O40 -","4","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0883","0.0609","","","0.1521","0.1667","","","","","","1.087","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102141","17.627","0.003","18.138","0.003","12.564","0.002","90","","125.495","0.002","90","","3270.5","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H14 Mn N O6 -","- C15 H14 Mn N O6 -","- C120 H112 Mn8 N8 O48 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0736","0.0548","","","0.1434","0.1599","","","","","","1.063","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102142","16.37","0.005","19.019","0.005","11.193","0.005","90","0.005","119.543","0.005","90","0.005","3031.8","1.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H8 Mn N O5 -","- C13 H8 Mn N O5 -","- C104 H64 Mn8 N8 O40 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71069","MoKα","","0.0633","0.0442","","","0.1127","0.1256","","","","","","1.07","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102143","19.175","0.004","16.692","0.003","14.285","0.003","90","","130.087","0.002","90","","3498","1.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H14 Mn N O5 -","- C19 H14 Mn N O5 -","- C152 H112 Mn8 N8 O40 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.0965","0.0685","","","0.1953","0.2253","","","","","","1.081","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102144","19.0453","0.0016","16.9279","0.0015","14.3358","0.0013","90","","130.83","0.001","90","","3497.1","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Mn N O5 -","- C20 H16 Mn N O5 -","- C160 H128 Mn8 N8 O40 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71073","MoKα","","0.1476","0.0747","","","0.178","0.2268","","","","","","1.03","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102145","19.229","0.005","16.683","0.005","14.391","0.005","90","0.005","130.181","0.005","90","0.005","3527.1","1.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H13 Cl Mn N O5 -","- C19 H13 Cl Mn N O5 -","- C152 H104 Cl8 Mn8 N8 O40 -","8","1","","Guohai Xu; Xiaoguang Zhang; Peng Guo; Chengling Pan; Hongjie Zhang; Cheng Wang","MnII-based MIL-53 Analogues: Synthesis Using Neutral Bridging μ2-Ligands and Application in Liquid-Phase Adsorption and Separation of C6-C8 Aromatics","Journal of the American Chemical Society","2010","132","","3656","3657","10.1021/ja910818a","","","0.71069","MoKα","","0.1512","0.0731","","","0.1694","0.2237","","","","","","1.029","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102146","9.0923","0.0012","10.9151","0.0014","15.353","0.002","84.402","0.002","88.593","0.002","89.179","0.002","1515.9","0.3","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H17 N3 O Pd -","- C16 H17 N3 O Pd -","- C64 H68 N12 O4 Pd4 -","4","2","","Dmitry Shabashov; Olafs Daugulis","Auxiliary-Assisted Palladium-Catalyzed Arylation and Alkylation of sp2 and sp3 Carbon-Hydrogen Bonds","Journal of the American Chemical Society","2010","132","","3965","3972","10.1021/ja910900p","","","0.71073","MoKα","","0.0524","0.0388","","","0.111","0.1279","","","","","","1.151","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102147","9.948","0.0009","10.5972","0.0009","11.8562","0.001","94.143","0.001","96.995","0.001","96.737","0.001","1227.27","0.18","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H25 Br2 Cl2 N3 O Pd -","- C20 H25 Br2 Cl2 N3 O Pd -","- C40 H50 Br4 Cl4 N6 O2 Pd2 -","2","1","","Dmitry Shabashov; Olafs Daugulis","Auxiliary-Assisted Palladium-Catalyzed Arylation and Alkylation of sp2 and sp3 Carbon-Hydrogen Bonds","Journal of the American Chemical Society","2010","132","","3965","3972","10.1021/ja910900p","","","0.71073","MoKα","","0.0337","0.0286","","","0.0786","0.0822","","","","","","1.008","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102148","10.5629","0.0008","11.9119","0.0009","12.1271","0.0009","64.813","0.001","75.015","0.001","82.151","0.001","1333.24","0.17","139","","139","","","","","","","","","6","P -1","-P 1","2","","","","- C46 H90 Cl4 N6 O2 Re -","- C42 H90 Cl4 N6 O2 Re -","- C42 H90 Cl4 N6 O2 Re -","1","0.5","","T. David Harris; Miriam V. Bennett; Rodolphe Clérac; Jeffrey R. Long","[ReCl4(CN)2]2-: A High Magnetic Anisotropy Building Unit Giving Rise to the Single-Chain Magnets (DMF)4MReCl4(CN)2 (M = Mn, Fe, Co, Ni)","Journal of the American Chemical Society","2010","132","","3980","3988","10.1021/ja910963x","","","0.71073","MoKα","","0.0338","0.0337","","0.0859","0.0857","","","","1.045","1.046","1.046","","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102149","9.9185","0.0009","10.7121","0.001","14.026","0.0013","68.078","0.001","77.779","0.001","68.909","0.001","1284.7","0.2","149","","149","","","","","","","","","7","P -1","-P 1","2","","","","- C14 H28 Cl4 Mn N6 O4 Re -","- C14 H24 Cl4 Mn N6 O4 Re -","- C28 H48 Cl8 Mn2 N12 O8 Re2 -","2","1","","T. David Harris; Miriam V. Bennett; Rodolphe Clérac; Jeffrey R. Long","[ReCl4(CN)2]2-: A High Magnetic Anisotropy Building Unit Giving Rise to the Single-Chain Magnets (DMF)4MReCl4(CN)2 (M = Mn, Fe, Co, Ni)","Journal of the American Chemical Society","2010","132","","3980","3988","10.1021/ja910963x","","","0.71073","MoKα","","0.0488","0.0366","","","0.0915","0.0995","","","","","","0.994","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102150","9.8745","0.0007","10.5846","0.0007","13.9378","0.001","68.131","0.004","78.315","0.004","69.294","0.004","1260.37","0.16","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H28 Cl4 Fe N6 O4 Re -","- C14 H24 Cl4 Fe N6 O4 Re -","- C28 H48 Cl8 Fe2 N12 O8 Re2 -","2","1","","T. David Harris; Miriam V. Bennett; Rodolphe Clérac; Jeffrey R. Long","[ReCl4(CN)2]2-: A High Magnetic Anisotropy Building Unit Giving Rise to the Single-Chain Magnets (DMF)4MReCl4(CN)2 (M = Mn, Fe, Co, Ni)","Journal of the American Chemical Society","2010","132","","3980","3988","10.1021/ja910963x","","","1.54178","CuKα","","0.0377","0.0306","","","0.0958","0.1026","","","","","","1.927","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102151","9.9575","0.001","10.5493","0.0013","13.9144","0.0014","67.882","0.001","86.275","0.001","69.659","0.002","1266","0.2","155","","155","","","","","","","","","7","P -1","-P 1","2","","","","- C14 H28 Cl4 Co N6 O4 Re -","- C14 H24 Cl4 Co N6 O4 Re -","- C28 H48 Cl8 Co2 N12 O8 Re2 -","2","1","","T. David Harris; Miriam V. Bennett; Rodolphe Clérac; Jeffrey R. Long","[ReCl4(CN)2]2-: A High Magnetic Anisotropy Building Unit Giving Rise to the Single-Chain Magnets (DMF)4MReCl4(CN)2 (M = Mn, Fe, Co, Ni)","Journal of the American Chemical Society","2010","132","","3980","3988","10.1021/ja910963x","","","0.71073","MoKα","","0.0589","0.0401","","0.1133","0.1004","","","","1.004","1.062","1.062","","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102152","51.67","0.006","51.67","0.006","51.67","0.006","90","","90","","90","","137948","3","120","2","120","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C102 H194 Cu3 N16 O57 -","- C54 H24 Cu3 O15 -","- C1728 H768 Cu96 O480 -","32","0.166667","","Yong Yan; Irvin Telepeni; Sihai Yang; Xiang Lin; Winfried Kockelmann; Anne Dailly; Alexander J. Blake; William Lewis; Gavin S. Walker; David R. Allan; Sarah A. Barnett; Neil R. Champness; Martin Schröder","Metal-Organic Polyhedral Frameworks: High H2 Adsorption Capacities and Neutron Powder Diffraction Studies","Journal of the American Chemical Society","2010","132","","4092","4094","10.1021/ja1001407","","","0.6889","Synchrotron","","0.115","0.104","","","0.297","0.308","","","","","","1.18","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102153","6.2423","0.0009","8.328","0.0013","25.041","0.004","90","","90","","90","","1301.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H13 Br O3 -","- C14 H13 Br O3 -","- C56 H52 Br4 O12 -","4","1","","Qing Gu; Zi-Qiang Rong; Chao Zheng; Shu-Li You","Desymmetrization of Cyclohexadienones via Brønsted Acid-Catalyzed Enantioselective Oxo-Michael Reaction","Journal of the American Chemical Society","2010","132","","4056","4057","10.1021/ja100207s","","","0.71073","MoKα","","0.0594","0.0432","","","0.0935","0.0985","","","","","","0.882","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102154","12.1037","0.0009","12.5612","0.0009","15.1027","0.0011","90","","94.4358","0.0013","90","","2289.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H11 B11 Cl12 -","- C5 H11 B11 Cl12 -","- C20 H44 B44 Cl48 -","4","1","","Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed","Dialkyl Chloronium Ions","Journal of the American Chemical Society","2010","132","","4062","4063","10.1021/ja100297b","","","0.71073","MoKα","","0.0583","0.0448","","","0.1071","0.1153","","","","","","1.071","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102155","10.2876","0.0003","13.1974","0.0004","15.9965","0.0005","90","","90","","90","","2171.84","0.11","100","2","100","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C3 H7 B11 Cl12 -","- C3 H7 B11 Cl12 -","- C12 H28 B44 Cl48 -","4","0.5","","Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed","Dialkyl Chloronium Ions","Journal of the American Chemical Society","2010","132","","4062","4063","10.1021/ja100297b","","","0.71073","MoKα","","0.0301","0.0245","","","0.0603","0.0628","","","","","","1.061","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102156","11.5301","0.0003","13.0178","0.0003","15.2397","0.0004","87.068","0.001","86.218","0.002","67.149","0.001","2102.5","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H52 N6 O2 -","- C50 H52 N6 O2 -","- C100 H104 N12 O4 -","2","1","","Diego Bagnis; Luca Beverina; Hui Huang; Fabio Silvestri; Yan Yao; Henry Yan; Giorgio A. Pagani; Tobin J. Marks; Antonio Facchetti","Marked Alkyl- vs Alkenyl-Substitutent Effects on Squaraine Dye Solid-State Structure, Carrier Mobility, and Bulk-Heterojunction Solar Cell Efficiency","Journal of the American Chemical Society","2010","132","","4074","4075","10.1021/ja100520q","","","1.54178","CuKα","","0.053","0.0388","","","0.0976","0.1062","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102157","10.0064","0.0009","10.014","0.002","11.6495","0.0011","100.379","0.01","114.691","0.006","94.897","0.009","1026.3","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H48 N6 O2 -","- C50 H48 N6 O2 -","- C50 H48 N6 O2 -","1","0.5","","Diego Bagnis; Luca Beverina; Hui Huang; Fabio Silvestri; Yan Yao; Henry Yan; Giorgio A. Pagani; Tobin J. Marks; Antonio Facchetti","Marked Alkyl- vs Alkenyl-Substitutent Effects on Squaraine Dye Solid-State Structure, Carrier Mobility, and Bulk-Heterojunction Solar Cell Efficiency","Journal of the American Chemical Society","2010","132","","4074","4075","10.1021/ja100520q","","","1.54178","CuKα","","0.1151","0.055","","","0.1158","0.1403","","","","","","0.967","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102158","5.45891","0.0001","11.3397","0.0002","28.9935","0.0005","90","","90","","90","","1794.77","0.06","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H21 Br N2 O2 -","- C20 H21 Br N2 O2 -","- C80 H84 Br4 N8 O8 -","4","1","","Takuya Hashimoto; Yuko Maeda; Masato Omote; Hiroki Nakatsu; Keiji Maruoka","Catalytic Enantioselective 1,3-Dipolar Cycloaddition of C,N-Cyclic Azomethine Imines with α,β-Unsaturated Aldehydes","Journal of the American Chemical Society","2010","132","","4076","4077","10.1021/ja100787a","","","1.54187","CuKα","","","0.0366","","","","0.0898","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102159","9.46167","0.00017","11.9002","0.0002","15.0505","0.0003","90","","90","","90","","1694.62","0.05","123.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H26 N2 O2 -","- C18 H26 N2 O2 -","- C72 H104 N8 O8 -","4","1","","Takuya Hashimoto; Yuko Maeda; Masato Omote; Hiroki Nakatsu; Keiji Maruoka","Catalytic Enantioselective 1,3-Dipolar Cycloaddition of C,N-Cyclic Azomethine Imines with α,β-Unsaturated Aldehydes","Journal of the American Chemical Society","2010","132","","4076","4077","10.1021/ja100787a","","","1.54187","CuKα","","","0.0334","","","","0.0877","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102160","6.10829","0.00012","7.5097","0.00015","17.8862","0.0003","90","","93.2667","0.0012","90","","819.13","0.03","143.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H24 N2 O2 -","- C17 H24 N2 O2 -","- C34 H48 N4 O4 -","2","1","","Takuya Hashimoto; Yuko Maeda; Masato Omote; Hiroki Nakatsu; Keiji Maruoka","Catalytic Enantioselective 1,3-Dipolar Cycloaddition of C,N-Cyclic Azomethine Imines with α,β-Unsaturated Aldehydes","Journal of the American Chemical Society","2010","132","","4076","4077","10.1021/ja100787a","","","1.54187","CuKα","","","0.049","","","","0.158","","","","","","1.141","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102161","8.35231","0.00018","10.24","0.0002","9.641","0.0002","90","","91.1862","0.0014","90","","824.4","0.03","123.1","","123","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H26 N2 O2 -","- C18 H26 N2 O2 -","- C36 H52 N4 O4 -","2","1","","Takuya Hashimoto; Yuko Maeda; Masato Omote; Hiroki Nakatsu; Keiji Maruoka","Catalytic Enantioselective 1,3-Dipolar Cycloaddition of C,N-Cyclic Azomethine Imines with α,β-Unsaturated Aldehydes","Journal of the American Chemical Society","2010","132","","4076","4077","10.1021/ja100787a","","","1.54187","CuKα","","","0.0426","","","","0.1148","","","","","","1.101","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102162","20.888","0.003","11.7854","0.0019","21.287","0.003","90","","119.255","0.001","90","","4571.9","1.2","143","1","143","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C50 H56 N8 Ru2 -","- C50 H56 N8 Ru2 -","- C200 H224 N32 Ru8 -","4","0.5","","Noah L. Wieder; Michelle Gallagher; Patrick J. Carroll; Donald H. Berry","Evidence for Ligand Non-innocence in a Formally Ruthenium(I) Hydride Complex","Journal of the American Chemical Society","2010","132","","4107","4109","10.1021/ja100894h","","","0.71069","MoKα","","0.0642","0.0565","","","0.1353","0.1413","","","","","","1.115","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102163","30.748","0.018","7.12","0.004","15.932","0.009","90","","90","","90","","3488","3","150","2","150","2","","","","","","","","5","C m m m","-C 2 2","65","InPyrene","","","- C53 H53 In2 N3 O17 -","- C48 H24 In2 O10 -","- C96 H48 In4 O20 -","2","0.125","","Kyriakos C. Stylianou; Romain Heck; Samantha Y. Chong; John Bacsa; James T. A. Jones; Yaroslav Z. Khimyak; Darren Bradshaw; Matthew J. Rosseinsky","A Guest-Responsive Fluorescent 3D Microporous Metal-Organic Framework Derived from a Long-Lifetime Pyrene Core","Journal of the American Chemical Society","2010","132","","4119","4130","10.1021/ja906041f","","","0.71073","synchrotron","","0.0943","0.063","","","0.164","0.1741","","","","","","0.975","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102164","10.28","0.0002","12.077","0.0002","15.155","0.0003","104.021","0.001","97.014","0.001","110.291","0.001","1667.67","0.06","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H40 Mn3 N2 O9 Se3 -","- C25 H40 Mn3 N2 O9 Se3 -","- C50 H80 Mn6 N4 O18 Se6 -","2","1","","Minghuey Shieh; Chia-Hua Ho; Wen-Shyan Sheu; Horng-Wen Chen","Selective Insertion of Oxygen and Selenium into an Electron-Precise Paramagnetic Selenium-Manganese Carbonyl Cluster [Se6Mn6(CO)18]4-","Journal of the American Chemical Society","2010","132","","4032","4033","10.1021/ja9091566","","","0.71073","MoKα","","0.079","0.0689","","","0.1807","0.1948","","","","","","1.123","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102165","11.7889","0.0003","17.6115","0.0004","17.7074","0.0004","89.438","0.001","88.132","0.001","72.987","0.001","3513.66","0.14","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H80 Mn6 N4 O19 Se6 -","- C50 H80 Mn6 N4 O19 Se6 -","- C100 H160 Mn12 N8 O38 Se12 -","2","1","","Minghuey Shieh; Chia-Hua Ho; Wen-Shyan Sheu; Horng-Wen Chen","Selective Insertion of Oxygen and Selenium into an Electron-Precise Paramagnetic Selenium-Manganese Carbonyl Cluster [Se6Mn6(CO)18]4-","Journal of the American Chemical Society","2010","132","","4032","4033","10.1021/ja9091566","","","0.71073","MoKα","","0.0741","0.0524","","","0.1383","0.1507","","","","","","1.035","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102166","10.9764","0.0003","13.6988","0.0004","24.3835","0.0009","90","","92.289","0.001","90","","3663.5","0.2","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H80 Mn6 N4 O18 Se10 -","- C50 H80 Mn6 N4 O18 Se10 -","- C100 H160 Mn12 N8 O36 Se20 -","2","0.5","","Minghuey Shieh; Chia-Hua Ho; Wen-Shyan Sheu; Horng-Wen Chen","Selective Insertion of Oxygen and Selenium into an Electron-Precise Paramagnetic Selenium-Manganese Carbonyl Cluster [Se6Mn6(CO)18]4-","Journal of the American Chemical Society","2010","132","","4032","4033","10.1021/ja9091566","","","0.71073","MoKα","","0.1354","0.071","","","0.1806","0.2264","","","","","","1.05","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102167","15.0449","0.0008","15.0449","0.0008","81.101","0.006","90","","90","","120","","15897.7","1.7","100","2","100","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C53.5 H87 Fe N3 P3 Si -","- C53.4 H86.85 Fe N2.97 P3 Si -","- C640.8 H1042.2 Fe12 N35.64 P36 Si12 -","12","0.333333","","Neal P. Mankad; Peter Müller; Jonas C. Peters","Catalytic N-N Coupling of Aryl Azides To Yield Azoarenes via trigonal Bipyramid Iron-Nitrene Intermediates","Journal of the American Chemical Society","2010","132","","4083","4085","10.1021/ja910224c","","","0.71073","MoKα","","0.0588","0.0516","","","0.1168","0.12","","","","","","1.21","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102168","13.4209","0.0018","14.619","0.002","21.192","0.003","90","","90","","90","","4157.9","1","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[SiPiPr3]Fe(NHTol)","","","- C43 H62 Fe N P3 Si -","- C43 H62 Fe N P3 Si -","- C172 H248 Fe4 N4 P12 Si4 -","4","1","","Neal P. Mankad; Peter Müller; Jonas C. Peters","Catalytic N-N Coupling of Aryl Azides To Yield Azoarenes via trigonal Bipyramid Iron-Nitrene Intermediates","Journal of the American Chemical Society","2010","132","","4083","4085","10.1021/ja910224c","","","0.71073","MoKα","","0.0587","0.0419","","","0.082","0.0899","","","","","","1.011","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102169","26.847","0.004","26.847","0.004","33.221","0.007","90","","90","","120","","20736","6","173","2","173","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C168 H222 Cl4 Mn25 N15 O112 -","- C168 H222 Cl4 Mn25 N15 O112 -","- C504 H666 Cl12 Mn75 N45 O336 -","3","0.333333","","Cai-Ming Liu; Ren-Gen Xiong; De-Qing Zhang; Dao-Ben Zhu","Nanoscale Homochiral C3-Symmetric Mixed-Valence Manganese Cluster Complexes with Both Ferromagnetic and Ferroelectric Properties","Journal of the American Chemical Society","2010","132","","4044","4045","10.1021/ja910310p","","","0.71073","MoKα","","0.08","0.0743","","","0.2139","0.2206","","","","","","1.101","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102170","26.933","0.004","26.933","0.004","33.251","0.007","90","","90","","120","","20888","6","173","2","173","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C168 H222 Cl4 Mn25 N15 O112 -","- C168 H222 Cl4 Mn25 N15 O112 -","- C504 H666 Cl12 Mn75 N45 O336 -","3","0.333333","","Cai-Ming Liu; Ren-Gen Xiong; De-Qing Zhang; Dao-Ben Zhu","Nanoscale Homochiral C3-Symmetric Mixed-Valence Manganese Cluster Complexes with Both Ferromagnetic and Ferroelectric Properties","Journal of the American Chemical Society","2010","132","","4044","4045","10.1021/ja910310p","","","0.71073","MoKα","","0.0672","0.0654","","","0.1816","0.1844","","","","","","1.085","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102171","8.5394","0.0004","10.3251","0.0005","16.5699","0.0008","94.324","0.004","101.046","0.003","114.318","0.003","1287.09","0.11","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 Si2 Ti -","- C28 H32 Si2 Ti -","- C56 H64 Si4 Ti2 -","2","1","","Martin Lamač; Anke Spannenberg; Wolfgang Baumann; Haijun Jiao; Christine Fischer; Sven Hansen; Perdita Arndt; Uwe Rosenthal","Si-H Bond Activation of Alkynylsilanes by Group 4 Metallocene Complexes","Journal of the American Chemical Society","2010","132","","4369","4380","10.1021/ja910527w","","","0.71073","MoKα","","0.0535","0.0322","","","0.0722","0.0757","","","","","","0.86","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102172","32.0481","0.001","9.1762","0.0002","20.1421","0.0007","90","","113.035","0.002","90","","5451.1","0.3","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H38 Hf Si4 -","- C22 H38 Hf Si4 -","- C176 H304 Hf8 Si32 -","8","1","","Martin Lamač; Anke Spannenberg; Wolfgang Baumann; Haijun Jiao; Christine Fischer; Sven Hansen; Perdita Arndt; Uwe Rosenthal","Si-H Bond Activation of Alkynylsilanes by Group 4 Metallocene Complexes","Journal of the American Chemical Society","2010","132","","4369","4380","10.1021/ja910527w","","","0.71073","MoKα","","0.0328","0.0199","","","0.0416","0.0433","","","","","","0.894","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102173","16.8109","0.0005","10.2196","0.0003","14.9047","0.0005","90","","109.929","0.002","90","","2407.3","0.13","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H35 Hf P Si2 -","- C20 H35 Hf P Si2 -","- C80 H140 Hf4 P4 Si8 -","4","1","","Martin Lamač; Anke Spannenberg; Wolfgang Baumann; Haijun Jiao; Christine Fischer; Sven Hansen; Perdita Arndt; Uwe Rosenthal","Si-H Bond Activation of Alkynylsilanes by Group 4 Metallocene Complexes","Journal of the American Chemical Society","2010","132","","4369","4380","10.1021/ja910527w","","","0.71073","MoKα","","0.066","0.0363","","","0.0652","0.0697","","","","","","0.972","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102174","8.1828","0.0002","10.4511","0.0003","20.5913","0.0006","88.056","0.002","84.173","0.002","80.283","0.002","1726.47","0.08","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H38 Hf Si4 -","- C38 H38 Hf Si4 -","- C76 H76 Hf2 Si8 -","2","1","","Martin Lamač; Anke Spannenberg; Wolfgang Baumann; Haijun Jiao; Christine Fischer; Sven Hansen; Perdita Arndt; Uwe Rosenthal","Si-H Bond Activation of Alkynylsilanes by Group 4 Metallocene Complexes","Journal of the American Chemical Society","2010","132","","4369","4380","10.1021/ja910527w","","","0.71073","MoKα","","0.0323","0.0246","","","0.0532","0.0543","","","","","","0.91","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102175","9.2758","0.0002","12.5624","0.0003","17.6005","0.0003","90","","90.212","0.001","90","","2050.91","0.07","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H58 I2 N4 O2 U -","- C38 H58 I2 N4 O2 U -","- C76 H116 I4 N8 O4 U2 -","2","0.5","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.0473","0.0403","","","0.0861","0.0888","","","","","","1.163","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102176","9.7094","0.0002","16.401","0.0004","16.4221","0.0004","106.65","0.001","94.867","0.001","106.296","0.001","2365.67","0.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H74 Ce I N4 O Si5 -","- C34 H74 Ce I N4 O Si5 -","- C68 H148 Ce2 I2 N8 O2 Si10 -","2","1","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.0403","0.0341","","","0.0691","0.0727","","","","","","1.142","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102177","13.71","0.0006","14.9679","0.0007","14.9982","0.0007","88.187","0.003","81.333","0.002","72.347","0.002","2899","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H172 Ce2 N14 O2 Si10 -","- C92 H172 Ce2 N14 O2 Si10 -","- C92 H172 Ce2 N14 O2 Si10 -","1","0.5","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.0546","0.0459","","","0.1029","0.1071","","","","","","1.178","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102178","9.6227","0.0008","16.3315","0.0013","16.4128","0.0014","106.924","0.004","94.311","0.004","106.275","0.004","2334","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H74 I N4 O Si5 Y -","- C34 H74 I N4 O Si5 Y -","- C68 H148 I2 N8 O2 Si10 Y2 -","2","1","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.0395","0.0296","","","0.069","0.073","","","","","","1.038","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102179","9.6898","0.0002","16.4169","0.0004","16.4228","0.0004","106.812","0.001","94.571","0.001","106.326","0.001","2362.84","0.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H74 I N4 O Si5 U -","- C34 H74 I N4 O Si5 U -","- C68 H148 I2 N8 O2 Si10 U2 -","2","1","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.0531","0.047","","","0.0938","0.0981","","","","","","1.213","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102180","20.3248","0.001","10.7829","0.0005","19.9568","0.0009","90","","110.601","0.002","90","","4094.1","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H56 N4 O Si4 U -","- C31 H56 N4 O Si4 U -","- C124 H224 N16 O4 Si16 U4 -","4","1","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.0456","0.0336","","","0.0755","0.0811","","","","","","1.071","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102181","12.5342","0.0007","65.014","0.003","21.5322","0.001","90","","103.097","0.003","90","","17090.1","1.5","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H80 Ce N7 O Si4 -","- C41 H80 Ce N7 O Si4 -","- C492 H960 Ce12 N84 O12 Si48 -","12","3","","Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold","Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes","Journal of the American Chemical Society","2010","132","","4050","4051","10.1021/ja910673q","","","0.71073","MoKα","","0.1","0.0951","","0.0825","0.082","0.082","","","","","","1.1032","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102182","11.2956","0.0011","11.9428","0.001","17.5109","0.0016","77.449","0.007","76.951","0.007","77.429","0.007","2210.7","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H42 O9 P Pd S -","- C38 H42 O9 P Pd S -","- C76 H84 O18 P2 Pd2 S2 -","2","1","","Damien Guironnet; Lucia Caporaso; Boris Neuwald; Inigo Göttker-Schnetmann; Luigi Cavallo; Stefan Mecking","Mechanistic Insights on Acrylate Insertion Polymerization","Journal of the American Chemical Society","2010","132","","4418","4426","10.1021/ja910760n","","","0.71073","MoKα","","0.0656","0.0488","","","0.1316","0.1393","","","","","","1.057","","","","has coordinates,has disorder","178767","2020-10-21","18:00:00","" "4102183","8.3124","0.0003","9.5889","0.0003","21.4172","0.0006","90","","90","","90","","1707.1","0.09","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 O6 -","- C18 H24 O6 -","- C72 H96 O24 -","4","1","","Hui Zhou; Kangjian Qiao; Zhizeng Gao; Michael J. Meehan; Jesse W.-H. Li; Xiling Zhao; Pieter C. Dorrestein; John C. Vederas; Yi Tang","Enzymatic Synthesis of Resorcylic Acid Lactones by Cooperation of Fungal Iterative Polyketide Synthases Involved in Hypothemycin Biosynthesis","Journal of the American Chemical Society","2010","132","","4530","4531","10.1021/ja100060k","","","0.71073","MoKα","","0.0283","0.0276","","","0.0764","0.0771","","","","","","1.04","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102184","5.6995","0.0014","5.6995","0.0014","23.799","0.006","90","","90","","120","","669.5","0.3","","","293","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba0.208 Co0.208 F0.042 O0.542 -","- Ba0.416667 Co0.416667 F0.063375 O1.08333 -","- Ba10 Co10 F1.521 O25.9998 -","24","1","","Olivier Mentré; Houria Kabbour; Ghislaine Ehora; Grégory Tricot; Sylvie Daviero-Minaud; Myung-Hwan Whangbo","Anion-Vacancy-Induced Magneto-Crystalline Anisotropy in Fluorine-Doped hexagonal Cobaltites","Journal of the American Chemical Society","2010","132","","4865","4875","10.1021/ja100170m","","","0.71073","MoKα","","0.032","0.0227","","","0.0225","0.0234","","","","2.96","2.96","2.82","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102185","5.71","0.002","5.71","0.002","23.925","0.01","90","","90","","120","","675.5","0.4","","","293","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba0.417 Co0.417 F0.083 O1.083 -","- Ba0.416667 Co0.416667 F0.063375 O1.08333 -","- Ba10 Co10 F1.521 O25.9998 -","24","1","","Olivier Mentré; Houria Kabbour; Ghislaine Ehora; Grégory Tricot; Sylvie Daviero-Minaud; Myung-Hwan Whangbo","Anion-Vacancy-Induced Magneto-Crystalline Anisotropy in Fluorine-Doped hexagonal Cobaltites","Journal of the American Chemical Society","2010","132","","4865","4875","10.1021/ja100170m","","","0.71073","MoKα","","0.0328","0.022","","","0.0221","0.023","","","","2.94","2.94","2.74","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102186","13.3502","0.0007","15.9899","0.0008","17.0757","0.0008","90","","90","","90","","3645.1","0.3","148","2","148","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 N2 O6 -","- C20 H25 N2 O6 -","- C160 H200 N16 O48 -","8","2","","Connor L. Martin; Larry E. Overman; Jason M. Rohde","Total Synthesis of (\±)- and (-)-Actinophyllic Acid","Journal of the American Chemical Society","2010","132","","4894","4906","10.1021/ja100178u","","","0.71073","MoKα","","0.0566","0.0521","","","0.1327","0.1368","","","","","","1.024","","","","has coordinates","211332","2020-10-21","18:00:00","" "4102187","11.3371","0.0006","16.2005","0.0009","18.065","0.001","90","","105.481","0.001","90","","3197.6","0.3","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H40 N2 O8 S -","- C32 H40 N2 O8 S -","- C128 H160 N8 O32 S4 -","4","1","","Connor L. Martin; Larry E. Overman; Jason M. Rohde","Total Synthesis of (\±)- and (-)-Actinophyllic Acid","Journal of the American Chemical Society","2010","132","","4894","4906","10.1021/ja100178u","","","0.71073","MoKα","","0.0449","0.0361","","","0.0917","0.0974","","","","","","1.038","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102188","13.271","0.002","15.261","0.003","15.572","0.003","90","","90","","90","","3153.8","1","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 N2 O4.5 -","- C18 H18 N2 O4.5 -","- C144 H144 N16 O36 -","8","2","","Connor L. Martin; Larry E. Overman; Jason M. Rohde","Total Synthesis of (\±)- and (-)-Actinophyllic Acid","Journal of the American Chemical Society","2010","132","","4894","4906","10.1021/ja100178u","","","0.71073","MoKα","","0.0785","0.0647","","","0.1775","0.1882","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102189","4.83377","0.00008","12.57757","0.00018","14.80061","0.0003","90","","93.2827","0.0016","90","","898.36","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","HBPTSMe","","","- C12 H8 N6 S4 Se4 -","- C12 H8 N6 S4 Se4 -","- C24 H16 N12 S8 Se8 -","2","0.5","","John S. Tse; Alicea A. Leitch; Xueyang Yu; Xuezhao Bao; Sijia Zhang; Qingqing Liu; Changqing Jin; Richard A. Secco; Serge Desgreniers; Yasuo Ohishi; Richard T. Oakley","Metallization of a Hypervalent Radical Dimer: Molecular and Band Perspectives","Journal of the American Chemical Society","2010","132","","4876","4886","10.1021/ja100216c","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.11541","","","","","","","","","has coordinates,has Fobs","178767","2020-10-21","18:00:00","" "4102190","4.60771","0.00012","12.69423","0.0002","14.0065","0.0004","90","","89.3851","0.002","90","","819.21","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","HBPTSMe","","","- C12 H8 N6 S4 Se4 -","- C12 H8 N6 S4 Se4 -","- C24 H16 N12 S8 Se8 -","2","0.5","","John S. Tse; Alicea A. Leitch; Xueyang Yu; Xuezhao Bao; Sijia Zhang; Qingqing Liu; Changqing Jin; Richard A. Secco; Serge Desgreniers; Yasuo Ohishi; Richard T. Oakley","Metallization of a Hypervalent Radical Dimer: Molecular and Band Perspectives","Journal of the American Chemical Society","2010","132","","4876","4886","10.1021/ja100216c","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.15233","","","","","","","","","has coordinates,has Fobs","178767","2020-10-21","18:00:00","" "4102191","4.5743","0.00014","12.67862","0.00024","13.8297","0.0004","90","","88.6518","0.0026","90","","801.84","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","HBPTSMe","","","- C6 H4 N3 S2 Se2 -","- C6 H4 N3 S2 Se2 -","- C24 H16 N12 S8 Se8 -","4","1","","John S. Tse; Alicea A. Leitch; Xueyang Yu; Xuezhao Bao; Sijia Zhang; Qingqing Liu; Changqing Jin; Richard A. Secco; Serge Desgreniers; Yasuo Ohishi; Richard T. Oakley","Metallization of a Hypervalent Radical Dimer: Molecular and Band Perspectives","Journal of the American Chemical Society","2010","132","","4876","4886","10.1021/ja100216c","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.11696","","","","","","","","","has coordinates,has Fobs","178767","2020-10-21","18:00:00","" "4102192","3.94301","0.00009","14.08054","0.00031","13.2227","0.0004","90","","85.5588","0.0028","90","","731.92","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","HBPTSMe","","","- C6 H4 N3 S2 Se2 -","- C6 H4 N3 S2 Se2 -","- C24 H16 N12 S8 Se8 -","4","1","","John S. Tse; Alicea A. Leitch; Xueyang Yu; Xuezhao Bao; Sijia Zhang; Qingqing Liu; Changqing Jin; Richard A. Secco; Serge Desgreniers; Yasuo Ohishi; Richard T. Oakley","Metallization of a Hypervalent Radical Dimer: Molecular and Band Perspectives","Journal of the American Chemical Society","2010","132","","4876","4886","10.1021/ja100216c","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.05868","","","","","","","","","has coordinates,has Fobs","178767","2020-10-21","18:00:00","" "4102193","3.73682","0.00019","14.0175","0.0006","12.742","0.0009","90","","87.144","0.006","90","","666.61","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","HBPTSMe","","","- C6 H4 N3 S2 Se2 -","- C6 H4 N3 S2 Se2 -","- C24 H16 N12 S8 Se8 -","4","1","","John S. Tse; Alicea A. Leitch; Xueyang Yu; Xuezhao Bao; Sijia Zhang; Qingqing Liu; Changqing Jin; Richard A. Secco; Serge Desgreniers; Yasuo Ohishi; Richard T. Oakley","Metallization of a Hypervalent Radical Dimer: Molecular and Band Perspectives","Journal of the American Chemical Society","2010","132","","4876","4886","10.1021/ja100216c","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.13519","","","","","","","","","has coordinates,has Fobs","178767","2020-10-21","18:00:00","" "4102194","14.5313","0.0013","13.9827","0.0013","14.7422","0.0014","90","","90","","90","","2995.4","0.5","100","2","100","2","","","","","","","","5","C m c 21","C 2c -2","36","(Et4N)[Ni(PyN2(Me2))OH]","","","- C31 H42 N4 Ni O3 -","- C31 H22 N4 Ni O3 -","- C124 H88 N16 Ni4 O12 -","4","0.5","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0476","0.0462","","","0.1224","0.1242","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102195","15.881","0.004","9.182","0.002","10.685","0.002","90","","90","","90","","1558.1","0.6","100","2","100","2","","","","","","","","6","I m m 2","I 2 -2","44","(Et4N)[Ni(PyN2(Me2))Cl].CH2Cl2","","","- C32 H43 Cl3 N4 Ni O2 -","- C32 H21 Cl3 N4 Ni O2 -","- C64 H42 Cl6 N8 Ni2 O4 -","2","0.25","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0614","0.06","","","0.1639","0.1657","","","","","","1.139","","","","has coordinates","178767","2020-10-21","18:00:00","" "4102196","15.698","0.008","9.143","0.005","10.847","0.005","90","","90","","90","","1556.8","1.4","100","2","100","2","","","","","","","","6","I m m 2","I 2 -2","44","(Et4N)[Ni(PyN2(Me2))SH]","","","- C31 H42 N4 Ni O2 S -","- C31 H22 N4 Ni O2 S -","- C62 H44 N8 Ni2 O4 S2 -","2","0.25","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0514","0.0476","","","0.122","0.125","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102197","18.421","0.005","14.485","0.004","11.217","0.003","90","","90","","90","","2993","1.4","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","(Et4N)[Ni(PyN2(Me2))HCO2]","","","- C32 H42 N4 Ni O4 -","- C32 H42 N4 Ni O4 -","- C128 H168 N16 Ni4 O16 -","4","0.5","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0952","0.0855","","","0.2115","0.2152","","","","","","1.273","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102198","15.572","0.005","9.016","0.003","10.919","0.004","90","","90","","90","","1533","0.9","100","2","100","2","","","","","","","","5","I m m 2","I 2 -2","44","(Et4N)[Ni(PyN2(Me2))CN]","","","- C32 H41 N5 Ni O2 -","- C32 H21 N5 Ni O2 -","- C64 H42 N10 Ni2 O4 -","2","0.25","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0391","0.0383","","","0.1021","0.1036","","","","","","1.1","","","","has coordinates","194617","2020-10-21","18:00:00","" "4102199","16.056","0.004","14.017","0.004","17.828","0.005","90","","90","","90","","4012.3","1.9","100","2","100","2","","","","","","","","8","P n m a","-P 2ac 2n","62","[Ni(PyN2(Me2))(CN)Fe(Me6tren)](OTf)","","","- C37 H51 F3 Fe N8 Ni O5 S -","- C37 H52 F3 Fe N8 Ni O5 S -","- C148 H208 F12 Fe4 N32 Ni4 O20 S4 -","4","0.5","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0792","0.0566","","","0.1368","0.1488","","","","","","1.066","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102200","7.857","0.002","13.443","0.004","15.249","0.005","73.508","0.005","77.465","0.005","83.423","0.005","1505.1","0.8","113","2","113","2","","","","","","","","5","P -1","-P 1","2","[H2PyN2dien(Me3)](2HCl).MeOH.0.25H2O","","","- C29 H40.5 Cl2 N6 O3.25 -","- C29 H38.5 Cl2 N6 O3.25 -","- C58 H77 Cl4 N12 O6.5 -","2","1","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0778","0.0608","","","0.1498","0.162","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102201","25.599","0.007","14.354","0.004","9.927","0.003","90","","90","","90","","3647.7","1.8","153","2","153","2","","","","","","","","5","P n m a","-P 2ac 2n","62","(Et4N)[Ni(PyN2dien(Me3))OH]","","","- C36 H53 N7 Ni O3 -","- C36 H33 N7 Ni O3 -","- C144 H132 N28 Ni4 O12 -","4","0.5","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0896","0.0787","","","0.2189","0.2362","","","","","","1.067","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102202","8.726","0.004","17.818","0.007","17.063","0.007","90","","100.087","0.007","90","","2611.9","1.9","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ni(OH)FeCl(PyN2dien(Me3))]","","","- C28 H33 Cl Fe N6 Ni O3 -","- C28 H33 Cl Fe N6 Ni O3 -","- C112 H132 Cl4 Fe4 N24 Ni4 O12 -","4","1","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.1073","0.0556","","","0.1165","0.1389","","","","","","1.003","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102203","17.3841","0.0008","20.4346","0.0011","19.492","0.0009","90","","112.377","0.003","90","","6402.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","2{[Ni(HCO2)FeCl(PyN2dien(Me3))].HCOOEt}","","","- C64 H78 Cl2 Fe2 N12 Ni2 O12 -","- C64 H72 Cl2 Fe2 N12 Ni2 O12 -","- C256 H288 Cl8 Fe8 N48 Ni8 O48 -","4","1","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.1104","0.0586","","","0.1312","0.1568","","","","","","1.012","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102204","8.6717","0.0012","20.35","0.003","17.491","0.002","90","","101.218","0.002","90","","3027.6","0.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ni(CN)FeCl(PyN2dien(Me3))].MeOH","","","- C30 H36 Cl Fe N7 Ni O3 -","- C30 H36 Cl Fe N7 Ni O3 -","- C120 H144 Cl4 Fe4 N28 Ni4 O12 -","4","1","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0492","0.0373","","","0.0895","0.0958","","","","","","1.057","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102205","12.2514","0.0009","17.3166","0.0014","15.1327","0.0011","90","","94.188","0.004","90","","3201.9","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Et4N)[Pd(PyN2(Me2))HCO3]","","","- C32 H42 N4 O5 Pd -","- C32 H42 N4 O5 Pd -","- C128 H168 N16 O20 Pd4 -","4","1","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0768","0.0624","","","0.1518","0.1679","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102206","12.8112","0.0018","16.671","0.002","14.266","0.002","90","","90.532","0.002","90","","3046.7","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Et4N)[Ni(PyN2(Me2))OMe]","","","- C32 H44 N4 Ni O3 -","- C32 H44 N4 Ni O3 -","- C128 H176 N16 Ni4 O12 -","4","1","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0564","0.0472","","","0.1237","0.132","","","","","","1.043","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102207","17.494","0.003","12.92","0.002","14.762","0.002","90","","90","","90","","3336.5","0.9","97","2","97","2","","","","","","","","5","P n n m","-P 2 2n","58","(Et4N)[Ni(PyN2(Me2))HCO3] H2O","","","- C32 H44 N4 Ni O6 -","- C32 H22 N4 Ni O6 -","- C128 H88 N16 Ni4 O24 -","4","0.5","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0861","0.0777","","","0.2093","0.2158","","","","","","1.196","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102208","14.461","0.005","13.742","0.005","14.839","0.005","90","","90","","90","","2948.9","1.8","100","2","100","2","","","","","","","","5","C m c 21","C 2c -2","36","(Et4N)[Pd(PyN2(Me2))OH]","","","- C31 H42 N4 O3 Pd -","- C31 H22 N4 O3 Pd -","- C124 H88 N16 O12 Pd4 -","4","0.5","","Deguang Huang; R. H. Holm","Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site","Journal of the American Chemical Society","2010","132","","4693","4701","10.1021/ja1003125","","","0.71073","MoKα","","0.0526","0.0461","","","0.1104","0.1158","","","","","","1.049","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102209","8.084","0.003","12.625","0.004","17.015","0.006","90","","103.119","0.005","90","","1691.2","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 N O2 S -","- C18 H25 N O2 S -","- C72 H100 N4 O8 S4 -","4","1","","Qian Li; Zhi-Xiang Yu","Conjugated Diene-Assisted Allylic C-H Bond Activation: Cationic Rh(I)-Catalyzed Syntheses of Polysubstituted Tetrahydropyrroles, Tetrahydrofurans, and Cyclopentanes from Ene-2-Dienes","Journal of the American Chemical Society","2010","132","","4542","4543","10.1021/ja100409b","","","0.71073","MoKα","","0.0653","0.0597","","","0.1415","0.1455","","","","","","1.171","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102210","11.8748","0.0005","15.8767","0.0007","16.875","0.0007","85.109","0.001","83.954","0.001","80.518","0.001","3113.1","0.2","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C39.75 H34.5 Cl2.5 N2 -","- C39.75 H34.5 Cl2.5 N2 -","- C159 H138 Cl10 N8 -","4","2","","Norito Takenaka; Jinshui Chen; Burjor Captain; Robindro Singh Sarangthem; Appayee Chandrakumar","Helical Chiral 2-Aminopyridinium Ions: A New Class of Hydrogen Bond Donor Catalysts","Journal of the American Chemical Society","2010","132","","4536","4537","10.1021/ja100539c","","","0.71073","MoKα","","0.0713","0.058","","","0.1508","0.1627","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102211","14.785","0.003","15.378","0.003","16.624","0.003","90","","90","","90","","3779.7","1.3","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H50 Cl2 O7 Rh2 S4 -","- C28 H50 Cl2 O7 Rh2 S4 -","- C112 H200 Cl8 O28 Rh8 S16 -","4","1","","Jun Chen; Junmin Chen; Feng Lang; Xiangyang Zhang; Linfeng Cun; Jin Zhu; Jingen Deng; Jian Liao","AC2-Symmetric Chiral Bis-Sulfoxide Ligand in a Rhodium-Catalyzed Reaction: Asymmetric 1,4-Addition of Sodium Tetraarylborates to Chromenones","Journal of the American Chemical Society","2010","132","","4552","4553","10.1021/ja1005477","","","0.71073","MoKα","","0.0869","0.0793","","","0.1841","0.1915","","","","","","1.076","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102212","17.3177","0.0005","19.45","0.0005","20.2626","0.0006","90","","132.758","0.0008","90","","5011.2","0.3","153.1","","153.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 Cl2 N3 V -","- C24 H23 Cl2 N3 V -","- C192 H184 Cl16 N24 V8 -","8","2","","Shu Zhang; Kotohiro Nomura","Highly Efficient Dimerization of Ethylene by (Imido)vanadium Complexes Containing (2-Anilidomethyl)pyridine Ligands: Notable Ligand Effect toward Activity and Selectivity","Journal of the American Chemical Society","2010","132","","4960","4965","10.1021/ja100573d","","","0.71075","MoKα","","","0.0448","","","","0.1323","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102213","12.0709","0.0004","12.539","0.0005","15.2621","0.0005","90","","90","","90","","2310.03","0.14","113.1","","113.1","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 Cl2 N3 V -","- C24 H30 Cl2 N3 V -","- C96 H120 Cl8 N12 V4 -","4","1","","Shu Zhang; Kotohiro Nomura","Highly Efficient Dimerization of Ethylene by (Imido)vanadium Complexes Containing (2-Anilidomethyl)pyridine Ligands: Notable Ligand Effect toward Activity and Selectivity","Journal of the American Chemical Society","2010","132","","4960","4965","10.1021/ja100573d","","","0.71075","MoKα","","","0.0169","","","","0.0519","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102214","10.0663","0.0018","10.537","0.002","13.172","0.003","96.887","0.005","96.829","0.006","91.582","0.005","1376","0.5","103.1","","103.1","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H38 Cl2 N3 V -","- C28 H38 Cl2 N3 V -","- C56 H76 Cl4 N6 V2 -","2","1","","Shu Zhang; Kotohiro Nomura","Highly Efficient Dimerization of Ethylene by (Imido)vanadium Complexes Containing (2-Anilidomethyl)pyridine Ligands: Notable Ligand Effect toward Activity and Selectivity","Journal of the American Chemical Society","2010","132","","4960","4965","10.1021/ja100573d","","","0.71075","MoKα","","","0.0343","","","","0.0925","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102215","7.5885","0.0004","15.7841","0.001","18.8905","0.0011","109.622","0.004","96.022","0.004","92.315","0.004","2112.6","0.2","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C7 H21 B11 Cl6 Si -","- C7 H21 B11 Cl6 Si -","- C28 H84 B44 Cl24 Si4 -","4","2","","Christos Douvris; C. M. Nagaraja; Chun-Hsing Chen; Bruce M. Foxman; Oleg V. Ozerov","Hydrodefluorination and Other Hydrodehalogenation of Aliphatic Carbon-Halogen Bonds Using Silylium Catalysis","Journal of the American Chemical Society","2010","132","","4946","4953","10.1021/ja100605m","","","0.71073","MoKα","","0.0766","0.0398","","0.0882","0.0772","0.0882","","","","","","0.94","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102216","5.2487","0.001","9.0689","0.0018","23.581","0.005","90","","90","","90","","1122.5","0.4","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H15 Br O -","- C12 H15 Br O -","- C48 H60 Br4 O4 -","4","1","","Jian-Bo Xie; Jian-Hua Xie; Xiao-Yan Liu; Wei-Ling Kong; Shen Li; Qi-Lin Zhou","Highly Enantioselective Hydrogenation of α-Arylmethylene Cycloalkanones Catalyzed by Iridium Complexes of Chiral Spiro Aminophosphine Ligands","Journal of the American Chemical Society","2010","132","","4538","4539","10.1021/ja100652f","","","0.7107","MoKα","","0.0404","0.0307","","","0.0597","0.0644","","","","","","0.995","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102217","8.8803","0.0008","9.2429","0.0008","11.5508","0.0011","95.288","0.003","96.482","0.003","102.289","0.003","913.82","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H23 N O4 S -","- C19 H23 N O4 S -","- C38 H46 N2 O8 S2 -","2","1","","Manuel R. Fructos; Eleuterio Álvarez; M. Mar Díaz-Requejo; Pedro J. Pérez","Selective Synthesis of N-Substituted 1,2-Dihydropyridines from Furans by Copper-Induced Concurrent Tandem Catalysis","Journal of the American Chemical Society","2010","132","","4600","4607","10.1021/ja1006614","","","0.71073","MoKα","","0.036","0.0339","","","0.0936","0.096","","","","","","1.052","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102218","16.34","0.003","17.121","0.003","36.538","0.007","90","","90","","90","","10222","3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C87 H140 N18 O21 -","- C87 H140 N18 O21 -","- C348 H560 N72 O84 -","4","1","","Jordi Solà; Madeleine Helliwell; Jonathan Clayden","N- versus C-Terminal Control over the Screw-Sense Preference of the Configurationally Achiral, Conformationally Helical Peptide Motif Aib8GlyAib8","Journal of the American Chemical Society","2010","132","","4548","4549","10.1021/ja100662d","","","0.71073","MoKα","","0.0767","0.0725","","","0.1474","0.1493","","","","","","1.155","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102219","11.65","0.0004","5.8419","0.0003","15.9102","0.0007","90","","90","","90","","1082.82","0.08","193","2","193","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C10 H10 N2 O4 -","- C10 H10 N2 O4 -","- C40 H40 N8 O16 -","4","0.5","","Matthew J. Kryger; Mitchell T. Ong; Susan A. Odom; Nancy R. Sottos; Scott R. White; Todd J. Martinez; Jeffrey S. Moore","Masked Cyanoacrylates Unveiled by Mechanical Force","Journal of the American Chemical Society","2010","132","","4558","4559","10.1021/ja1008932","","","0.71073","MoKα","","0.0428","0.0364","","","0.0912","0.0974","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102220","5.9857","0.0009","9.3466","0.0015","9.4874","0.0015","93.652","0.003","100.48","0.003","95.083","0.003","518.15","0.14","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H10 N2 O4 -","- C10 H10 N2 O4 -","- C20 H20 N4 O8 -","2","1","","Matthew J. Kryger; Mitchell T. Ong; Susan A. Odom; Nancy R. Sottos; Scott R. White; Todd J. Martinez; Jeffrey S. Moore","Masked Cyanoacrylates Unveiled by Mechanical Force","Journal of the American Chemical Society","2010","132","","4558","4559","10.1021/ja1008932","","","0.71073","MoKα","","0.0376","0.0337","","","0.0923","0.0947","","","","","","1.157","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102221","5.4948","0.0005","7.2202","0.0007","19.2488","0.0018","90","","91.345","0.001","90","","763.46","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 O2 P2 -","- C16 H20 O2 P2 -","- C32 H40 O4 P4 -","2","0.5","","Marlena P. Washington; Vittal B. Gudimetla; Feng L. Laughlin; Nihal Deligonul; Susan He; John L. Payton; M. Cather Simpson; John D. Protasiewicz","Phosphorus Can Also Be a ""Photocopy""","Journal of the American Chemical Society","2010","132","","4566","4567","10.1021/ja1009426","","","0.71073","MoKα","","0.0297","0.0291","","","0.0849","0.0856","","","","","","1.089","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102222","13.6566","0.0001","14.8733","0.0002","23.5763","0.0003","76.5761","0.0005","76.9145","0.0005","80.9145","0.0005","4508.87","0.09","150","","150","","","","","","","","","8","P -1","-P 1","2","","","","- C80 H83 B4 Cl16 F Fe2 N2 P4 -","- C80 H83 B4 Cl16 F Fe2 N2 P4 -","- C160 H166 B8 Cl32 F2 Fe4 N4 P8 -","2","1","","David A. Addy; Glesni A. Pierce; Dragoslav Vidovic; Dibyendu Mallick; Eluvathingal D. Jemmis; Jose M. Goicoechea; Simon Aldridge","Generation of Cationic Two-Coordinate Group-13 Ligand Systems by Spontaneous Halide Ejection: Remarkably Nucleophile-Resistant (Dimethylamino)borylene Complexes","Journal of the American Chemical Society","2010","132","","4586","4588","10.1021/ja101192e","","","0.71073","MoKα","","0.072","0.0551","","0.1459","0.1295","0.1459","","","","","","0.9206","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102223","31.455","0.0006","7.983","0.0002","18.2228","0.0004","90","","124.636","0.0011","90","","3764.89","0.15","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H25 Cl3 Fe O P2 -","- C13 H25 Cl3 Fe O P2 -","- C104 H200 Cl24 Fe8 O8 P16 -","8","1","","David A. Addy; Glesni A. Pierce; Dragoslav Vidovic; Dibyendu Mallick; Eluvathingal D. Jemmis; Jose M. Goicoechea; Simon Aldridge","Generation of Cationic Two-Coordinate Group-13 Ligand Systems by Spontaneous Halide Ejection: Remarkably Nucleophile-Resistant (Dimethylamino)borylene Complexes","Journal of the American Chemical Society","2010","132","","4586","4588","10.1021/ja101192e","","","0.71073","MoKα","","0.0753","0.0429","","0.0894","0.0789","0.0894","","","","","","0.952","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102224","16.3137","0.0002","11.816","0.0001","19.2319","0.0002","90","","109.689","0.0006","90","","3490.45","0.06","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H47 B2 Fe N P2 -","- C37 H47 B2 Fe N P2 -","- C148 H188 B8 Fe4 N4 P8 -","4","1","","David A. Addy; Glesni A. Pierce; Dragoslav Vidovic; Dibyendu Mallick; Eluvathingal D. Jemmis; Jose M. Goicoechea; Simon Aldridge","Generation of Cationic Two-Coordinate Group-13 Ligand Systems by Spontaneous Halide Ejection: Remarkably Nucleophile-Resistant (Dimethylamino)borylene Complexes","Journal of the American Chemical Society","2010","132","","4586","4588","10.1021/ja101192e","","","0.71073","MoKα","","0.066","0.0429","","0.1068","0.0968","0.1067","","","","","","0.9703","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102225","9.6979","0.0002","5.6619","0.0001","16.9349","0.0003","90","","95.952","0.001","90","","924.86","0.03","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H24 O5 S -","- C18 H24 O5 S -","- C36 H48 O10 S2 -","2","1","","Jianwei Sun; Gregory C. Fu","Phosphine-Catalyzed Formation of Carbon-Sulfur Bonds: Catalytic Asymmetric Synthesis of γ-Thioesters","Journal of the American Chemical Society","2010","132","","4568","4569","10.1021/ja101251d","","","1.54178","CuKα","","0.0259","0.0258","","","0.0658","0.0659","","","","","","1.049","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102226","13.6501","0.0006","34.1296","0.0014","20.1054","0.0008","90","","99.195","0.001","90","","9246.2","0.7","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H98 Ag4 F24 N18 P4 -","- C72 H98 Ag4 F24 N18 P4 -","- C288 H392 Ag16 F96 N72 P16 -","4","1","","Arnab Rit; Tania Pape; F. Ekkehardt Hahn","Self-Assembly of Molecular Cylinders from Polycarbene Ligands and AgI or AuI","Journal of the American Chemical Society","2010","132","","4572","4573","10.1021/ja101490d","","","0.71073","MoKα","","0.0952","0.0508","","","0.1093","0.1287","","","","","","1.004","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102227","15.02","0.002","21.071","0.003","22.15","0.003","90","","90.546","0.002","90","","7009.9","1.7","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48.5 H60.5 Au3 F18 N13.5 O P3 -","- C48.5 H48 Au3 F18 N13.5 O P3 -","- C194 H192 Au12 F72 N54 O4 P12 -","4","1","","Arnab Rit; Tania Pape; F. Ekkehardt Hahn","Self-Assembly of Molecular Cylinders from Polycarbene Ligands and AgI or AuI","Journal of the American Chemical Society","2010","132","","4572","4573","10.1021/ja101490d","","","0.71073","MoKα","","0.0605","0.0392","","","0.1019","0.1135","","","","","","1.1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102228","10.072","","14.077","","11.528","","90","","108.1","","90","","1553.6","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Cs2 H5 O16 V5 -","- Cs2 H5 O16 V5 -","- Cs8 H20 O64 V20 -","4","1","","Lionel A. Truflandier; Florent Boucher; Christophe Payen; Redouane Hajjar; Yannick Millot; Christian Bonhomme; Nathalie Steunou","DFT-NMR Investigation and 51V 3QMAS Experiments for Probing Surface OH Ligands and the Hydrogen-Bond Network in a Polyoxovanadate Cluster: The Case of Cs4[H2V10O28].4H2O","Journal of the American Chemical Society","2010","132","","4653","4668","10.1021/ja908973y","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102229","9.323","0.0004","11.6735","0.0005","11.7514","0.0005","87.448","0.002","73.626","0.002","67.519","0.002","1130.92","0.09","110","","110","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H32 N3 Pt -","- C25 H32 N3 Pt -","- C50 H64 N6 Pt2 -","2","1","","Joanna R. Webb; Aaron W. Pierpont; Colleen Munro-Leighton; T. Brent Gunnoe; Thomas R. Cundari; Paul D. Boyle","Net Hydrogenation of Pt-NHPh Bond Is Catalyzed by Elemental Pt","Journal of the American Chemical Society","2010","132","","4520","4521","10.1021/ja9102309","","","0.7107","MoKα","","0.043","0.0316","","","0.0605","0.0647","","","","","","1.001","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102230","12.3661","0.0017","6.1734","0.0009","22.174","0.003","90","","98.769","0.002","90","","1673","0.4","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 N3 O2 S -","- C18 H19 N3 O2 S -","- C72 H76 N12 O8 S4 -","4","1","","Shigeru Arai; Yuka Koike; Hirohiko Hada; Atsushi Nishida","Catalytic Dicyanative [4+2] Cycloaddition Triggered by Cyanopalladation of Conjugated Enynes under Aerobic Conditions","Journal of the American Chemical Society","2010","132","","4522","4523","10.1021/ja910451j","","","0.71073","MoKα","","0.0881","0.0474","","","0.0955","0.1091","","","","","","1.013","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102231","13.255","0.004","7.968","0.003","16.547","0.005","90","","101.148","0.005","90","","1714.6","1","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N3 O2 S -","- C18 H19 N3 O2 S -","- C72 H76 N12 O8 S4 -","4","1","","Shigeru Arai; Yuka Koike; Hirohiko Hada; Atsushi Nishida","Catalytic Dicyanative [4+2] Cycloaddition Triggered by Cyanopalladation of Conjugated Enynes under Aerobic Conditions","Journal of the American Chemical Society","2010","132","","4522","4523","10.1021/ja910451j","","","0.71073","MoKα","","0.0903","0.0458","","","0.0744","0.0891","","","","","","0.98","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102232","33.311","0.006","33.311","0.006","7.6091","0.0018","90","","90","","90","","8443","3","93","2","93","0.2","","","","","","","","6","P 42/n :2","-P 4bc","86","","2-[2-(4,5-Dibromo-[1,3]dithiol-2-ylidene)-1,3-benzodithiol-5-yl]- 4,4,5,5-tetramethyl imidazoline-3-oxide-1-oxyl","","- C17 H15 Br2 N2 O2 S4 -","- C17 H15 Br2 N2 O2 S4 -","- C272 H240 Br32 N32 O32 S64 -","16","2","","Hideji Komatsu; Michio M. Matsushita; Shigefumi Yamamura; Yoko Sugawara; Kentaro Suzuki; Tadashi Sugawara","Influence of Magnetic Field upon the Conductance of a Unicomponent Crystal of a Tetrathiafulvalene-Based Nitronyl Nitroxide","Journal of the American Chemical Society","2010","132","","4528","4529","10.1021/ja9109538","","","0.71073","MoKα","","0.201","0.135","","","0.3503","0.3838","","","","","","1.118","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102233","9.9621","0.0002","11.4794","0.0003","21.7107","0.0006","90","","90","","90","","2482.81","0.11","120","","120","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H32 N2 O5 -","- C28 H32 N2 O5 -","- C112 H128 N8 O20 -","4","1","","Mujeeb Khan; Volker Enkelmann; Gunther Brunklaus","Crystal Engineering of Pharmaceutical Co-crystals: Application of Methyl Paraben as Molecular Hook","Journal of the American Chemical Society","2010","132","","5254","5263","10.1021/ja100146f","","","0.71073","MoKα","","0.0677","0.0374","","0.0567","0.0416","0.0416","","","","","","1.109","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102234","8.5337","0.0009","10.3702","0.0006","13.3899","0.0012","69.135","0.008","82.489","0.01","67.433","0.008","1022.44","0.17","143","1","143","1","","","","","","","","5","P 1","P 1","1","","","","- C24 H24 Br N O2 -","- C24 H24 Br N O2 -","- C48 H48 Br2 N2 O4 -","2","2","","Sebastian Rendler; David W. C. MacMillan","Enantioselective Polyene Cyclization via Organo-SOMO Catalysis","Journal of the American Chemical Society","2010","132","","5027","5029","10.1021/ja100185p","","","0.71073","MoKα","","0.0441","0.0408","","","0.0986","0.1036","","","","","","1.096","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102235","7.7406","0.0006","25.5147","0.0018","14.5225","0.0011","90","","91.63","0.003","90","","2867","0.4","143","1","143","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 N O -","- C17 H19 N O -","- C136 H152 N8 O8 -","8","4","","Sebastian Rendler; David W. C. MacMillan","Enantioselective Polyene Cyclization via Organo-SOMO Catalysis","Journal of the American Chemical Society","2010","132","","5027","5029","10.1021/ja100185p","","","0.71073","MoKα","","0.12","0.0838","","","0.1914","0.2158","","","","","","1.143","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102236","13.0078","0.0003","6.8941","0.0002","21.3275","0.0006","90","","91.374","0.002","90","","1912.04","0.09","153","1","153","1","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C23 H31 N O3 -","- C23 H29 N O3 -","- C92 H116 N4 O12 -","4","1","","Sebastian Rendler; David W. C. MacMillan","Enantioselective Polyene Cyclization via Organo-SOMO Catalysis","Journal of the American Chemical Society","2010","132","","5027","5029","10.1021/ja100185p","","","1.54178","CuKα","","0.0528","0.0389","","","0.0957","0.1215","","","","","","1.143","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102237","15.922","0.003","20.076","0.004","19.176","0.003","90","","121.573","0.01","90","","5222.3","1.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H40 B F20 N2 Pd -","- C55 H40 B F20 N2 Pd -","- C220 H160 B4 F80 N8 Pd4 -","4","1","","Changle Chen; Shuji Luo; Richard F. Jordan","Cationic Polymerization and Insertion Chemistry in the Reactions of Vinyl Ethers with (α-Diimine)PdMe+ Species","Journal of the American Chemical Society","2010","132","","5273","5284","10.1021/ja100491y","","","0.71073","MoKα","","0.0664","0.0435","","","0.0972","0.1042","","","","","","0.982","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102238","8.879","0.0004","20.7162","0.0007","24.1069","0.0008","90","","90","","90","","4434.2","0.3","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C45.5 H59 Br2 O6 -","- C45.5 H59 Br2 O6 -","- C182 H236 Br8 O24 -","4","1","","Matthew A. Boone; Rongbiao Tong; Frank E. McDonald; Sheri Lense; Rui Cao; Kenneth I. Hardcastle","Biomimetic Syntheses from Squalene-Like Precursors: Synthesis of ent-Abudinol B and Reassessment of the Structure of Muzitone","Journal of the American Chemical Society","2010","132","","5300","5308","10.1021/ja1006806","","","1.54178","CuKα","","0.065","0.0553","","","0.1567","0.1651","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102239","13.2539","0.0017","7.4121","0.0009","16.7467","0.0018","90","","101.349","0.006","90","","1613","0.3","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C34 H54 O6 -","- C34 H54 O6 -","- C68 H108 O12 -","2","1","","Matthew A. Boone; Rongbiao Tong; Frank E. McDonald; Sheri Lense; Rui Cao; Kenneth I. Hardcastle","Biomimetic Syntheses from Squalene-Like Precursors: Synthesis of ent-Abudinol B and Reassessment of the Structure of Muzitone","Journal of the American Chemical Society","2010","132","","5300","5308","10.1021/ja1006806","","","1.54178","CuKα","","0.098","0.0608","","","0.1614","0.2206","","","","","","1.131","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102240","16.924","0.014","7.236","0.006","39.64","0.03","90","","98.926","0.01","90","","4796","7","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C44 H56 N2 O12 -","- C44 H56 N2 O12 -","- C176 H224 N8 O48 -","4","2","","Matthew A. Boone; Rongbiao Tong; Frank E. McDonald; Sheri Lense; Rui Cao; Kenneth I. Hardcastle","Biomimetic Syntheses from Squalene-Like Precursors: Synthesis of ent-Abudinol B and Reassessment of the Structure of Muzitone","Journal of the American Chemical Society","2010","132","","5300","5308","10.1021/ja1006806","","","1.54178","CuKα","","0.2107","0.0905","","","0.1472","0.1804","","","","","","0.989","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102241","12.194","0.003","17.305","0.004","25.66","0.006","90","","90","","90","","5415","2","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H50 O4 -","- C30 H50 O4 -","- C240 H400 O32 -","8","2","","Matthew A. Boone; Rongbiao Tong; Frank E. McDonald; Sheri Lense; Rui Cao; Kenneth I. Hardcastle","Biomimetic Syntheses from Squalene-Like Precursors: Synthesis of ent-Abudinol B and Reassessment of the Structure of Muzitone","Journal of the American Chemical Society","2010","132","","5300","5308","10.1021/ja1006806","","","1.54178","CuKα","","0.2062","0.0803","","","0.0952","0.1295","","","","","","1.003","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102242","19.5887","0.0005","16.5221","0.0004","19.8902","0.0005","90","","90","","90","","6437.4","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H30 Fe0.5 N3 O4 P2 -","- C36 H30 Fe0.5 N3 O4 P2 -","- C288 H240 Fe4 N24 O32 P16 -","8","1","","Fu-Te Tsai; Pei-Lin Chen; Wen-Feng Liaw","Roles of the Distinct Electronic Structures of the {Fe(NO)2}9 and {Fe(NO)2}10 Dinitrosyliron Complexes in Modulating Nitrite Binding Modes and Nitrite Activation Pathways","Journal of the American Chemical Society","2010","132","","5290","5299","10.1021/ja100849r","","","0.71073","MoKα","","0.0938","0.0823","","","0.2351","0.2455","","","","","","1.034","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102243","19.6091","0.0016","16.4478","0.0014","19.8447","0.0016","90","","90","","90","","6400.4","0.9","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H30 Fe0.5 N3.5 O4.5 P2 -","- C36 H30 Fe0.5 N3.5 O4.5 P2 -","- C288 H240 Fe4 N28 O36 P16 -","8","1","","Fu-Te Tsai; Pei-Lin Chen; Wen-Feng Liaw","Roles of the Distinct Electronic Structures of the {Fe(NO)2}9 and {Fe(NO)2}10 Dinitrosyliron Complexes in Modulating Nitrite Binding Modes and Nitrite Activation Pathways","Journal of the American Chemical Society","2010","132","","5290","5299","10.1021/ja100849r","","","0.71073","MoKα","","0.0998","0.0796","","","0.185","0.2003","","","","","","1.17","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102244","10.1353","0.0003","15.5214","0.0005","16.7544","0.0005","77.035","0.002","78.642","0.001","83.664","0.002","2512.16","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H49.5 Fe N5.5 O4 P3 -","- C57 H49.5 Fe N5.5 O4 P3 -","- C114 H99 Fe2 N11 O8 P6 -","2","1","","Fu-Te Tsai; Pei-Lin Chen; Wen-Feng Liaw","Roles of the Distinct Electronic Structures of the {Fe(NO)2}9 and {Fe(NO)2}10 Dinitrosyliron Complexes in Modulating Nitrite Binding Modes and Nitrite Activation Pathways","Journal of the American Chemical Society","2010","132","","5290","5299","10.1021/ja100849r","","","0.71073","MoKα","","0.0478","0.0408","","","0.1086","0.1163","","","","","","1.067","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102245","13.3838","0.0004","16.0477","0.0005","17.3339","0.0006","90","","90","","90","","3723","0.2","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C20 H18 Fe0.5 N1.5 O3 P -","- C20 H18 Fe0.5 N1.5 O3 P -","- C160 H144 Fe4 N12 O24 P8 -","8","1","","Fu-Te Tsai; Pei-Lin Chen; Wen-Feng Liaw","Roles of the Distinct Electronic Structures of the {Fe(NO)2}9 and {Fe(NO)2}10 Dinitrosyliron Complexes in Modulating Nitrite Binding Modes and Nitrite Activation Pathways","Journal of the American Chemical Society","2010","132","","5290","5299","10.1021/ja100849r","","","0.71073","MoKα","","0.0655","0.0505","","","0.1363","0.1573","","","","","","1.195","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102246","17.5116","0.0011","8.6269","0.0005","21.0769","0.0014","90","","104.229","0.003","90","","3086.4","0.3","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H39 Cl2 Cu N O4 -","- C31 H39 Cl2 Cu N O4 -","- C124 H156 Cl8 Cu4 N4 O16 -","4","1","","James D. Crowley; Kevin D. Hänni; David A. Leigh; Alexandra M. Z. Slawin","Diels-Alder Active-Template Synthesis of Rotaxanes and Metal-Ion-Switchable Molecular Shuttles","Journal of the American Chemical Society","2010","132","","5309","5314","10.1021/ja101029u","","","0.71073","MoKα","","0.049","0.047","","","0.1098","0.1108","","","","","","1.229","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102247","13.0715","0.0009","15.7296","0.001","15.78","0.0009","70.911","0.004","75.535","0.004","81.991","0.005","2963","0.3","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H39 Cl2 N O4 Zn -","- C31 H39 Cl2 N O4 Zn -","- C124 H156 Cl8 N4 O16 Zn4 -","4","2","","James D. Crowley; Kevin D. Hänni; David A. Leigh; Alexandra M. Z. Slawin","Diels-Alder Active-Template Synthesis of Rotaxanes and Metal-Ion-Switchable Molecular Shuttles","Journal of the American Chemical Society","2010","132","","5309","5314","10.1021/ja101029u","","","0.71073","MoKα","","0.0576","0.0439","","","0.0938","0.1025","","","","","","1.019","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102248","18.1258","0.0018","15.0266","0.0014","14.6076","0.0015","90","","105.704","0.006","90","","3830.1","0.7","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37.5 H46 Cl2 N2 O5 Zn -","- C37.5 H42 Cl2 N2 O5 Zn -","- C150 H168 Cl8 N8 O20 Zn4 -","4","1","","James D. Crowley; Kevin D. Hänni; David A. Leigh; Alexandra M. Z. Slawin","Diels-Alder Active-Template Synthesis of Rotaxanes and Metal-Ion-Switchable Molecular Shuttles","Journal of the American Chemical Society","2010","132","","5309","5314","10.1021/ja101029u","","","0.71073","MoKα","","0.0978","0.088","","","0.1971","0.2039","","","","","","1.167","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102249","26.267","0.009","9.004","0.003","26.253","0.009","90","","90","","90","","6209","4","93","2","93","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C31 H39 Cl2 N O2 S2 Zn -","- C31 H39 Cl2 N O2 S2 Zn -","- C248 H312 Cl16 N8 O16 S16 Zn8 -","8","1","","James D. Crowley; Kevin D. Hänni; David A. Leigh; Alexandra M. Z. Slawin","Diels-Alder Active-Template Synthesis of Rotaxanes and Metal-Ion-Switchable Molecular Shuttles","Journal of the American Chemical Society","2010","132","","5309","5314","10.1021/ja101029u","","","0.71073","MoKα","","0.1616","0.1293","","","0.3075","0.3398","","","","","","1.107","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102250","29.6016","0.0019","11.7105","0.0007","27.6057","0.0018","90","","113.03","0.002","90","","8806.8","1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Na[Co(CNArMes2)4]","","","- C108 H120 Co N4 Na O2 -","- C108 H120 Co N4 Na O2 -","- C432 H480 Co4 N16 Na4 O8 -","4","0.5","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","0.71073","MoKα","","0.0783","0.0559","","","0.1076","0.1162","","","","","","1.097","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102251","14.3428","0.0012","42.211","0.004","20.2968","0.0017","90","","92.558","0.001","90","","12275.9","1.9","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[PPN][Co(CNArMes2)4]","","","- C148 H160 Co N5 O3 P2 -","- C148 H160 Co N5 O3 P2 -","- C592 H640 Co4 N20 O12 P8 -","4","1","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","0.71073","MoKα","","0.112","0.079","","","0.1884","0.2083","","","","","","1.074","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102252","29.708","0.01","11.863","0.004","27.485","0.009","90","","112.141","0.005","90","","8972","5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co(CNArMes2)4","","","- C108 H120 Co N4 O4 -","- C108 H120 Co N4 O4 -","- C432 H480 Co4 N16 O16 -","4","0.5","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","0.71073","MoKα","","0.1126","0.07","","","0.1245","0.141","","","","","","1.086","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102253","29.8149","0.0016","11.9653","0.0006","27.7566","0.0015","90","","111.712","0.004","90","","9199.5","0.9","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co(CNArMes2)4","","","- C108 H120 Co N4 O4 -","- C108 H120 Co N4 O4 -","- C432 H480 Co4 N16 O16 -","4","0.5","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","1.54178","CuKα","","0.0913","0.0551","","","0.1367","0.1553","","","","","","1.019","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102254","29.707","0.003","11.866","0.0012","27.577","0.003","90","","111.978","0.007","90","","9014.5","1.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Co(CNArMes2)4","","","- C108 H120 Co N4 O4 -","- C108 H120 Co N4 O4 -","- C432 H480 Co4 N16 O16 -","4","0.5","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","1.54178","CuKα","","0.1088","0.0629","","","0.1441","0.1673","","","","","","1.02","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102255","26.924","0.017","15.161","0.009","31.86","0.02","90","","104.523","0.009","90","","12590","13","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Co(CNArMes2)4]BArF4","","","- C142 H136 B Co F24 N4 -","- C142 H136 B Co F24 N4 -","- C568 H544 B4 Co4 F96 N16 -","4","0.5","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","0.71073","MoKα","","0.1435","0.0776","","","0.1793","0.2168","","","","","","1.02","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102256","14.959","0.004","20.543","0.005","31.517","0.008","90","","103.099","0.004","90","","9433","4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[(THF)Co(CNArMes2)4]OTf","","","- C109 H118 Co F3 N4 O5 S -","- C109 H118 Co F3 N4 O5 S -","- C436 H472 Co4 F12 N16 O20 S4 -","4","1","","Grant W. Margulieux; Nils Weidemann; David C. Lacy; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Isocyano Analogues of [Co(CO)4]n: A Tetraisocyanide of Cobalt Isolated in Three States of Charge","Journal of the American Chemical Society","2010","132","","5033","5035","10.1021/ja1012382","","","0.71073","MoKα","","0.1878","0.08","","","0.148","0.1898","","","","","","1.019","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102257","13.024","0.003","13.024","0.003","16.759","0.004","90","","90","","90","","2842.7","1.1","100","2","100","2","","","","","","","","6","P 43","P 4cw","78","","","","- C30 H36 Cl2 N2 O2 S2 -","- C30 H36 Cl2 N2 O2 S2 -","- C120 H144 Cl8 N8 O8 S8 -","4","1","","Robert R. Knowles; Song Lin; Eric N. Jacobsen","Enantioselective Thiourea-Catalyzed Cationic Polycyclizations","Journal of the American Chemical Society","2010","132","","5030","5032","10.1021/ja101256v","","","0.71073","MoKα","","0.0417","0.0343","","","0.0771","0.0809","","","","","","1.036","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102258","6.953","0.003","10.796","0.005","13.61","0.006","90.786","0.008","104.123","0.007","98.754","0.007","977.8","0.8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H23 N O2 -","- C18 H23 N O2 -","- C36 H46 N2 O4 -","2","1","","Robert R. Knowles; Song Lin; Eric N. Jacobsen","Enantioselective Thiourea-Catalyzed Cationic Polycyclizations","Journal of the American Chemical Society","2010","132","","5030","5032","10.1021/ja101256v","","","0.71073","MoKα","","0.0863","0.0623","","","0.1582","0.1675","","","","","","1.042","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102259","6.9387","0.0014","14.503","0.003","15.6","0.003","90","","90","","90","","1569.9","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H23 N O -","- C21 H23 N O -","- C84 H92 N4 O4 -","4","1","","Robert R. Knowles; Song Lin; Eric N. Jacobsen","Enantioselective Thiourea-Catalyzed Cationic Polycyclizations","Journal of the American Chemical Society","2010","132","","5030","5032","10.1021/ja101256v","","","0.71073","MoKα","","0.0652","0.042","","","0.0822","0.0909","","","","","","1.019","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102260","17.071","0.006","9.127","0.003","22.864","0.008","90","","111.787","0.0011","90","","3308","2","150","","150","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C28 H50 Si6 -","- C28 H50 Si6 -","- C112 H200 Si24 -","4","1","","Takashi Abe; Takeaki Iwamoto; Mitsuo Kira","A Stable 1,2-Disilacyclohexene and Its 14-Electron Palladium(0) Complex","Journal of the American Chemical Society","2010","132","","5008","5009","10.1021/ja101654b","","","0.7107","MoKα","","0.0563","0.0534","","","0.1129","0.1144","","","","","","1.227","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102261","11.231","0.002","20.76","0.004","22.617","0.005","90","","99.409","0.002","90","","5202.3","1.8","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H83 P Pd Si6 -","- C46 H83 P Pd Si6 -","- C184 H332 P4 Pd4 Si24 -","4","1","","Takashi Abe; Takeaki Iwamoto; Mitsuo Kira","A Stable 1,2-Disilacyclohexene and Its 14-Electron Palladium(0) Complex","Journal of the American Chemical Society","2010","132","","5008","5009","10.1021/ja101654b","","","0.71073","MoKα","","0.0345","0.0258","","","0.0635","0.0701","","","","","","1.058","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102262","6.0138","0.0001","23.3983","0.0004","17.9273","0.0003","90","","93.199","0.001","90","","2518.67","0.07","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H20 O4 -","- C20 H20 O4 -","- C120 H120 O24 -","6","3","","Sha Lou; Gregory C. Fu","Enantioselective Alkenylation via Nickel-Catalyzed Cross-Coupling with Organozirconium Reagents","Journal of the American Chemical Society","2010","132","","5010","5011","10.1021/ja1017046","","","1.54178","CuKα","","0.035","0.032","","","0.0804","0.0827","","","","","","1.029","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102263","10.3237","0.0016","10.8233","0.0016","11.7218","0.0018","95.244","0.004","113.624","0.004","113.405","0.004","1051.2","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","JMH1X207","mayer22","","- C18 H21 F3 N4 O4 Pt S -","- C18 H21 F3 N4 O4 Pt S -","- C36 H42 F6 N8 O8 Pt2 S2 -","2","1","","Jessica M. Hoover; Antonio DiPasquale; James M. Mayer; Forrest E. Michael","Platinum-Catalyzed Intramolecular Hydrohydrazination: Evidence for Alkene Insertion into a Pt-N Bond","Journal of the American Chemical Society","2010","132","","5043","5053","10.1021/ja906563z","","","1.54178","CuKα","","0.0277","0.027","","","0.0663","0.0693","","","","","","1.061","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102264","7.1149","0.0001","8.7177","0.0002","9.2105","0.0002","90.52","0.001","109.281","0.001","91.873","0.001","538.836","0.019","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H26 Cl2 N4 O2 Sn -","- C18 H26 Cl2 N4 O2 Sn -","- C18 H26 Cl2 N4 O2 Sn -","1","0.5","","Gang Wu; Jianfeng Zhu; Xin Mo; Ruiyao Wang; Victor Terskikh","Solid-State 17O NMR and Computational Studies of C-Nitrosoarene Compounds","Journal of the American Chemical Society","2010","132","","5143","5155","10.1021/ja909656w","","","0.71073","MoKα","","0.0153","0.0151","","","0.0374","0.0375","","","","","","1.066","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102265","8.4338","0.0002","22.7228","0.0006","10.7268","0.0003","90","","97.729","0.002","90","","2037","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H21 Cl4 N O5 -","- C18 H21 Cl4 N O5 -","- C72 H84 Cl16 N4 O20 -","4","1","","Carles Giró Mañas; Victoria L. Paddock; Christian G. Bochet; Alan C. Spivey; Andrew J. P. White; Inderjit Mann; Wolfgang Oppolzer","Total Synthesis of the Lycorenine-Type Amaryllidaceae Alkaloid (\±)-Clivonine via a Biomimetic Ring-Switch from a Lycorine-Type Progenitor","Journal of the American Chemical Society","2010","132","","5176","5178","10.1021/ja910184j","","","0.71073","MoKα","","0.0781","0.0467","","","0.1111","0.1206","","","","","","1.008","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102266","37.859","0.004","9.7245","0.001","23.612","0.002","90","","111.508","0.005","90","","8087.7","1.4","190","2","190","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H42 B Cl3 Co N6 S3 -","- C34 H42 B Cl3 Co N6 S3 -","- C272 H336 B8 Cl24 Co8 N48 S24 -","8","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71069","MoKα","","0.0963","0.0585","","","0.1449","0.1622","","","","","","1.062","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102267","9.8456","0.001","27.114","0.003","14.127","0.0014","90","","92.325","0.005","90","","3768.1","0.7","190","2","190","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 B Co N7 S4 -","- C34 H40 B Co N7 S4 -","- C136 H160 B4 Co4 N28 S16 -","4","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71069","MoKα","","0.0687","0.0387","","","0.0841","0.0934","","","","","","1.046","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102268","10.0557","0.001","16.0979","0.0016","15.8729","0.0016","90","","91.405","0.005","90","","2568.7","0.4","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 B Co N7 O -","- C22 H34 B Co N7 O -","- C88 H136 B4 Co4 N28 O4 -","4","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71073","MoKα","","0.1036","0.0478","","","0.0852","0.0993","","","","","","1.014","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102269","10.1577","0.0011","15.8814","0.0017","15.8027","0.0017","90","","91.186","0.005","90","","2548.7","0.5","190","2","190","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H34 B Co N9 -","- C21 H34 B Co N9 -","- C84 H136 B4 Co4 N36 -","4","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71069","MoKα","","0.0497","0.0365","","","0.0903","0.0957","","","","","","1.114","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102270","15.9843","0.0017","15.9843","0.0017","9.4269","0.001","90","","90","","120","","2085.9","0.4","190","2","190","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C24 H40 B Cl Co N6 -","- C24 H40 B Cl Co N6 -","- C72 H120 B3 Cl3 Co3 N18 -","3","0.166667","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71073","MoKα","","0.0246","0.0231","","","0.0552","0.056","","","","","","1.087","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102271","9.6545","0.0011","17.4408","0.0018","17.9183","0.0018","90","","98.059","0.005","90","","2987.3","0.5","190","2","190","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H40 B Co N7 S -","- C25 H40 B Co N7 S -","- C100 H160 B4 Co4 N28 S4 -","4","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71073","MoKα","","0.0918","0.0434","","","0.0857","0.1011","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102272","10.4823","0.0011","17.0139","0.0018","16.0436","0.0017","90","","91.101","0.005","90","","2860.8","0.5","190","2","190","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H40 B Co N7 O -","- C25 H40 B Co N7 O -","- C100 H160 B4 Co4 N28 O4 -","4","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71073","MoKα","","0.0778","0.0436","","","0.0969","0.1106","","","","","","1.031","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102273","10.5385","0.0012","19.126","0.002","15.7062","0.0017","90","","90.437","0.005","90","","3165.6","0.6","190","2","190","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27.5 H44 B Co N9 -","- C27.5 H44 B Co N9 -","- C110 H176 B4 Co4 N36 -","4","1","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71073","MoKα","","0.0701","0.0457","","","0.105","0.1168","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102274","9.686","0.0012","11.3379","0.0015","24.442","0.003","87.917","0.003","82.601","0.003","89.81","0.004","2660.1","0.6","93.1","","93.1","","","","","","","","","7","P 1","P 1","1","","","","- C109 H106.7 Cu2 F12 N10 O16.35 S4 -","- C109 H98 Cu2 F12 N10 O16.35 S4 -","- C109 H98 Cu2 F12 N10 O16.35 S4 -","1","1","","Takayoshi Arai; Asami Mishiro; Naota Yokoyama; Kuniko Suzuki; Hiroyasu Sato","Chiral Bis(imidazolidine)pyridine-Cu(OTf)2: Catalytic Asymmetric Endo-Selective [3 + 2] Cycloaddition of Imino Esters with Nitroalkenes","Journal of the American Chemical Society","2010","132","","5338","5339","10.1021/ja100265j","","","0.71075","MoKα","","","0.0558","","","","0.1581","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102275","3.5979","0.0019","9.064","0.005","14.452","0.008","75.267","0.013","83.602","0.009","87.354","0.009","452.9","0.4","","","298","3","","","","","","","","4","P 1","P 1","1","","","","- P Rb S6 Zr -","- P Rb S6 Zr -","- P2 Rb2 S12 Zr2 -","2","2","","Santanu Banerjee; Jodi M. Szarko; Benjamin D. Yuhas; Christos D. Malliakas; Lin X. Chen; Mercouri G. Kanatzidis","Room Temperature Light Emission from the Low-Dimensional Semiconductors AZrPS6 (A = K, Rb, Cs)","Journal of the American Chemical Society","2010","132","","5348","5350","10.1021/ja1004653","","","0.4428","synchrotron","","0.0949","0.0835","","","0.1786","0.1871","","","","1.71","1.71","1.62","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102276","11.851","0.003","11.134","0.003","18.831","0.004","90","","99.882","0.004","90","","2447.9","1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 Br3 In O3 P -","- C21 H21 Br3 In O3 P -","- C84 H84 Br12 In4 O12 P4 -","4","1","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0789","0.0573","","","0.1484","0.1637","","","","","","1.034","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102277","12.8528","0.0014","12.8528","0.0014","8.5383","0.0018","90","","90","","120","","1221.5","0.3","193","2","193","2","","","","","","","","6","P -3","-P 3","147","","","","- C21 H21 Br3 In O3 P -","- C21 H21 Br3 In O3 P -","- C42 H42 Br6 In2 O6 P2 -","2","0.333333","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0279","0.0238","","","0.0592","0.0613","","","","","","1.06","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102278","11.831","0.0007","18.4922","0.0011","19.0997","0.0012","110.516","0.0008","105.019","0.0009","104.38","0.0009","3504.2","0.4","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H30 Br3 In P2 -","- C36 H30 Br3 In P2 -","- C144 H120 Br12 In4 P8 -","4","2","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0566","0.0332","","","0.0636","0.0701","","","","","","0.994","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102279","10.7486","0.0006","12.3701","0.0007","13.4953","0.0008","104.477","0.0008","104.014","0.0007","101.582","0.0008","1619.14","0.16","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H33 Br3 In O9 P -","- C27 H33 Br3 In O9 P -","- C54 H66 Br6 In2 O18 P2 -","2","1","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0308","0.0267","","","0.0678","0.0694","","","","","","1.052","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102280","9.0867","0.0008","18.0965","0.0015","13.9402","0.0012","90","","91.719","0.001","90","","2291.3","0.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 Cl3 In O3 P -","- C21 H21 Cl3 In O3 P -","- C84 H84 Cl12 In4 O12 P4 -","4","1","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0223","0.0206","","","0.0566","0.0578","","","","","","1.121","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102281","25.1006","0.0017","15.0311","0.001","22.0125","0.0015","90","","92.449","0.001","90","","8297.5","1","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H42 Cl3 In O6 P2 -","- C42 H42 Cl3 In O6 P2 -","- C336 H336 Cl24 In8 O48 P16 -","8","1","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0647","0.0411","","","0.0941","0.1045","","","","","","0.998","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102282","17.9666","0.001","17.1784","0.001","22.5151","0.0013","90","","90","","90","","6949","0.7","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C36 H30 Cl3 In P2 -","- C36 H30 Cl3 In P2 -","- C288 H240 Cl24 In8 P16 -","8","1","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0358","0.0289","","","0.0703","0.0755","","","","","","1.068","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102283","14.5207","0.0008","14.5207","0.0008","20.52","0.002","90","","90","","90","","4326.7","0.5","193","2","193","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C42.5 H43 Cl4 In O6 P2 -","- C42.5 H43 Cl4 In O6 P2 -","- C170 H172 Cl16 In4 O24 P8 -","4","0.5","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0818","0.0645","","","0.1536","0.1627","","","","","","1.115","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102284","13.6759","0.0017","23.23","0.003","8.6375","0.0011","90","","101.575","0.0016","90","","2688.3","0.6","193","2","193","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C21 H21 I3 In O3 P -","- C21 H21 I3 In O3 P -","- C84 H84 I12 In4 O12 P4 -","4","1","","Fu Chen; Guibin Ma; Guy M. Bernard; Ronald G. Cavell; Robert McDonald; Michael J. Ferguson; Roderick E. Wasylishen","Solid-State 115In and 31P NMR Studies of Triarylphosphine Indium Trihalide Adducts","Journal of the American Chemical Society","2010","132","","5479","5493","10.1021/ja100625p","","","0.71073","MoKα","","0.0485","0.0425","","","0.1037","0.1072","","","","","","1.071","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102285","22.9187","0.0005","22.9187","0.0005","61.6463","0.0012","90","","90","","120","","28042.6","1","296.1","","296.1","","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C68 H72 Cl2 Cu2 P4 -","- C68 H72 Cl2 Cu2 P4 -","- C1224 H1296 Cl36 Cu36 P72 -","18","1.5","","Ryo Yazaki; Naoya Kumagai; Masakatsu Shibasaki","Direct Catalytic Asymmetric Addition of Allyl Cyanide to Ketones via Soft Lewis Acid/Hard Brønsted Base/Hard Lewis Base Catalysis","Journal of the American Chemical Society","2010","132","","5522","5531","10.1021/ja101687p","","","1.54187","CuKα","","","0.1176","","","","0.342","","","","","","1.629","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102286","24.069","0.003","5.1082","0.0006","17.486","0.002","90","0.002","108.292","0.002","90","0.002","2041.3","0.4","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 N2 O2 Se -","- C26 H20 N2 O2 Se -","- C104 H80 N8 O8 Se4 -","4","0.5","","Bani Kanta Sarma; Debasish Manna; Mao Minoura; Govindasamy Mugesh","Synthesis, Structure, Spirocyclization Mechanism, and Glutathione Peroxidase-like Antioxidant Activity of Stable Spirodiazaselenurane and Spirodiazatellurane","Journal of the American Chemical Society","2010","132","","5364","5374","10.1021/ja908080u","","","0.71073","MoKα","","0.0467","0.0365","","","0.0877","0.0926","","","","","","1.095","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102287","9.982","0.003","22.965","0.007","11.053","0.004","90","","105.729","0.005","90","","2438.9","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H20 Cl2 N2 O2 Se -","- C27 H20 Cl2 N2 O2 Se -","- C108 H80 Cl8 N8 O8 Se4 -","4","1","","Bani Kanta Sarma; Debasish Manna; Mao Minoura; Govindasamy Mugesh","Synthesis, Structure, Spirocyclization Mechanism, and Glutathione Peroxidase-like Antioxidant Activity of Stable Spirodiazaselenurane and Spirodiazatellurane","Journal of the American Chemical Society","2010","132","","5364","5374","10.1021/ja908080u","","","0.71073","MoKα","","0.0651","0.038","","","0.0776","0.0896","","","","","","1.021","","","","has coordinates,has disorder","178768","2020-10-21","18:00:00","" "4102288","9.9216","0.001","10.6161","0.001","19.8643","0.0019","90","","90","","90","","2092.3","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H18 N2 O2 Te -","- C26 H18 N2 O2 Te -","- C104 H72 N8 O8 Te4 -","4","1","","Bani Kanta Sarma; Debasish Manna; Mao Minoura; Govindasamy Mugesh","Synthesis, Structure, Spirocyclization Mechanism, and Glutathione Peroxidase-like Antioxidant Activity of Stable Spirodiazaselenurane and Spirodiazatellurane","Journal of the American Chemical Society","2010","132","","5364","5374","10.1021/ja908080u","","","0.71073","MoKα","","0.0647","0.0427","","","0.0644","0.0716","","","","","","1.072","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102289","10.879","0.003","11.265","0.003","11.488","0.003","106.488","0.004","114.488","0.005","94.871","0.005","1195","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H18 N2 O2.5 Te -","- C28 H18 N2 O2.5 Te -","- C56 H36 N4 O5 Te2 -","2","1","","Bani Kanta Sarma; Debasish Manna; Mao Minoura; Govindasamy Mugesh","Synthesis, Structure, Spirocyclization Mechanism, and Glutathione Peroxidase-like Antioxidant Activity of Stable Spirodiazaselenurane and Spirodiazatellurane","Journal of the American Chemical Society","2010","132","","5364","5374","10.1021/ja908080u","","","0.71073","MoKα","","0.06","0.0464","","","0.1104","0.1175","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102290","9.9319","0.0006","10.6098","0.0006","19.8677","0.0012","90","","90","","90","","2093.6","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H18 N2 O2 Te -","- C26 H18 N2 O2 Te -","- C104 H72 N8 O8 Te4 -","4","1","","Bani Kanta Sarma; Debasish Manna; Mao Minoura; Govindasamy Mugesh","Synthesis, Structure, Spirocyclization Mechanism, and Glutathione Peroxidase-like Antioxidant Activity of Stable Spirodiazaselenurane and Spirodiazatellurane","Journal of the American Chemical Society","2010","132","","5364","5374","10.1021/ja908080u","","","0.71073","MoKα","","0.0931","0.058","","","0.0884","0.0993","","","","","","1.073","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102291","5.8894","0.0001","8.3683","0.0001","34.8423","0.0004","90","","90","","90","","1717.18","0.04","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 Br -","- C23 H19 Br -","- C92 H76 Br4 -","4","1","","Benoit Cardinal-David; Dustin E. A. Raup; Karl A. Scheidt","Cooperative N-Heterocyclic Carbene/Lewis Acid Catalysis for Highly Stereoselective Annulation Reactions with Homoenolates","Journal of the American Chemical Society","2010","132","","5345","5347","10.1021/ja910666n","","","0.71073","MoKα","","0.0349","0.0307","","","0.0818","0.0887","","","","","","1.122","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102292","4.986","0.0002","14.6944","0.0007","16.868","0.0008","90","","96.905","0.001","90","","1226.89","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 N4 O6 -","- C28 H24 N4 O6 -","- C56 H48 N8 O12 -","2","0.5","","Yuewen Xu; Mark D. Smith; Michael F. Geer; Perry J. Pellechia; Julius C. Brown; Arief C. Wibowo; Linda S. Shimizu","Thermal Reaction of a Columnar Assembled Diacetylene Macrocycle","Journal of the American Chemical Society","2010","132","","5334","5335","10.1021/ja9107066","","","0.71073","MoKα","","0.0488","0.0418","","","0.1047","0.1102","","","","","","1.035","","","","has coordinates","178768","2020-10-21","18:00:00","" "4102293","5.1523","0.0014","8.571","0.003","26.799","0.007","90","","90","","90","","1183.5","0.6","125.1","","125","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Te2 -","- C12 H10 Te2 -","- C48 H40 Te8 -","4","1","","Amy L. Fuller; Lindesay A. S. Scott-Hayward; Yang Li; Michael Bühl; Alexandra M. Z. Slawin; J. Derek Woollins","Automated Chemical Crystallography","Journal of the American Chemical Society","2010","132","","5799","5802","10.1021/ja100247y","","","0.7107","MoKα","","","0.0253","","","","0.0603","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102294","5.5401","0.0011","8.0864","0.0018","23.478","0.005","90","","90","","90","","1051.8","0.4","125.1","","125","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 S2 -","- C12 H10 S2 -","- C48 H40 S8 -","4","1","","Amy L. Fuller; Lindesay A. S. Scott-Hayward; Yang Li; Michael Bühl; Alexandra M. Z. Slawin; J. Derek Woollins","Automated Chemical Crystallography","Journal of the American Chemical Society","2010","132","","5799","5802","10.1021/ja100247y","","","0.71075","MoKα","","","0.0723","","","","0.172","","","","","","1.108","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102295","5.5363","0.0007","8.0793","0.0011","23.483","0.003","90","","90","","90","","1050.4","0.2","125.1","","125","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 S2 -","- C12 H10 S2 -","- C48 H40 S8 -","4","1","","Amy L. Fuller; Lindesay A. S. Scott-Hayward; Yang Li; Michael Bühl; Alexandra M. Z. Slawin; J. Derek Woollins","Automated Chemical Crystallography","Journal of the American Chemical Society","2010","132","","5799","5802","10.1021/ja100247y","","","0.71075","MoKα","","","0.0293","","","","0.0646","","","","","","1.073","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102296","5.5699","0.0019","8.238","0.003","23.826","0.007","90","","90","","90","","1093.3","0.6","125.1","","125","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Se2 -","- C12 H10 Se2 -","- C48 H40 Se8 -","4","1","","Amy L. Fuller; Lindesay A. S. Scott-Hayward; Yang Li; Michael Bühl; Alexandra M. Z. Slawin; J. Derek Woollins","Automated Chemical Crystallography","Journal of the American Chemical Society","2010","132","","5799","5802","10.1021/ja100247y","","","0.7107","MoKα","","","0.0334","","","","0.1014","","","","","","1.224","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102297","5.5878","0.0011","8.2521","0.0017","23.907","0.005","90","","90","","90","","1102.4","0.4","125.1","","125","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Se2 -","- C12 H10 Se2 -","- C48 H40 Se8 -","4","1","","Amy L. Fuller; Lindesay A. S. Scott-Hayward; Yang Li; Michael Bühl; Alexandra M. Z. Slawin; J. Derek Woollins","Automated Chemical Crystallography","Journal of the American Chemical Society","2010","132","","5799","5802","10.1021/ja100247y","","","0.71075","MoKα","","","0.0408","","","","0.0806","","","","","","1.146","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102298","5.1563","0.0008","8.5809","0.0013","26.784","0.004","90","","90","","90","","1185.1","0.3","125.1","","125","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Te2 -","- C12 H10 Te2 -","- C48 H40 Te8 -","4","1","","Amy L. Fuller; Lindesay A. S. Scott-Hayward; Yang Li; Michael Bühl; Alexandra M. Z. Slawin; J. Derek Woollins","Automated Chemical Crystallography","Journal of the American Chemical Society","2010","132","","5799","5802","10.1021/ja100247y","","","0.7107","MoKα","","","0.031","","","","0.1032","","","","","","1.124","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102299","7.7646","0.0002","7.7646","0.0002","7.7646","0.0002","90","","90","","90","","468.12","0.02","273","2","273","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Au19.4 Bi0.6 Ca4 -","- Au19.4 Bi0.6 Ca4 -","- Au19.4 Bi0.6 Ca4 -","1","0.0104167","","Qisheng Lin; John D. Corbett","Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition","Journal of the American Chemical Society","2010","132","","5662","5671","10.1021/ja100250d","","","0.71073","MoKα","","0.02","0.02","","","0.0414","0.0414","","","","","","1.24","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102300","7.8246","0.0002","7.8246","0.0002","7.8246","0.0002","90","","90","","90","","479.06","0.02","273","2","273","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Au9.34 Bi0.66 Ca2 -","- Au9.34 Bi0.66 Ca2 -","- Au18.68 Bi1.32 Ca4 -","2","0.0208333","","Qisheng Lin; John D. Corbett","Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition","Journal of the American Chemical Society","2010","132","","5662","5671","10.1021/ja100250d","","","0.71073","MoKα","","0.0174","0.0174","","","0.0348","0.0348","","","","","","1.112","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102301","7.9199","0.0002","7.9199","0.0002","7.9199","0.0002","90","","90","","90","","496.77","0.02","273","2","273","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Au8.18 Bi1.82 Ca2 -","- Au8.18 Bi1.82 Ca2 -","- Au16.36 Bi3.64 Ca4 -","2","0.0208333","","Qisheng Lin; John D. Corbett","Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition","Journal of the American Chemical Society","2010","132","","5662","5671","10.1021/ja100250d","","","0.71073","MoKα","","0.0136","0.0136","","","0.0332","0.0332","","","","","","1.127","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102302","7.9046","0.0002","7.9046","0.0002","7.9046","0.0002","90","","90","","90","","493.9","0.02","273","2","273","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Au16 Bi4.78 Ca3.22 -","- Au16 Bi4.784 Ca3.216 -","- Au16 Bi4.784 Ca3.216 -","1","0.0104167","","Qisheng Lin; John D. Corbett","Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition","Journal of the American Chemical Society","2010","132","","5662","5671","10.1021/ja100250d","","","0.71073","MoKα","","0.0169","0.0169","","","0.0383","0.0383","","","","","","1.153","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102303","7.9505","0.0002","7.9505","0.0002","7.9505","0.0002","90","","90","","90","","502.55","0.02","273","2","273","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Au8 Bi2.64 Ca1.36 -","- Au8 Bi2.644 Ca1.356 -","- Au16 Bi5.288 Ca2.712 -","2","0.0208333","","Qisheng Lin; John D. Corbett","Multiple Nonstoichiometric Phases with Discrete Composition Ranges in the CaAu5-CaAu4Bi-BiAu2 System. A Case Study of the Chemistry of Spinodal Decomposition","Journal of the American Chemical Society","2010","132","","5662","5671","10.1021/ja100250d","","","0.71073","MoKα","","0.0238","0.0234","","","0.0457","0.0461","","","","","","1.163","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102304","9.6816","0.0006","11.846","0.0007","14.882","0.0009","84.421","0.001","75.462","0.001","68.009","0.001","1531.93","0.16","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H24 O4 -","- C16 H24 O4 -","- C64 H96 O16 -","4","2","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.069","0.0552","","","0.1398","0.1486","","","","","","1.031","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102305","6.9923","0.0004","28.3844","0.0018","8.1995","0.0005","90","","91.323","0.002","90","","1626.94","0.17","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N2 O7 -","- C17 H16 N2 O7 -","- C68 H64 N8 O28 -","4","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.062","0.0491","","","0.1314","0.1391","","","","","","1.065","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102306","11.1282","0.0004","25.3958","0.001","12.4272","0.0005","90","","93.902","0.001","90","","3503.9","0.2","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N2 O8 -","- C18 H18 N2 O8 -","- C144 H144 N16 O64 -","8","2","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0548","0.0457","","","0.1235","0.1303","","","","","","1.05","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102307","8.6807","0.0005","12.2715","0.0008","12.4359","0.0008","80.749","0.002","73.924","0.002","81.848","0.002","1249.75","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H32 N2 O8 -","- C25 H32 N2 O8 -","- C50 H64 N4 O16 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0654","0.0535","","","0.1438","0.1525","","","","","","1.047","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102308","7.4447","0.0004","11.7593","0.0007","12.3555","0.0007","108.336","0.001","104.011","0.001","100.246","0.001","957.54","0.09","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 N2 O9 -","- C19 H20 N2 O9 -","- C38 H40 N4 O18 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0557","0.0497","","","0.1288","0.1334","","","","","","1.045","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102309","7.039","0.0006","24.783","0.002","13.5449","0.0012","90","","100.26","0.002","90","","2325.1","0.3","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H23 N3 O9 -","- C25 H23 N3 O9 -","- C100 H92 N12 O36 -","4","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0671","0.0493","","","0.1259","0.1355","","","","","","1.062","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102310","7.8202","0.0004","11.1046","0.0005","15.2948","0.0007","102.786","0.001","93.96","0.001","103.068","0.001","1251.77","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H27 N3 O11 -","- C27 H27 N3 O11 -","- C54 H54 N6 O22 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0469","0.0429","","","0.1146","0.1176","","","","","","1.038","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102311","7.6819","0.0006","12.8663","0.0009","15.3441","0.0011","70.197","0.001","84.768","0.002","76.122","0.002","1385.15","0.18","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H29 N3 O12 -","- C28 H29 N3 O12 -","- C56 H58 N6 O24 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0765","0.0559","","","0.1378","0.1497","","","","","","1.017","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102312","6.8316","0.0008","15.8889","0.0018","16.43","0.0018","83.062","0.002","78.939","0.003","87.588","0.002","1737.1","0.3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H43 N3 O12 -","- C35 H43 N3 O12 -","- C70 H86 N6 O24 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.084","0.0643","","","0.1517","0.1628","","","","","","1.121","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102313","8.0316","0.001","13.8306","0.0017","15.0009","0.0018","109.279","0.002","93.852","0.002","106.744","0.002","1481.7","0.3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H30 N4 O11 -","- C33 H30 N4 O11 -","- C66 H60 N8 O22 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.103","0.0616","","","0.1287","0.1457","","","","","","1.002","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102314","12.1198","0.0006","13.1343","0.0006","13.7022","0.0006","107.878","0.001","108.158","0.001","95.126","0.001","1930.76","0.16","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H37 N5 O13 -","- C41 H37 N5 O13 -","- C82 H74 N10 O26 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.0915","0.0603","","","0.1375","0.1523","","","","","","1.047","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102315","11.276","0.002","12.301","0.003","16.564","0.003","90.388","0.006","94.562","0.005","105.3","0.005","2208.2","0.8","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C49 H44 N6 O15 -","- C49 H44 N6 O15 -","- C98 H88 N12 O30 -","2","1","","Yan Yan; Bo Qin; Changliang Ren; Xiuying Chen; Yeow Kwan Yip; Ruijuan Ye; Dawei Zhang; Haibin Su; Huaqiang Zeng","Synthesis, Structural Investigations, Hydrogen-Deuterium Exchange Studies, and Molecular Modeling of Conformationally Stablilized Aromatic Oligoamides","Journal of the American Chemical Society","2010","132","","5869","5879","10.1021/ja100579z","","","0.71073","MoKα","","0.1337","0.0868","","","0.1907","0.2159","","","","","","1.057","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102316","5.6763","0.0008","17.997","0.003","22.844","0.003","90","","90","","90","","2333.7","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H22 Br O2 P -","- C27 H22 Br O2 P -","- C108 H88 Br4 O8 P4 -","4","1","","Jian-Jun Feng; Xue-Feng Chen; Min Shi; Wei-Liang Duan","Palladium-Catalyzed Asymmetric Addition of Diarylphosphines to Enones toward the Synthesis of Chiral Phosphines","Journal of the American Chemical Society","2010","132","","5562","5563","10.1021/ja100606v","","","0.71073","MoKα","","0.071","0.0444","","","0.0853","0.0906","","","","","","0.892","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102317","11.309","0.002","24.952","0.005","21.872","0.004","90","","99.339","0.003","90","","6090","2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C76 H78 O4 Zr -","- C76 H78 O4 Zr -","- C304 H312 O16 Zr4 -","4","1","","Elizabeth T. Kiesewetter; Sören Randoll; Madalyn Radlauer; Robert M. Waymouth","Stereospecific Octahedral Group 4 Bis(phenolate) Ether Complexes for Olefin Polymerization","Journal of the American Chemical Society","2010","132","","5566","5567","10.1021/ja100627x","","","0.71073","MoKα","","0.0651","0.0483","","","0.1141","0.1233","","","","","","1.031","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102318","11.2966","0.0015","24.95","0.003","22.016","0.003","90","","99.698","0.002","90","","6116.5","1.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C76 H78 Hf O4 -","- C76 H78 Hf O4 -","- C304 H312 Hf4 O16 -","4","1","","Elizabeth T. Kiesewetter; Sören Randoll; Madalyn Radlauer; Robert M. Waymouth","Stereospecific Octahedral Group 4 Bis(phenolate) Ether Complexes for Olefin Polymerization","Journal of the American Chemical Society","2010","132","","5566","5567","10.1021/ja100627x","","","0.71073","MoKα","","0.0448","0.0329","","","0.078","0.0837","","","","","","1.024","","","","has coordinates","198633","2020-10-21","18:00:00","" "4102319","35.413","0.003","22.233","0.003","19.854","0.005","90","","90","","90","","15632","5","233","2","233","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C79 H89 Cs N5 O12 -","- C76 H80 Cs N5 O9 -","- C608 H640 Cs8 N40 O72 -","8","1","","Sung Kuk Kim; Jonathan L. Sessler; Dustin E. Gross; Chang-Hee Lee; Jong Seung Kim; Vincent M. Lynch; Laetitia H. Delmau; Benjamin P. Hay","A Calix[4]arene Strapped Calix[4]pyrrole: An Ion-Pair Receptor Displaying Three Different Cesium Cation Recognition Modes","Journal of the American Chemical Society","2010","132","","5827","5836","10.1021/ja100715e","","","0.71069","MoKα","","0.3155","0.103","","","0.1654","0.1939","","","","","","1.129","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102320","13.4993","0.0002","26.0185","0.0007","19.6409","0.0005","90","0.005","100.663","0.002","90","0.005","6779.4","0.3","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C77 H86 Cs F N4 O8 -","- C77 H86 Cs F N4 O8 -","- C308 H344 Cs4 F4 N16 O32 -","4","1","","Sung Kuk Kim; Jonathan L. Sessler; Dustin E. Gross; Chang-Hee Lee; Jong Seung Kim; Vincent M. Lynch; Laetitia H. Delmau; Benjamin P. Hay","A Calix[4]arene Strapped Calix[4]pyrrole: An Ion-Pair Receptor Displaying Three Different Cesium Cation Recognition Modes","Journal of the American Chemical Society","2010","132","","5827","5836","10.1021/ja100715e","","","0.71073","MoKα","","0.0803","0.0418","","","0.0839","0.0973","","","","","","1.019","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102321","18.449","0.002","21.316","0.003","22.059","0.003","61.593","0.002","78.297","0.003","74.265","0.003","7316.4","1.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C154 H175.5 Cl2 Cs2 N8.5 O18 -","- C154 H165.5 Cl2 Cs2 N8.5 O15 -","- C308 H331 Cl4 Cs4 N17 O30 -","2","1","","Sung Kuk Kim; Jonathan L. Sessler; Dustin E. Gross; Chang-Hee Lee; Jong Seung Kim; Vincent M. Lynch; Laetitia H. Delmau; Benjamin P. Hay","A Calix[4]arene Strapped Calix[4]pyrrole: An Ion-Pair Receptor Displaying Three Different Cesium Cation Recognition Modes","Journal of the American Chemical Society","2010","132","","5827","5836","10.1021/ja100715e","","","0.71069","MoKα","","0.1865","0.105","","","0.1873","0.2058","","","","","","1.363","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102322","10.5877","0.0005","17.6496","0.0008","35.4397","0.0013","90","","95.51","0.002","90","","6592","0.5","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C78 H88 N4 O8 -","- C78 H88 N4 O8 -","- C312 H352 N16 O32 -","4","1","","Sung Kuk Kim; Jonathan L. Sessler; Dustin E. Gross; Chang-Hee Lee; Jong Seung Kim; Vincent M. Lynch; Laetitia H. Delmau; Benjamin P. Hay","A Calix[4]arene Strapped Calix[4]pyrrole: An Ion-Pair Receptor Displaying Three Different Cesium Cation Recognition Modes","Journal of the American Chemical Society","2010","132","","5827","5836","10.1021/ja100715e","","","0.7107","MoKα","","0.2145","0.0696","","","0.1359","0.1782","","","","","","1","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102323","20.2603","0.0008","25.3053","0.0011","25.6274","0.001","90","","90","","90","","13139","0.9","100","2","100","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C152 H130 Cl8 N4 Nb2 O8 -","- C152 H130 Cl8 N4 Nb2 O8 -","- C608 H520 Cl32 N16 Nb8 O32 -","4","1","","Hiromichi Egami; Takuya Oguma; Tsutomu Katsuki","Oxidation Catalysis of Nb(salan) Complexes: Asymmetric Epoxidation of Allylic Alcohols Using Aqueous Hydrogen Peroxide as an Oxidant","Journal of the American Chemical Society","2010","132","","5886","5895","10.1021/ja100795k","","","0.71073","MoKα","","0.109","0.088","","","0.2384","0.2564","","","","","","1.072","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102324","6.8305","0.0013","6.8305","0.0013","13.962","0.003","90","","90","","120","","564.14","0.19","100","2","100","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- Cl2 Cu3.35 H6 Mg0.65 O6 -","- Cl2 Cu3.344 H6 Mg0.656 O6 -","- Cl6 Cu10.032 H18 Mg1.968 O18 -","3","0.0833333","","Shaoyan Chu; Tyrel M. McQueen; Robin Chisnell; Danna E. Freedman; Peter Müller; Young S. Lee; Daniel G. Nocera","A Cu2+ (S = 1/2) Kagomé Antiferromagnet: MgxCu4-x(OH)6Cl2","Journal of the American Chemical Society","2010","132","","5570","5571","10.1021/ja1008322","","","0.71073","MoKα","","0.0175","0.0168","","","0.044","0.0442","","","","","","1.324","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102325","6.8393","0.0018","6.8393","0.0018","14.005","0.004","90","","90","","120","","567.3","0.3","100","2","100","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- Cl2 Cu3.67 H6 Mg0.33 O6 -","- Cl2 Cu3.686 H6 Mg0.314 O6 -","- Cl6 Cu11.058 H18 Mg0.942 O18 -","3","0.0833333","","Shaoyan Chu; Tyrel M. McQueen; Robin Chisnell; Danna E. Freedman; Peter Müller; Young S. Lee; Daniel G. Nocera","A Cu2+ (S = 1/2) Kagomé Antiferromagnet: MgxCu4-x(OH)6Cl2","Journal of the American Chemical Society","2010","132","","5570","5571","10.1021/ja1008322","","","0.71073","MoKα","","0.0221","0.0219","","","0.0555","0.0556","","","","","","1.244","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102326","6.8322","0.0011","6.8322","0.0011","13.96","0.002","90","","90","","120","","564.34","0.15","100","2","100","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- Cl2 Cu3.25 H6 Mg0.75 O6 -","- Cl2 Cu3.252 H6 Mg0.748 O6 -","- Cl6 Cu9.756 H18 Mg2.244 O18 -","3","0.0833333","","Shaoyan Chu; Tyrel M. McQueen; Robin Chisnell; Danna E. Freedman; Peter Müller; Young S. Lee; Daniel G. Nocera","A Cu2+ (S = 1/2) Kagomé Antiferromagnet: MgxCu4-x(OH)6Cl2","Journal of the American Chemical Society","2010","132","","5570","5571","10.1021/ja1008322","","","0.71073","MoKα","","0.0172","0.0162","","","0.0414","0.0421","","","","","","1.194","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102327","7.1277","0.0001","11.2873","0.0002","13.6337","0.0002","90","","105.186","0.001","90","","1058.56","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 F N2 O -","- C12 H11 F N2 O -","- C48 H44 F4 N8 O4 -","4","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0624","0.0519","","","0.1515","0.1637","","","","","","1.076","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102328","7.0622","0.0004","7.2019","0.0004","11.5013","0.0006","73.718","0.003","80.875","0.003","75.073","0.002","540.2","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C24 H24 N4 O4 -","2","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0991","0.0806","","","0.2527","0.2694","","","","","","1.018","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102329","7.511","0.0001","21.9578","0.0003","8.049","0.0001","90","","110.047","0.001","90","","1247.05","0.03","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-4-(2,5-diemethylbenzylidene)-1,2-dimethyl- 1H-imidazol-5(4H)-one","","- C14 H16 N2 O -","- C14 H16 N2 O -","- C56 H64 N8 O4 -","4","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0563","0.047","","","0.1445","0.1519","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102330","27.911","0.007","27.911","0.007","8.407","0.002","90","","90","","120","","5672","2","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","(Z)-4-(2,5-diemethylbenzylidene)-1,2-dimethyl- 1H-imidazol-5(4H)-one","","- C14 H16 N2 O -","- C14 H16 N2 O -","- C252 H288 N36 O18 -","18","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0584","0.0425","","","0.1363","0.1547","","","","","","1.088","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102331","6.9641","0.0003","7.4052","0.0003","12.8203","0.0005","100.458","0.003","97.239","0.002","112.435","0.003","586.93","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C26 H28 N4 O4 -","2","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0481","0.0415","","","0.1222","0.1354","","","","","","1.122","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102332","7.555","0.004","17.172","0.008","16.754","0.008","90","","90.999","0.012","90","","2173.2","1.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C96 H96 N16 O16 -","8","2","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.1378","0.0714","","","0.1757","0.1997","","","","","","1.001","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102333","7.2224","0.0002","7.3215","0.0001","12.4936","0.0003","96.864","0.001","100.939","0.001","115.801","0.002","568.51","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H14 N2 O -","- C13 H14 N2 O -","- C26 H28 N4 O2 -","2","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.055","0.0452","","","0.1276","0.1399","","","","","","1.072","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102334","7.0404","0.0008","7.2141","0.0007","11.4902","0.0011","74.02","0.006","80.942","0.006","75.193","0.004","540.02","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C24 H24 N4 O4 -","2","1","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0985","0.0653","","","0.1891","0.2079","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102335","10.2568","0.0003","10.47","0.0003","12.1996","0.0005","96.512","0.002","106.279","0.002","118.988","0.001","1050.44","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C48 H48 N8 O8 -","4","2","","Panče Naumov; Janusz Kowalik; Kyril M. Solntsev; Anthony Baldridge; Jong-Seok Moon; Christine Kranz; Laren M. Tolbert","Topochemistry and Photomechanical Effects in Crystals of Green Fluorescent Protein-like Chromophores: Effects of Hydrogen Bonding and Crystal Packing","Journal of the American Chemical Society","2010","132","","5845","5857","10.1021/ja100844m","","","0.71073","MoKα","","0.0563","0.0489","","","0.1343","0.1406","","","","","","1.111","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102336","7.242","0.001","7.939","0.002","14.711","0.003","91.26","0.02","90.96","0.02","95.55","0.03","841.5","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Marek-51 (Bishu)","","","- C18 H26 O3 -","- C18 H26 O3 -","- C36 H52 O6 -","2","1","","Bishnu Dutta; Noga Gilboa; Ilan Marek","Highly Diastereoselective Preparation of Homoallylic Alcohols Containing Two Contiguous Quaternary Stereocenters in Acyclic Systems from Simple Terminal Alkynes","Journal of the American Chemical Society","2010","132","","5588","5589","10.1021/ja101371x","","","0.71073","MoKα","","0.1266","0.0565","","","0.1321","0.1543","","","","","","0.997","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102337","8.5787","0.0006","18.4977","0.0013","12.5721","0.0009","90","","90.313","0.003","90","","1995","0.2","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H29 Au F3 P -","- C18 H29 Au F3 P -","- C72 H116 Au4 F12 P4 -","4","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0277","0.0272","","","0.0696","0.0699","","","","","","1.133","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102338","8.56","0.003","20.335","0.006","12.155","0.004","90","","104.92","0.01","90","","2044.5","1.2","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 Au F5 P -","- C18 H27 Au F5 P -","- C72 H108 Au4 F20 P4 -","4","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0448","0.0327","","","0.0645","0.0717","","","","","","0.786","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102339","8.528","0.003","18.534","0.005","12.578","0.004","90","","90.101","0.008","90","","1988","1.1","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H29 Au F3 P -","- C18 H29 Au F3 P -","- C72 H116 Au4 F12 P4 -","4","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.036","0.033","","","0.0834","0.0868","","","","","","0.822","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102340","17.458","0.005","15.145","0.003","16.548","0.005","90","","116.557","0.005","90","","3913.7","1.8","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 Au F2 P -","- C18 H30 Au F2 P -","- C144 H240 Au8 F16 P8 -","8","2","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0375","0.0326","","","0.0748","0.0788","","","","","","0.801","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102341","10.433","0.009","12.677","0.008","16.21","0.013","90","","104.65","0.02","90","","2074","3","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H32 Au F2 P -","- C19 H32 Au F2 P -","- C76 H128 Au4 F8 P4 -","4","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0978","0.0676","","","0.213","0.2908","","","","","","1.241","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102342","8.837","0.004","20.754","0.007","11.608","0.005","90","","106.169","0.012","90","","2044.7","1.5","93","2","93","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 Au N2 O4 P -","- C18 H30 Au N2 O4 P -","- C72 H120 Au4 N8 O16 P4 -","4","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0489","0.0433","","","0.1234","0.1579","","","","","","1.155","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102343","10.905","0.003","20.102","0.005","14.188","0.004","90","","100.793","0.007","90","","3055.2","1.4","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H38 Au F3 N2 -","- C33 H38 Au F3 N2 -","- C132 H152 Au4 F12 N8 -","4","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0418","0.0324","","","0.0724","0.0784","","","","","","0.819","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102344","11.677","0.004","13.18","0.004","26.365","0.009","90","","95.868","0.01","90","","4036","2","93","2","93","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H17 Au F3 P -","- C24 H17 Au F3 P -","- C192 H136 Au8 F24 P8 -","8","1","","Pengfei Lu; Tanya C. Boorman; Alexandra M. Z. Slawin; Igor Larrosa","Gold(I)-Mediated C-H Activation of Arenes","Journal of the American Chemical Society","2010","132","","5580","5581","10.1021/ja101525w","","","0.71073","MoKα","","0.0743","0.0524","","","0.1545","0.2302","","","","","","1.205","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102345","15.95","0.003","11.7","0.002","10.21","0.002","90","","112.77","0.03","90","","1756.8","0.7","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C18 H13 Cd N3 O4 -","- C18 H13 Cd N3 O4 -","- C72 H52 Cd4 N12 O16 -","4","0.5","","Hai-Long Jiang; Yoshiro Tatsu; Zhang-Hui Lu; Qiang Xu","Non-, Micro-, and Mesoporous Metal-Organic Framework Isomers: Reversible Transformation, Fluorescence Sensing, and Large Molecule Separation","Journal of the American Chemical Society","2010","132","","5586","5587","10.1021/ja101541s","","","0.71073","MoKα","","0.0855","0.0491","","","0.1165","0.1411","","","","","","1.02","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102346","13.7","0.003","21.05","0.004","11.72","0.002","90","","90","","90","","3379.9","1.1","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C18 H13 Cd N3 O4 -","- C18 H13 Cd N3 O4 -","- C72 H52 Cd4 N12 O16 -","4","0.5","","Hai-Long Jiang; Yoshiro Tatsu; Zhang-Hui Lu; Qiang Xu","Non-, Micro-, and Mesoporous Metal-Organic Framework Isomers: Reversible Transformation, Fluorescence Sensing, and Large Molecule Separation","Journal of the American Chemical Society","2010","132","","5586","5587","10.1021/ja101541s","","","0.71073","MoKα","","0.0622","0.0443","","","0.1022","0.1065","","","","","","0.805","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102347","25.29","0.004","25.29","0.004","11.69","0.002","90","","90","","120","","6475","1.8","293","2","293","2","","","","","","","","5","P 6/m","-P 6","175","","","","- C18 H13 Cd N3 O4 -","- C18 H13 Cd N3 O4 -","- C108 H78 Cd6 N18 O24 -","6","0.5","","Hai-Long Jiang; Yoshiro Tatsu; Zhang-Hui Lu; Qiang Xu","Non-, Micro-, and Mesoporous Metal-Organic Framework Isomers: Reversible Transformation, Fluorescence Sensing, and Large Molecule Separation","Journal of the American Chemical Society","2010","132","","5586","5587","10.1021/ja101541s","","","0.71073","MoKα","","0.1234","0.0763","","","0.172","0.191","","","","","","1.067","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102348","16.105","0.004","11.323","0.003","15.526","0.004","90","","107.556","0.005","90","","2699.4","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H51 B Cl N Os P2 -","- C20 H51 B Cl N Os P2 -","- C80 H204 B4 Cl4 N4 Os4 P8 -","4","1","","Miguel A. Esteruelas; Francisco J. Fernández-Alvarez; Ana M. López; Malka Mora; Enrique Oñate","Borinium Cations as σ-B-H Ligands in Osmium Complexes","Journal of the American Chemical Society","2010","132","","5600","5601","10.1021/ja101806x","","","0.71073","MoKα","","0.0635","0.0386","","","0.0784","0.0861","","","","","","1.004","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102349","14.005","0.002","10.5978","0.0018","26.244","0.004","90","","101.324","0.003","90","","3819.4","1","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H69 B2 Cl O4 Os P2 -","- C30 H69 B2 Cl O4 Os P2 -","- C120 H276 B8 Cl4 O16 Os4 P8 -","4","1","","Miguel A. Esteruelas; Francisco J. Fernández-Alvarez; Ana M. López; Malka Mora; Enrique Oñate","Borinium Cations as σ-B-H Ligands in Osmium Complexes","Journal of the American Chemical Society","2010","132","","5600","5601","10.1021/ja101806x","","","0.71073","MoKα","","0.09","0.0463","","","0.0746","0.0849","","","","","","1.008","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102350","8.224","0.0016","6.585","0.0013","13.899","0.003","90","","94.19","0.03","90","","750.7","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H19 Br O2 -","- C18 H19 Br O2 -","- C36 H38 Br2 O4 -","2","1","","Kazutaka Shibatomi; Kentaro Futatsugi; Fumito Kobayashi; Seiji Iwasa; Hisashi Yamamoto","Stereoselective Construction of Halogenated Quaternary Stereogenic Centers via Catalytic Asymmetric Diels-Alder Reaction","Journal of the American Chemical Society","2010","132","","5625","5627","10.1021/ja1018628","","","0.71073","MoKα","","0.047","0.0422","","","0.097","0.0984","","","","","","0.981","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102351","7.0708","0.0015","16.433","0.003","13.37","0.003","90","","92.797","0.003","90","","1551.7","0.6","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H21 Br O2 -","- C19 H21 Br O2 -","- C76 H84 Br4 O8 -","4","2","","Kazutaka Shibatomi; Kentaro Futatsugi; Fumito Kobayashi; Seiji Iwasa; Hisashi Yamamoto","Stereoselective Construction of Halogenated Quaternary Stereogenic Centers via Catalytic Asymmetric Diels-Alder Reaction","Journal of the American Chemical Society","2010","132","","5625","5627","10.1021/ja1018628","","","0.71073","MoKα","","0.0306","0.0283","","","0.0595","0.06","","","","","","0.974","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102352","6.5078","0.0013","16.614","0.003","13.417","0.003","90","","91.79","0.03","90","","1449.9","0.5","20","","20","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H19 Cl O2 -","- C18 H19 Cl O2 -","- C72 H76 Cl4 O8 -","4","2","","Kazutaka Shibatomi; Kentaro Futatsugi; Fumito Kobayashi; Seiji Iwasa; Hisashi Yamamoto","Stereoselective Construction of Halogenated Quaternary Stereogenic Centers via Catalytic Asymmetric Diels-Alder Reaction","Journal of the American Chemical Society","2010","132","","5625","5627","10.1021/ja1018628","","","0.41328","","","0.0534","0.0517","","","0.1266","0.1284","","","","","","1.118","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102353","9.85577","0.00007","9.85577","0.00007","9.85577","0.00007","90","","90","","90","","957.352","0.012","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","","","- Ga0.894 S8 Ti3.4 V -","- Ga0.894 S8 Ti3.4 V -","- Ga3.576 S32 Ti13.6 V4 -","4","0.0416667","","Eugen Dorolti; Laurent Cario; Benoît Corraze; Etienne Janod; Cristian Vaju; Hyun-Joo Koo; Erjun Kan; Myung-Hwan Whangbo","Half-Metallic Ferromagnetism and Large Negative Magnetoresistance in the New Lacunar Spinel GaTi3VS8","Journal of the American Chemical Society","2010","132","","5704","5710","10.1021/ja908128b","powder diffraction","","","X-ray","","","","","","","","","4.8953","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102354","9.721893","0.00002","9.721893","0.00002","9.721893","0.00002","90","","90","","90","","918.867","0.003","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","","","- Ga1.021 S8 Ti V3 -","- Ga1.021 S8 Ti V3 -","- Ga4.084 S32 Ti4 V12 -","4","0.0416667","","Eugen Dorolti; Laurent Cario; Benoît Corraze; Etienne Janod; Cristian Vaju; Hyun-Joo Koo; Erjun Kan; Myung-Hwan Whangbo","Half-Metallic Ferromagnetism and Large Negative Magnetoresistance in the New Lacunar Spinel GaTi3VS8","Journal of the American Chemical Society","2010","132","","5704","5710","10.1021/ja908128b","powder diffraction","","","","","","","","","","","","4.5761","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102355","4.58878","0.00015","4.58878","0.00015","2.95756","0.00018","90","","90","","90","","62.277","0.005","","","","","","","","","","","","2","P 42/m n m","-P 4n 2n","136","","","","- O2 Ti -","- O2 Ti -","- O4 Ti2 -","2","0.125","","Eugen Dorolti; Laurent Cario; Benoît Corraze; Etienne Janod; Cristian Vaju; Hyun-Joo Koo; Erjun Kan; Myung-Hwan Whangbo","Half-Metallic Ferromagnetism and Large Negative Magnetoresistance in the New Lacunar Spinel GaTi3VS8","Journal of the American Chemical Society","2010","132","","5704","5710","10.1021/ja908128b","powder diffraction","","","","","","","","","","","","31.8903","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102356","24.333","0.005","4.111","0.0008","19.673","0.004","90","","90","","90","","1967.9","0.7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Iron Lead Antinony Selenide (0.75/3.25/4/10)","","- Fe0.75 Pb3.25 Sb4 Se10 -","- Fe0.75 Pb3.25 Sb4 Se10 -","- Fe3 Pb13 Sb16 Se40 -","4","0.5","","Pierre F. P. Poudeu; Nathan Takas; Clarence Anglin; James Eastwood; Arianna Rivera","Fe~x~Pb~4-x~Sb~4~Se~10~: A New Class of Ferromagnetic Semiconductors with Quasi 1D {Fe~2~Se~10~} Ladders","Journal of the American Chemical Society","2010","132","","5751","5760","10.1021/ja910545e","","","0.71073","MoKα","","0.0293","0.0293","","","0.0717","0.0717","","","","","","1.232","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102357","19.6918","0.0009","4.1153","0.0002","24.3607","0.0011","90","","90.02","0.01","90","","1974.13","0.16","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Iron Lead Antinony Selenide (0.96/3.04/4/10)","","- Fe0.96 Pb3.04 Sb4 Se10 -","- Fe0.9615 Pb3.0385 Sb4 Se10 -","- Fe3.846 Pb12.154 Sb16 Se40 -","4","1","","Pierre F. P. Poudeu; Nathan Takas; Clarence Anglin; James Eastwood; Arianna Rivera","Fe~x~Pb~4-x~Sb~4~Se~10~: A New Class of Ferromagnetic Semiconductors with Quasi 1D {Fe~2~Se~10~} Ladders","Journal of the American Chemical Society","2010","132","","5751","5760","10.1021/ja910545e","","","0.71073","MoKα","","0.0282","0.0282","","","0.0664","0.0664","","","","","","1.22","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102358","9.6088","0.0009","9.6875","0.0008","14.5497","0.0016","72.189","0.007","89.358","0.01","88.158","0.007","1288.8","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H25 Cl8 N3 Sb -","- C16 H25 Cl8 N3 Sb -","- C32 H50 Cl16 N6 Sb2 -","2","1","","Almaz S. Jalilov; Gaoquan Li; Stephen F. Nelsen; Ilia A. Guzei; Qin Wu","Solution and Solid-State Studies of Doubly Trimethylene-Bridged Tetraalkyl p-Phenylenediamine Diradical Dication Conformations","Journal of the American Chemical Society","2010","132","","6176","6182","10.1021/ja100322k","","","1.54178","Cu-Kα","","0.09","0.0814","","","0.2183","0.2288","","","","","","1.038","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102359","9.2925","0.0003","14.6281","0.0004","15.0725","0.0005","90","","103.215","0.002","90","","1994.57","0.11","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C30 H48 F12 N4 Sb2 -","- C30 H48 F11 N4 Sb2 -","- C60 H96 F22 N8 Sb4 -","2","0.5","","Almaz S. Jalilov; Gaoquan Li; Stephen F. Nelsen; Ilia A. Guzei; Qin Wu","Solution and Solid-State Studies of Doubly Trimethylene-Bridged Tetraalkyl p-Phenylenediamine Diradical Dication Conformations","Journal of the American Chemical Society","2010","132","","6176","6182","10.1021/ja100322k","","","1.54178","Cu-Kα","","0.0551","0.0395","","","0.0862","0.0915","","","","","","1.003","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102360","7.2994","0.0003","12.7484","0.0006","21.9094","0.001","90","","94.84","0.004","90","","2031.52","0.16","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H38 Cl12 N6 Sb2 -","- C26 H38 Cl12 N6 Sb2 -","- C52 H76 Cl24 N12 Sb4 -","2","0.5","","Almaz S. Jalilov; Gaoquan Li; Stephen F. Nelsen; Ilia A. Guzei; Qin Wu","Solution and Solid-State Studies of Doubly Trimethylene-Bridged Tetraalkyl p-Phenylenediamine Diradical Dication Conformations","Journal of the American Chemical Society","2010","132","","6176","6182","10.1021/ja100322k","","","1.54178","CuKα","","0.0874","0.0646","","","0.1265","0.1353","","","","","","1.146","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102361","6.5273","0.0005","10.0768","0.0008","11.9925","0.00013","109.5","0.005","100.439","0.005","104.66","0.05","688.1","0.3","100","1","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H32 F12 N4 Sb2 -","- C22 H32 F12 N4 Sb2 -","- C22 H32 F12 N4 Sb2 -","1","0.5","","Almaz S. Jalilov; Gaoquan Li; Stephen F. Nelsen; Ilia A. Guzei; Qin Wu","Solution and Solid-State Studies of Doubly Trimethylene-Bridged Tetraalkyl p-Phenylenediamine Diradical Dication Conformations","Journal of the American Chemical Society","2010","132","","6176","6182","10.1021/ja100322k","","","1.54178","Cu-Kα","","0.0319","0.0307","","","0.0804","0.081","","","","","","1.037","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102362","12.5994","0.0006","21.9541","0.001","12.828","0.0006","90","","95.825","0.002","90","","3530","0.3","123","","123","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H34 F6 Ir N6 P -","- C38 H34 F6 Ir N6 P -","- C152 H136 F24 Ir4 N24 P4 -","4","1","","Rubén D. Costa; Enrique Ortí; Henk J. Bolink; Stefan Graber; Catherine E. Housecroft; Edwin C. Constable","Intramolecular π-Stacking in a Phenylpyrazole-Based Iridium Complex and Its Use in Light-Emitting Electrochemical Cells","Journal of the American Chemical Society","2010","132","","5978","5980","10.1021/ja1010674","","","0.71073","MoKα","","0.0628","0.0222","","0.0417","0.0201","0.0201","","","","","","1.0936","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102363","7.5884","0.0005","11.4643","0.0008","20.3343","0.0013","86.321","0.003","83.111","0.003","72.125","0.003","1670.75","0.19","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H42 Cl2 N2 Ni O4 -","- C36 H42 Cl2 N2 Ni O4 -","- C72 H84 Cl4 N4 Ni2 O8 -","2","1","","James D. Crowley; Stephen M. Goldup; Nicholas D. Gowans; David A. Leigh; Vicki E. Ronaldson; Alexandra M. Z. Slawin","An Unusual Nickel-Copper-Mediated Alkyne Homocoupling Reaction for the Active-Template Synthesis of [2]Rotaxanes","Journal of the American Chemical Society","2010","132","","6243","6248","10.1021/ja101121j","","","0.71073","MoKα","","0.0442","0.0415","","","0.0999","0.1015","","","","","","1.139","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102364","19.191","0.003","8.4088","0.001","29.802","0.004","90","","90","","90","","4809.2","1.1","170","2","170","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H38 Cl2 Cr N6 -","- C18 H38 Cl2 Cr N6 -","- C144 H304 Cl16 Cr8 N48 -","8","1","","Jaeheung Cho; Jaeyoung Woo; Wonwoo Nam","An ""End-On"" Chromium(III)-Superoxo Complex: Crystallographic and Spectroscopic Characterization and Reactivity in C-H Bond Activation of Hydrocarbons","Journal of the American Chemical Society","2010","132","","5958","5959","10.1021/ja1015926","","","0.71073","MoKα","","0.1182","0.0781","","","0.2209","0.2367","","","","","","1.182","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102365","9.395","0.003","11.455","0.004","12.58","0.005","115.39","0.02","93.81","0.02","93.85","0.02","1213.5","0.8","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H38 Cl2 Cr N6 O2 -","- C18 H38 Cl2 Cr N6 O2 -","- C36 H76 Cl4 Cr2 N12 O4 -","2","1","","Jaeheung Cho; Jaeyoung Woo; Wonwoo Nam","An ""End-On"" Chromium(III)-Superoxo Complex: Crystallographic and Spectroscopic Characterization and Reactivity in C-H Bond Activation of Hydrocarbons","Journal of the American Chemical Society","2010","132","","5958","5959","10.1021/ja1015926","","","0.71073","MoKα","","0.1073","0.0726","","","0.2563","0.2685","","","","","","1.192","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102366","16.945","0.003","20.205","0.004","18.017","0.004","90","","90.16","0.03","90","","6169","2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H88 Mo6 N4 O19 -","- C48 H88 Mo6 N4 O19 -","- C192 H352 Mo24 N16 O76 -","4","1","","Fengping Xiao; Jian Hao; Jin Zhang; Chunlin Lv; Panchao Yin; Longsheng Wang; Yongge Wei","Polyoxometalatocyclophanes: Controlled Assembly of Polyoxometalate-Based Chiral Metallamacrocycles from Achiral Building Blocks","Journal of the American Chemical Society","2010","132","","5956","5957","10.1021/ja101671q","","","0.71073","MoKα","","0.0788","0.048","","","0.1126","0.1325","","","","","","1.047","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102367","11.798","0.002","16.642","0.003","17.248","0.003","90","","106.91","0.03","90","","3240.1","1.1","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C50 H92 Mo6 N4 O19 -","- C50 H92 Mo6 N4 O19 -","- C100 H184 Mo12 N8 O38 -","2","1","","Fengping Xiao; Jian Hao; Jin Zhang; Chunlin Lv; Panchao Yin; Longsheng Wang; Yongge Wei","Polyoxometalatocyclophanes: Controlled Assembly of Polyoxometalate-Based Chiral Metallamacrocycles from Achiral Building Blocks","Journal of the American Chemical Society","2010","132","","5956","5957","10.1021/ja101671q","","","0.71073","MoKα","","0.0312","0.0282","","","0.0698","0.0717","","","","","","1.049","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102368","11.78","0.002","16.623","0.003","17.258","0.004","90","","106.83","0.03","90","","3234.7","1.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C50 H92 Mo6 N4 O19 -","- C50 H92 Mo6 N4 O19 -","- C100 H184 Mo12 N8 O38 -","2","1","","Fengping Xiao; Jian Hao; Jin Zhang; Chunlin Lv; Panchao Yin; Longsheng Wang; Yongge Wei","Polyoxometalatocyclophanes: Controlled Assembly of Polyoxometalate-Based Chiral Metallamacrocycles from Achiral Building Blocks","Journal of the American Chemical Society","2010","132","","5956","5957","10.1021/ja101671q","","","0.71073","MoKα","","0.0353","0.0322","","","0.079","0.0807","","","","","","1.054","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102369","12.426","0.003","12.58","0.003","23.06","0.005","81.09","0.03","77.37","0.03","79.7","0.03","3435.5","1.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H99 Mo6 N5 O19 -","- C54 H99 Mo6 N5 O19 -","- C108 H198 Mo12 N10 O38 -","2","1","","Fengping Xiao; Jian Hao; Jin Zhang; Chunlin Lv; Panchao Yin; Longsheng Wang; Yongge Wei","Polyoxometalatocyclophanes: Controlled Assembly of Polyoxometalate-Based Chiral Metallamacrocycles from Achiral Building Blocks","Journal of the American Chemical Society","2010","132","","5956","5957","10.1021/ja101671q","","","0.71073","MoKα","","0.0774","0.0486","","","0.1283","0.1548","","","","","","1.05","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102370","6.6135","0.0002","9.6729","0.0003","14.923","0.0005","85.1702","0.0017","82.1886","0.0018","81.5996","0.0017","933.63","0.05","110","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H48 Br2 Co N2 O4 -","- C38 H48 Br2 Co N2 O4 -","- C38 H48 Br2 Co N2 O4 -","1","0.5","","R. D. Schmidt; D. A. Shultz; J. D. Martin; P. D. Boyle","Goldilocks Effect in Magnetic Bistability: Remote Substituent Modulation and Lattice Control of Photoinduced Valence Tautomerism and Light-Induced Thermal Hysteresis","Journal of the American Chemical Society","2010","132","","6261","6273","10.1021/ja101957c","","","0.71073","MoKα","","0.1283","0.0518","","","0.0871","0.1089","","","","","","0.979","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102371","10.335","0.0006","10.0315","0.0006","21.6292","0.0013","90","","90.82","0.003","90","","2242.2","0.2","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H54 Co N2 O4 -","- C40 H54 Co N2 O4 -","- C80 H108 Co2 N4 O8 -","2","0.5","","R. D. Schmidt; D. A. Shultz; J. D. Martin; P. D. Boyle","Goldilocks Effect in Magnetic Bistability: Remote Substituent Modulation and Lattice Control of Photoinduced Valence Tautomerism and Light-Induced Thermal Hysteresis","Journal of the American Chemical Society","2010","132","","6261","6273","10.1021/ja101957c","","","0.71073","MoKα","","0.1125","0.0826","","","0.199","0.214","","","","","","0.97","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102372","11.7175","0.0009","22.4237","0.0018","7.283","0.0006","90","","90.286","0.004","90","","1913.6","0.3","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H48 Co N4 O8 -","- C38 H48 Co N4 O8 -","- C76 H96 Co2 N8 O16 -","2","0.5","","R. D. Schmidt; D. A. Shultz; J. D. Martin; P. D. Boyle","Goldilocks Effect in Magnetic Bistability: Remote Substituent Modulation and Lattice Control of Photoinduced Valence Tautomerism and Light-Induced Thermal Hysteresis","Journal of the American Chemical Society","2010","132","","6261","6273","10.1021/ja101957c","","","0.71073","MoKα","","0.1144","0.0861","","","0.178","0.1915","","","","","","1.147","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102373","11.6823","0.0016","21.061","0.003","7.4348","0.0011","90","","93.54","0.003","90","","1825.8","0.5","85","2","85","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H54 Co N2 O6 -","- C40 H54 Co N2 O6 -","- C80 H108 Co2 N4 O12 -","2","0.5","","R. D. Schmidt; D. A. Shultz; J. D. Martin; P. D. Boyle","Goldilocks Effect in Magnetic Bistability: Remote Substituent Modulation and Lattice Control of Photoinduced Valence Tautomerism and Light-Induced Thermal Hysteresis","Journal of the American Chemical Society","2010","132","","6261","6273","10.1021/ja101957c","","","0.71073","MoKα","","0.0775","0.0485","","","0.093","0.1023","","","","","","1.079","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102374","10.463","0.002","9.266","0.002","22.165","0.005","90","","94.838","0.004","90","","2141.2","0.8","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41.5 H58 Co N2 O4 -","- C38 H50 Co N2 O4 -","- C76 H100 Co2 N4 O8 -","2","0.5","","R. D. Schmidt; D. A. Shultz; J. D. Martin; P. D. Boyle","Goldilocks Effect in Magnetic Bistability: Remote Substituent Modulation and Lattice Control of Photoinduced Valence Tautomerism and Light-Induced Thermal Hysteresis","Journal of the American Chemical Society","2010","132","","6261","6273","10.1021/ja101957c","","","0.71073","MoKα","","0.0655","0.0515","","","0.1387","0.1439","","","","","","1.178","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102375","15.3071","0.0007","21.9836","0.0011","7.368","0.0003","90","","91.239","0.002","90","","2478.8","0.2","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H64 Co N4 O4 -","- C54 H64 Co N4 O4 -","- C108 H128 Co2 N8 O8 -","2","0.5","","R. D. Schmidt; D. A. Shultz; J. D. Martin; P. D. Boyle","Goldilocks Effect in Magnetic Bistability: Remote Substituent Modulation and Lattice Control of Photoinduced Valence Tautomerism and Light-Induced Thermal Hysteresis","Journal of the American Chemical Society","2010","132","","6261","6273","10.1021/ja101957c","","","0.71073","MoKα","","0.1019","0.0492","","","0.1046","0.1269","","","","","","1.027","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102376","10.9625","0.0005","8.5221","0.0004","24.6537","0.0009","90","","95.801","0.004","90","","2291.44","0.17","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H35 Cl2 Fe N5 O6 -","- C15 H35 Cl2 Fe N5 O6 -","- C60 H140 Cl8 Fe4 N20 O24 -","4","1","","Thengarai S. Venkatakrishnan; Shaon Sahoo; Nicolas Bréfuel; Carine Duhayon; Carley Paulsen; Anne-Laure Barra; S. Ramasesha; Jean-Pascal Sutter","Enhanced Ion Anisotropy by Nonconventional Coordination Geometry: Single-Chain Magnet Behavior for a [{FeIIL}2{NbIV(CN)8}] Helical Chain Compound Designed with Heptacoordinate FeII","Journal of the American Chemical Society","2010","132","","6047","6056","10.1021/ja9089389","","","0.71073","MoKα","","0.0391","0.0313","","","0.0849","0.0934","","","","","","1.101","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102377","13.4352","0.0005","17.59","0.001","21.0784","0.0008","90","","99.578","0.003","90","","4911.9","0.4","180","","180","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H58 Fe2 Mo N18 O6 -","- C38 H46 Fe2 Mo N18 O6 -","- C152 H184 Fe8 Mo4 N72 O24 -","4","1","","Thengarai S. Venkatakrishnan; Shaon Sahoo; Nicolas Bréfuel; Carine Duhayon; Carley Paulsen; Anne-Laure Barra; S. Ramasesha; Jean-Pascal Sutter","Enhanced Ion Anisotropy by Nonconventional Coordination Geometry: Single-Chain Magnet Behavior for a [{FeIIL}2{NbIV(CN)8}] Helical Chain Compound Designed with Heptacoordinate FeII","Journal of the American Chemical Society","2010","132","","6047","6056","10.1021/ja9089389","","","0.71073","MoKα","","0.1891","0.0966","","0.1425","0.1123","0.1123","","","","","","1.1082","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102378","13.403","0.005","17.532","0.005","21.084","0.005","90","","99.478","0.005","90","","4887","3","180","","180","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H55 Fe2 N18 O4.5 W -","- C38 H46 Fe2 N18 O4.5 W -","- C152 H184 Fe8 N72 O18 W4 -","4","1","","Thengarai S. Venkatakrishnan; Shaon Sahoo; Nicolas Bréfuel; Carine Duhayon; Carley Paulsen; Anne-Laure Barra; S. Ramasesha; Jean-Pascal Sutter","Enhanced Ion Anisotropy by Nonconventional Coordination Geometry: Single-Chain Magnet Behavior for a [{FeIIL}2{NbIV(CN)8}] Helical Chain Compound Designed with Heptacoordinate FeII","Journal of the American Chemical Society","2010","132","","6047","6056","10.1021/ja9089389","","","0.71073","MoKα","","0.1633","0.06","","0.1042","0.0662","0.0662","","","","","","1.1357","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102379","11.861","0.006","13.143","0.006","16.803","0.008","101.311","0.004","97.606","0.009","100.814","0.007","2484","2","103.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H62 Br4 N4 O3 -","- C52 H62 Br4 N4 O3 -","- C104 H124 Br8 N8 O6 -","2","1","","Yoshiaki Shoji; Kentaro Tashiro; Takuzo Aida","One-Pot Enantioselective Extraction of Chiral Fullerene C76 Using a Cyclic Host Carrying an Asymmetrically Distorted, Highly π-Basic Porphyrin Module","Journal of the American Chemical Society","2010","132","","5928","5929","10.1021/ja910701q","","","0.71075","MoKα","","","0.0814","","","","0.22","","","","","","1.034","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102380","11.6141","0.0008","18.8908","0.0014","10.0488","0.0006","90","","102.012","0.002","90","","2156.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 F3 N O4 -","- C24 H26 F3 N O4 -","- C96 H104 F12 N4 O16 -","4","1","","Hidenori Kinoshita; Oscar J. Ingham; Winnie W. Ong; Aaron B. Beeler; John A. Porco","Tandem Processes Identified from Reaction Screening: Nucleophilic Addition to Aryl N-Phosphinylimines Employing La(III)-TFAA Activation","Journal of the American Chemical Society","2010","132","","6412","6418","10.1021/ja100346w","","","0.71073","MoKα","","0.0733","0.0484","","","0.1094","0.1215","","","","","","1.04","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102381","10.9153","0.0012","7.296","0.0009","23.168","0.003","90","","93.879","0.006","90","","1840.8","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 F3 N O4 -","- C21 H20 F3 N O4 -","- C84 H80 F12 N4 O16 -","4","1","","Hidenori Kinoshita; Oscar J. Ingham; Winnie W. Ong; Aaron B. Beeler; John A. Porco","Tandem Processes Identified from Reaction Screening: Nucleophilic Addition to Aryl N-Phosphinylimines Employing La(III)-TFAA Activation","Journal of the American Chemical Society","2010","132","","6412","6418","10.1021/ja100346w","","","0.71073","MoKα","","0.058","0.0433","","","0.0977","0.1047","","","","","","1.05","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102382","10.4731","0.0004","10.016","0.0004","18.348","0.0007","90","","104.366","0.002","90","","1864.5","0.13","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H19 Br F3 N O -","- C21 H19 Br F3 N O -","- C84 H76 Br4 F12 N4 O4 -","4","1","","Hidenori Kinoshita; Oscar J. Ingham; Winnie W. Ong; Aaron B. Beeler; John A. Porco","Tandem Processes Identified from Reaction Screening: Nucleophilic Addition to Aryl N-Phosphinylimines Employing La(III)-TFAA Activation","Journal of the American Chemical Society","2010","132","","6412","6418","10.1021/ja100346w","","","0.71073","MoKα","","0.0555","0.0303","","","0.0599","0.0683","","","","","","1.025","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102383","10.32","0.003","11.387","0.004","12.207","0.004","90.235","0.012","115.124","0.011","105.603","0.011","1239.3","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H26 F3 N O4 -","- C28 H26 F3 N O4 -","- C56 H52 F6 N2 O8 -","2","1","","Hidenori Kinoshita; Oscar J. Ingham; Winnie W. Ong; Aaron B. Beeler; John A. Porco","Tandem Processes Identified from Reaction Screening: Nucleophilic Addition to Aryl N-Phosphinylimines Employing La(III)-TFAA Activation","Journal of the American Chemical Society","2010","132","","6412","6418","10.1021/ja100346w","","","0.71073","MoKα","","0.0833","0.0462","","","0.1134","0.1236","","","","","","1.082","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102384","19.6843","0.0007","17.8444","0.0005","25.7736","0.0009","90","","90","","90","","9053.1","0.5","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H24 F3 N O2 -","- C28 H24 F3 N O2 -","- C448 H384 F48 N16 O32 -","16","2","","Hidenori Kinoshita; Oscar J. Ingham; Winnie W. Ong; Aaron B. Beeler; John A. Porco","Tandem Processes Identified from Reaction Screening: Nucleophilic Addition to Aryl N-Phosphinylimines Employing La(III)-TFAA Activation","Journal of the American Chemical Society","2010","132","","6412","6418","10.1021/ja100346w","","","0.71073","MoKα","","0.082","0.047","","","0.1039","0.1205","","","","","","1.094","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102385","12.243","0.002","8.8775","0.0018","27.705","0.006","90","","98.35","0.03","90","","2979.3","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H37 O P Pd Si2 -","- C32 H37 O P Pd Si2 -","- C128 H148 O4 P4 Pd4 Si8 -","4","1","","Mathieu J.-L. Tschan; Eduardo J. García-Suárez; Zoraida Freixa; Hélène Launay; Henk Hagen; Jordi Benet-Buchholz; Piet W. N. M. van Leeuwen","Efficient Bulky Phosphines for the Selective Telomerization of 1,3-Butadiene with Methanol","Journal of the American Chemical Society","2010","132","","6463","6473","10.1021/ja100521m","","","0.71073","MoKα","","0.0343","0.0294","","","0.0734","0.0753","","","","","","1.064","","","","has coordinates","288243","2023-12-12","09:57:13","" "4102386","20.0915","0.0017","17.3002","0.0017","18.7964","0.0018","90","","94.156","0.004","90","","6516.2","1.1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H41 O3 P Pd Si2 -","- C34 H41 O3 P Pd Si2 -","- C272 H328 O24 P8 Pd8 Si16 -","8","1","","Mathieu J.-L. Tschan; Eduardo J. García-Suárez; Zoraida Freixa; Hélène Launay; Henk Hagen; Jordi Benet-Buchholz; Piet W. N. M. van Leeuwen","Efficient Bulky Phosphines for the Selective Telomerization of 1,3-Butadiene with Methanol","Journal of the American Chemical Society","2010","132","","6463","6473","10.1021/ja100521m","","","0.71073","MoKα","","0.0671","0.0587","","","0.1527","0.1659","","","","","","1.029","","","","has coordinates","288243","2023-12-12","09:57:13","" "4102387","10.2083","0.0003","12.3688","0.0004","12.3907","0.0004","90.612","0.002","94.807","0.001","110.861","0.001","1455.42","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H37 O P Pd Si2 -","- C31 H37 O P Pd Si2 -","- C62 H74 O2 P2 Pd2 Si4 -","2","1","","Mathieu J.-L. Tschan; Eduardo J. García-Suárez; Zoraida Freixa; Hélène Launay; Henk Hagen; Jordi Benet-Buchholz; Piet W. N. M. van Leeuwen","Efficient Bulky Phosphines for the Selective Telomerization of 1,3-Butadiene with Methanol","Journal of the American Chemical Society","2010","132","","6463","6473","10.1021/ja100521m","","","0.71073","MoKα","","0.0407","0.0349","","","0.0889","0.0935","","","","","","1.054","","","","has coordinates","288243","2023-12-12","09:57:13","" "4102388","19.639","0.009","17.258","0.01","40.11","0.02","90","","90","","90","","13594","12","173","2","173","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C120 Cl12 -","- C120 Cl12 -","- C960 Cl96 -","8","1","","Igor V. Kuvychko; Alexey V. Streletskii; Natalia B. Shustova; Konrad Seppelt; Thomas Drewello; Alexey A. Popov; Steven H. Strauss; Olga V. Boltalina","Soluble Chlorofullerenes C~60~Cl~2,4,6,8,10~. Synthesis, Purification, Compositional Analysis, Stability, and Experimental/Theoretical Structure Elucidation, Including the X-ray Structure of C~1~-C~60~Cl~10~","Journal of the American Chemical Society","2010","132","","6443","6462","10.1021/ja1005256","","","0.71073","MoKα","","0.0991","0.0845","","","0.2139","0.2295","","","","","","1.099","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102389","9.997","0.0014","20.717","0.004","39.968","0.006","90","","90","","90","","8278","2","150","2","150","2","","","","","","","","2","C 2 2 21","C 2c 2","20","","","","- C60 Cl10 -","- C60 Cl10 -","- C480 Cl80 -","8","1","","Igor V. Kuvychko; Alexey V. Streletskii; Natalia B. Shustova; Konrad Seppelt; Thomas Drewello; Alexey A. Popov; Steven H. Strauss; Olga V. Boltalina","Soluble Chlorofullerenes C~60~Cl~2,4,6,8,10~. Synthesis, Purification, Compositional Analysis, Stability, and Experimental/Theoretical Structure Elucidation, Including the X-ray Structure of C~1~-C~60~Cl~10~","Journal of the American Chemical Society","2010","132","","6443","6462","10.1021/ja1005256","","","0.7749","synchrotron","","0.1418","0.0888","","","0.2049","0.2251","","","","","","1.072","","","","has coordinates","178769","2020-10-21","18:00:00","" "4102390","5.673","0.0002","9.768","0.0004","22.1257","0.0009","90","","90","","90","","1226.07","0.08","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","","Ming-Kui Zhu; Jun-Feng Zhao; Teck-Peng Loh","Palladium-Catalyzed Oxime Assisted Intramolecular Dioxygenation of Alkenes with 1 atm of Air as the Sole Oxidant","Journal of the American Chemical Society","2010","132","","6284","6285","10.1021/ja100716x","","","0.71073","MoKα","","0.0653","0.0483","","","0.1398","0.1661","","","","","","1.103","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102391","7.4681","0.0017","12.7255","0.0016","17.4475","0.0018","90","","90","","90","","1658.1","0.5","292.1","","292.1","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H18 Br N O4 -","- C16 H18 Br N O4 -","- C64 H72 Br4 N4 O16 -","4","1","","Tomonori Misaki; Gouta Takimoto; Takashi Sugimura","Direct Asymmetric Aldol Reaction of 5H-Oxazol-4-ones with Aldehydes Catalyzed by Chiral Guanidines","Journal of the American Chemical Society","2010","132","","6286","6287","10.1021/ja101216x","","","0.71069","MoKα","","","0.0642","","","","0.062","","","","","","1.16","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102392","7.5387","0.0006","8.0616","0.0008","9.2158","0.0009","64.967","0.004","83.532","0.004","81.588","0.004","501.2","0.08","","","293","","","","","","","","","4","P -1","-P 1","2","","Li 2,6-bis(ethoxycarbonyl)-3,7-dioxo-3,7-dihydro-s-indacene-1,5-bis(olate)","","- C9 H10 Li O6 -","- C9 H10 Li O6 -","- C18 H20 Li2 O12 -","2","1","","Wesley Walker; Sylvie Grugeon; Olivier Mentre; Stéphane Laruelle; Jean-Marie Tarascon; Fred Wudl","Ethoxycarbonyl-Based Organic Electrode for Li-Batteries","Journal of the American Chemical Society","2010","132","","6517","6523","10.1021/ja1012849","","","0.71069","MoKα","","0.0401","0.0319","","","0.0298","0.0338","","","","0.83","0.83","0.83","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102393","9.673","0.0005","12.8755","0.0006","14.3392","0.0007","102.753","0.003","99.036","0.003","91.5","0.003","1716.76","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H46 Cl2 Ni2 P2 -","- C36 H46 Cl2 Ni2 P2 -","- C72 H92 Cl4 Ni4 P4 -","2","1","","Alexandra Velian; Sibo Lin; Alexander J. M. Miller; Michael W. Day; Theodor Agapie","Synthesis and C-C Coupling Reactivity of a Dinuclear NiI-NiI Complex Supported by a Terphenyl Diphosphine","Journal of the American Chemical Society","2010","132","","6296","6297","10.1021/ja101699a","","","0.71073","MoKα","","0.0379","0.027","","","0.0532","0.0539","","","","","","2.237","","","","has coordinates","211332","2020-10-21","18:00:00","" "4102394","8.577","0.0003","14.8684","0.0005","21.6483","0.0007","90","","90","","90","","2760.73","0.16","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H40 Ni P2 -","- C30 H40 Ni P2 -","- C120 H160 Ni4 P8 -","4","1","","Alexandra Velian; Sibo Lin; Alexander J. M. Miller; Michael W. Day; Theodor Agapie","Synthesis and C-C Coupling Reactivity of a Dinuclear NiI-NiI Complex Supported by a Terphenyl Diphosphine","Journal of the American Chemical Society","2010","132","","6296","6297","10.1021/ja101699a","","","0.71073","MoKα","","0.039","0.0302","","","0.0568","0.0584","","","","","","1.311","","","","has coordinates","211332","2020-10-21","18:00:00","" "4102395","11.7255","0.0005","13.1876","0.0005","14.7366","0.0006","105.066","0.002","97.41","0.002","115.216","0.002","1914.32","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H55 Ni2 P2 -","- C45 H55 Ni2 P2 -","- C90 H110 Ni4 P4 -","2","1","","Alexandra Velian; Sibo Lin; Alexander J. M. Miller; Michael W. Day; Theodor Agapie","Synthesis and C-C Coupling Reactivity of a Dinuclear NiI-NiI Complex Supported by a Terphenyl Diphosphine","Journal of the American Chemical Society","2010","132","","6296","6297","10.1021/ja101699a","","","0.71073","MoKα","","0.0569","0.0334","","","0.0565","0.0577","","","","","","1.747","","","","has coordinates","211332","2020-10-21","18:00:00","" "4102396","7.1846","0.0013","25.477","0.004","9.4217","0.0016","90","","100.794","0.011","90","","1694.1","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34.41 H40 Ni2 O4.41 P2 -","- C34.3884 H40 Ni1.9942 O4.3884 P2 -","- C68.7768 H80 Ni3.9884 O8.7768 P4 -","2","0.5","","Alexandra Velian; Sibo Lin; Alexander J. M. Miller; Michael W. Day; Theodor Agapie","Synthesis and C-C Coupling Reactivity of a Dinuclear NiI-NiI Complex Supported by a Terphenyl Diphosphine","Journal of the American Chemical Society","2010","132","","6296","6297","10.1021/ja101699a","","","0.71073","MoKα","","0.1479","0.0651","","","0.0634","0.0709","","","","","","1.248","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00","" "4102397","16.0764","0.0008","20.7006","0.001","8.5956","0.0004","90","","90","","90","","2860.5","0.2","193","2","193","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C31 H42 N O P Pd -","- C31 H42 N O P Pd -","- C124 H168 N4 O4 P4 Pd4 -","4","1","","Patrick S. Hanley; Dean Marković; John F. Hartwig","Intermolecular Insertion of Ethylene and Octene into a Palladium-Amide Bond. Spectroscopic Evidence for an Ethylene Amido Intermediate","Journal of the American Chemical Society","2010","132","","6302","6303","10.1021/ja102172m","","","0.71073","MoKα","","0.0606","0.038","","","0.0683","0.0759","","","","","","1","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102398","13.9745","0.0008","18.6987","0.0011","20.417","0.0012","90","","102.129","0.004","90","","5216","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H68 N2 P2 Pd2 -","- C54 H68 N2 P2 Pd2 -","- C216 H272 N8 P8 Pd8 -","4","1","","Patrick S. Hanley; Dean Marković; John F. Hartwig","Intermolecular Insertion of Ethylene and Octene into a Palladium-Amide Bond. Spectroscopic Evidence for an Ethylene Amido Intermediate","Journal of the American Chemical Society","2010","132","","6302","6303","10.1021/ja102172m","","","0.71073","MoKα","","0.0315","0.0244","","","0.0599","0.0624","","","","","","1.051","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102399","8.1672","0.001","14.7597","0.0017","18.591","0.002","105.912","0.002","94.878","0.002","94.771","0.002","2134.1","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H31 Cl2 N O -","- C21 H31 Cl2 N O -","- C84 H124 Cl8 N4 O4 -","4","2","","Jonathan Clayden; Morgan Donnard; Julien Lefranc; Alberto Minassi; Daniel J. Tetlow","Tandem β-Alkylation-α-Arylation of Amines by Carbolithiation and Rearrangement of N-Carbamoyl Enamines (Vinyl Ureas)","Journal of the American Chemical Society","2010","132","","6624","6625","10.1021/ja1007992","","","0.71073","MoKα","","0.119","0.0678","","","0.1633","0.1866","","","","","","0.941","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00","" "4102400","28.222","0.005","28.222","0.005","9.413","0.003","90","","90","","120","","6493","3","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C24 H16 Co N10 -","- C24 H16 Co N10 -","- C216 H144 Co9 N90 -","9","0.5","","Jian-Bin Lin; Jie-Peng Zhang; Xiao-Ming Chen","Nonclassical Active Site for Enhanced Gas Sorption in Porous Coordination Polymer","Journal of the American Chemical Society","2010","132","","6654","6656","10.1021/ja1009635","","","0.71073","MoKα","","0.0637","0.0416","","","0.102","0.1082","","","","","","1","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102401","27.07","0.009","27.07","0.009","10.126","0.007","90","","90","","120","","6426","5","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C26 H20 Co N10 -","- C26 H20 Co N10 -","- C234 H180 Co9 N90 -","9","0.5","","Jian-Bin Lin; Jie-Peng Zhang; Xiao-Ming Chen","Nonclassical Active Site for Enhanced Gas Sorption in Porous Coordination Polymer","Journal of the American Chemical Society","2010","132","","6654","6656","10.1021/ja1009635","","","0.71073","MoKα","","0.1251","0.0856","","","0.2247","0.2473","","","","","","1.006","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102402","15.9812","0.0019","27.908","0.004","34.355","0.004","70.843","0.005","79.695","0.006","73.704","0.006","13829","3","173","0.1","173","0.2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C524 H534 Cu4 F24 N52 O30 P4 Zn2 -","- C524 H534 Cu4 F24 N52 O30 P4 Zn2 -","- C524 H534 Cu4 F24 N52 O30 P4 Zn2 -","1","0.5","","Jean-Paul Collin; Fabien Durola; Julien Frey; Valérie Heitz; Felipe Reviriego; Jean-Pierre Sauvage; Yann Trolez; Kari Rissanen","Templated Synthesis of Cyclic [4]Rotaxanes Consisting of Two Stiff Rods Threaded through Two Bis-macrocycles with a Large and Rigid Central Plate as Spacer","Journal of the American Chemical Society","2010","132","","6840","6850","10.1021/ja101759w","","x-ray","1.54184","CuKα","","0.2505","0.122","","","0.3031","0.357","","","","","","0.821","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102403","10.581","0.002","23.213","0.004","6.078","0.001","90","","90","","90","","1492.9","0.5","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Cu Mo3 O12 Rb4 -","- Cu Mo2.96 O12.02 Rb4 -","- Cu4 Mo11.84 O48.08 Rb16 -","4","0.5","","Rieko Ishii; Dixie Gautreaux; Keisuke Onuma; Yo Machida; Yoshiteru Maeno; Satoru Nakatsuji; Julia Y. Chan","Low-Dimensional Structure and Magnetism of the Quantum Antiferromagnet Rb4Cu(MoO4)3 and the Structure of Rb4Zn(MoO4)3","Journal of the American Chemical Society","2010","132","","7055","7061","10.1021/ja100077v","","","0.71073","MoKα","","0.0729","0.0508","","","0.1103","0.1188","","","","","","1.052","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102404","12.485","0.002","10.875","0.001","22.266","0.001","90","","90","","90","","3023.2","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Mo3 O12 Rb4 Zn -","- Mo3 O12 Rb4 Zn -","- Mo24 O96 Rb32 Zn8 -","8","1","","Rieko Ishii; Dixie Gautreaux; Keisuke Onuma; Yo Machida; Yoshiteru Maeno; Satoru Nakatsuji; Julia Y. Chan","Low-Dimensional Structure and Magnetism of the Quantum Antiferromagnet Rb4Cu(MoO4)3 and the Structure of Rb4Zn(MoO4)3","Journal of the American Chemical Society","2010","132","","7055","7061","10.1021/ja100077v","","","0.71073","MoKα","","0.0873","0.0456","","","0.0919","0.1062","","","","","","1.032","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102405","3.957","0.002","3.95715","","6.138","0.001","90","","90","","120","","83.24","0.04","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","","","- La2 O3 -","- La2 O3 -","- La4 O6 -","2","0.0833333","","Cao Wang; Ming-qiu Tan; Chun-mu Feng; Zhi-feng Ma; Shuai Jiang; Zhu-an Xu; Guang-han Cao; Kazuyuki Matsubayashi; Yoshiya Uwatoko","La2Co2Se2O3: A Quasi-Two-Dimensional Mott Insulator with Unusual Cobalt Spin State and Possible Orbital Ordering","Journal of the American Chemical Society","2010","132","","7069","7073","10.1021/ja1001295","powder diffraction","","1.54056","CuK\α~1~","","","","","","","","","","1.42","","","","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102406","4.0697","0.0008","4.06965","","18.419","0.004","90","","90","","90","","305.06","0.09","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Co2 La2 O3 Se2 -","- Co2 La2 O3 Se2 -","- Co4 La4 O6 Se4 -","2","0.0625","","Cao Wang; Ming-qiu Tan; Chun-mu Feng; Zhi-feng Ma; Shuai Jiang; Zhu-an Xu; Guang-han Cao; Kazuyuki Matsubayashi; Yoshiya Uwatoko","La2Co2Se2O3: A Quasi-Two-Dimensional Mott Insulator with Unusual Cobalt Spin State and Possible Orbital Ordering","Journal of the American Chemical Society","2010","132","","7069","7073","10.1021/ja1001295","powder diffraction","","1.54056","CuK\α~1~","","","","","","","","","","1.42","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102407","12.653","0.0001","15.2413","0.0002","21.8305","0.0002","95.183","0.001","106.815","0.001","112.223","0.001","3634.6","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C85 H82 As4 Cl2 Pt2 -","- C85 H82 As4 Cl2 Pt2 -","- C170 H164 As8 Cl4 Pt4 -","2","1","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.0398","0.0305","","","0.0705","0.0732","","","","","","1.024","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102408","12.8447","0.0001","14.2111","0.0002","22.2162","0.0002","103.07","0.001","94.282","0.001","109.235","0.001","3680.33","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C85 H82 As4 Cl2 Pt2 -","- C85 H82 As4 Cl2 Pt2 -","- C170 H164 As8 Cl4 Pt4 -","2","1","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.0473","0.03","","","0.0621","0.0657","","","","","","1.045","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102409","12.2508","0.0001","12.2827","0.0001","12.7841","0.0002","87.55","0.001","79.142","0.001","83.834","0.001","1877.79","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C85.4 H82.8 As4 Cl2.8 Pt2 -","- C85.4 H82.8 As4 Cl2.8 Pt2 -","- C85.4 H82.8 As4 Cl2.8 Pt2 -","1","0.5","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.0311","0.0258","","","0.0634","0.0649","","","","","","1.032","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102410","19.7061","0.0002","16.8389","0.0001","25.4236","0.0002","90","","109.641","0.0005","90","","7945.45","0.12","200","","200","","","","","","","","from RMIT university","5","P 1 21/c 1","-P 2ybc","14","","","","- C86 H84 As4 Cl6 Pt2 -","- C86 H84 As4 Cl6 Pt2 -","- C344 H336 As16 Cl24 Pt8 -","4","1","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.0387","0.0239","","0.0682","0.0541","0.0682","","","","","","0.9477","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102411","14.2622","0.0002","21.2716","0.0002","24.0645","0.0002","90","","105.077","0.0006","90","","7049.36","0.13","200","","200","","","","","","","","from RMIT University","5","P 1 21/c 1","-P 2ybc","14","","","","- C84 H80 As4 Br2 Pt2 -","- C84 H80 As4 Br2 Pt2 -","- C336 H320 As16 Br8 Pt8 -","4","1","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.0638","0.0248","","0.078","0.0528","0.078","","","","","","1.0012","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102412","14.2887","0.0005","21.2992","0.0008","24.2678","0.0009","90","","105.115","0.0017","90","","7130.1","0.5","200","","200","","","","","","","","from RMIT University","5","P 1 21/c 1","-P 2ybc","14","","","","- C84 H80 As4 I2 Pt2 -","- C84 H80 As4 I2 Pt2 -","- C336 H320 As16 I8 Pt8 -","4","1","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.0926","0.0507","","0.0959","0.0766","0.0959","","","","","","1.0133","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102413","13.2149","0.0001","13.6749","0.0002","23.5355","0.0003","76.373","0.0005","77.1321","0.0006","63.1672","0.0006","3655.02","0.08","200","","200","","","","","","","","from RMIT University","6","P -1","-P 1","2","","","","- C87 H82 As4 Cl2 N2 Pt2 -","- C87 H82 As4 Cl2 N2 Pt2 -","- C174 H164 As8 Cl4 N4 Pt4 -","2","1","","Martin A. Bennett; Suresh K. Bhargava; Eddie Chung-Chin Cheng; Wai Han Lam; Terence Kwok-Ming Lee; Steven H. Privér; Jörg Wagler; Anthony C. Willis; Wing-Wah Yam, Vivian","Unprecedented Near-Infrared (NIR) Emission in Diplatinum(III) (d7-d7) Complexes at Room Temperature","Journal of the American Chemical Society","2010","132","","7094","7103","10.1021/ja1002313","","","0.71073","MoKα","","0.045","0.0289","","0.0637","0.0605","0.0637","","","","","","0.8585","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102414","7.8543","0.0016","12.234","0.002","14.429","0.003","98.59","0.03","99.5","0.03","95.83","0.03","1340.7","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H48 O4 Si -","- C26 H48 O4 Si -","- C52 H96 O8 Si2 -","2","1","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Philippe Dagneau; Andreas Lanver; Michael P. Jennings; Stellios Arseniyadis; Raffaella Faraoni; Dimitrios E. Lizos","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the Originally Assigned Structure of Vannusal B","Journal of the American Chemical Society","2010","132","","7138","7152","10.1021/ja100740t","","","0.71073","MoKα","","0.0839","0.0684","","","0.163","0.1729","","","","","","1.095","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102415","6.8795","0.0014","14.854","0.003","19.609","0.004","90","","90","","90","","2003.8","0.7","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 Br N O3 -","- C20 H25 Br N O3 -","- C80 H100 Br4 N4 O12 -","4","1","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Philippe Dagneau; Andreas Lanver; Michael P. Jennings; Stellios Arseniyadis; Raffaella Faraoni; Dimitrios E. Lizos","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the Originally Assigned Structure of Vannusal B","Journal of the American Chemical Society","2010","132","","7138","7152","10.1021/ja100740t","","","0.71073","MoKα","","0.0889","0.0529","","","0.1379","0.1576","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102416","38.042","0.008","11.144","0.002","26.725","0.005","90","","130.87","0.03","90","","8568","5","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C40 H51 Br N O6 -","- C40 H52 Br N O6 -","- C320 H416 Br8 N8 O48 -","8","2","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Philippe Dagneau; Andreas Lanver; Michael P. Jennings; Stellios Arseniyadis; Raffaella Faraoni; Dimitrios E. Lizos","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the Originally Assigned Structure of Vannusal B","Journal of the American Chemical Society","2010","132","","7138","7152","10.1021/ja100740t","","","0.71073","MoKα","","0.1214","0.0713","","","0.1832","0.2194","","","","","","0.991","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102417","7.968","0.0016","11.498","0.002","15.381","0.003","103.76","0.03","97.93","0.03","97.76","0.03","1334.8","0.5","158","2","158","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H45 N O3 Si -","- C27 H45 N O3 Si -","- C54 H90 N2 O6 Si2 -","2","1","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Graziano Guella","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the True Structures of Vannusals A and B","Journal of the American Chemical Society","2010","132","","7153","7176","10.1021/ja100742b","","","0.71073","MoKα","","0.1034","0.0709","","","0.174","0.1884","","","","","","0.944","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102418","8.6041","0.0017","18.186","0.004","19.188","0.004","90","","90","","90","","3002.4","1.1","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H52 O4 Si -","- C29 H52 O4 Si -","- C116 H208 O16 Si4 -","4","1","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Graziano Guella","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the True Structures of Vannusals A and B","Journal of the American Chemical Society","2010","132","","7153","7176","10.1021/ja100742b","","","0.71073","MoKα","","0.0992","0.0736","","","0.1566","0.1694","","","","","","1.109","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102419","7.552","0.0015","10.867","0.002","19.923","0.004","101.99","0.03","94.72","0.03","90.48","0.03","1593.4","0.6","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H28 O4 -","- C17 H28 O4 -","- C68 H112 O16 -","4","2","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Graziano Guella","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the True Structures of Vannusals A and B","Journal of the American Chemical Society","2010","132","","7153","7176","10.1021/ja100742b","","","0.71073","MoKα","","0.2491","0.1097","","","0.1706","0.2166","","","","","","0.987","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102420","8.0392","0.0016","12.061","0.002","31.538","0.006","90","","90","","90","","3057.9","1","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H46 O7 -","- C32 H46 O7 -","- C128 H184 O28 -","4","1","","K. C. Nicolaou; Adrian Ortiz; Hongjun Zhang; Graziano Guella","Total Synthesis and Structural Revision of Vannusals A and B: Synthesis of the True Structures of Vannusals A and B","Journal of the American Chemical Society","2010","132","","7153","7176","10.1021/ja100742b","","","0.71073","MoKα","","0.0734","0.0587","","","0.1364","0.1444","","","","","","1.066","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102421","12.8642","0.0019","20.417","0.003","9.1652","0.0013","90","","90.062","0.012","90","","2407.2","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TRN-2-173","","","- C26 H31 N4 O5 -","- C26 H31 N4 O5 -","- C104 H124 N16 O20 -","4","1","","Timothy Newhouse; Chad A. Lewis; Kyle J. Eastman; Phil S. Baran","Scalable Total Syntheses of N-Linked Tryptamine Dimers by Direct Indole-Aniline Coupling: Psychotrimine and Kapakahines B and F","Journal of the American Chemical Society","2010","132","","7119","7137","10.1021/ja1009458","","","1.54178","CuKα","","0.1423","0.0663","","","0.1508","0.1873","","","","","","0.986","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102422","10.5748","0.0009","10.8805","0.001","13.204","0.0012","69.47","0.006","78.957","0.005","65.684","0.005","1294.6","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H25 I2 N4 O3 -","- C25 H25 I2 N4 O3 -","- C50 H50 I4 N8 O6 -","2","1","","Timothy Newhouse; Chad A. Lewis; Kyle J. Eastman; Phil S. Baran","Scalable Total Syntheses of N-Linked Tryptamine Dimers by Direct Indole-Aniline Coupling: Psychotrimine and Kapakahines B and F","Journal of the American Chemical Society","2010","132","","7119","7137","10.1021/ja1009458","","","1.54178","CuKα","","0.0394","0.0332","","","0.0815","0.0843","","","","","","1.046","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102423","10.6409","0.0009","10.9163","0.0009","7.4015","0.0006","90","","110.311","0.001","90","","806.3","0.12","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Fe2 N4 O4 S2 -","- C12 H10 Fe2 N4 O4 S2 -","- C24 H20 Fe4 N8 O8 S4 -","2","0.5","","Zachary J. Tonzetich; Hongxin Wang; Devrani Mitra; Christine E. Tinberg; Loi H. Do; Francis E. Jenney; Michael W. W. Adams; Stephen P. Cramer; Stephen J. Lippard","Identification of Protein-Bound Dinitrosyl Iron Complexes by Nuclear Resonance Vibrational Spectroscopy","Journal of the American Chemical Society","2010","132","","6914","6916","10.1021/ja101002f","","","0.71073","MoKα","","0.015","0.0148","","","0.0398","0.0399","","","","","","1.155","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102424","8.1729","0.0013","10.0823","0.0017","15.84","0.003","90","","94.989","0.003","90","","1300.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Fe2 N5 O4 S2 -","- C20 H30 Fe2 N5 O4 S2 -","- C40 H60 Fe4 N10 O8 S4 -","2","0.5","","Zachary J. Tonzetich; Hongxin Wang; Devrani Mitra; Christine E. Tinberg; Loi H. Do; Francis E. Jenney; Michael W. W. Adams; Stephen P. Cramer; Stephen J. Lippard","Identification of Protein-Bound Dinitrosyl Iron Complexes by Nuclear Resonance Vibrational Spectroscopy","Journal of the American Chemical Society","2010","132","","6914","6916","10.1021/ja101002f","","","0.71073","MoKα","","0.0486","0.0343","","","0.0679","0.0736","","","","","","1.071","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102425","18.4727","0.0013","14.7923","0.001","13.2274","0.0009","90","","105.85","0.001","90","","3477","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 N10 O16.5 S2 -","- C24 H34 N10 O16.5 S2 -","- C96 H136 N40 O66 S8 -","4","1","","Radu Custelcean; Aurelien Bock; Bruce A. Moyer","Selectivity Principles in Anion Separation by Crystallization of Hydrogen-Bonding Capsules","Journal of the American Chemical Society","2010","132","","7177","7185","10.1021/ja101354r","","","0.71073","MoKα","","0.1031","0.0873","","","0.2547","0.2724","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102426","12.4707","0.0008","18.3638","0.0011","13.0812","0.0008","90","","91.486","0.001","90","","2994.7","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 Mg N20 O16 S0.35 Se0.65 -","- C48 H72 Mg N20 O16 S0.347 Se0.653 -","- C96 H144 Mg2 N40 O32 S0.694 Se1.306 -","2","0.5","","Radu Custelcean; Aurelien Bock; Bruce A. Moyer","Selectivity Principles in Anion Separation by Crystallization of Hydrogen-Bonding Capsules","Journal of the American Chemical Society","2010","132","","7177","7185","10.1021/ja101354r","","","0.71073","MoKα","","0.0549","0.0387","","","0.092","0.1004","","","","","","1.028","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102427","12.472","0.0008","18.3585","0.0011","13.058","0.0008","90","","91.49","0.001","90","","2988.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 Mg N20 O16 S0.52 Se0.48 -","- C48 H72 Mg N20 O16 S0.522 Se0.478 -","- C96 H144 Mg2 N40 O32 S1.044 Se0.956 -","2","0.5","","Radu Custelcean; Aurelien Bock; Bruce A. Moyer","Selectivity Principles in Anion Separation by Crystallization of Hydrogen-Bonding Capsules","Journal of the American Chemical Society","2010","132","","7177","7185","10.1021/ja101354r","","","0.71073","MoKα","","0.0612","0.0421","","","0.0947","0.1021","","","","","","1.043","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102428","12.4742","0.0008","18.3503","0.0011","13.0549","0.0008","90","","91.54","0.001","90","","2987.3","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 Mg N20 O16 S0.57 Se0.43 -","- C48 H72 Mg N20 O16 S0.569 Se0.431 -","- C96 H144 Mg2 N40 O32 S1.138 Se0.862 -","2","0.5","","Radu Custelcean; Aurelien Bock; Bruce A. Moyer","Selectivity Principles in Anion Separation by Crystallization of Hydrogen-Bonding Capsules","Journal of the American Chemical Society","2010","132","","7177","7185","10.1021/ja101354r","","","0.71073","MoKα","","0.0652","0.0434","","","0.0944","0.1034","","","","","","1.029","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102429","14.5468","0.0009","15.2501","0.001","17.7653","0.0012","102.369","0.001","90.138","0.001","97.355","0.001","3816.1","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H125 N8 Na O4 Si10 U2 -","- C44 H123 N8 Na O4 Si10 U2 -","- C88 H246 N16 Na2 O8 Si20 U4 -","2","1","","Skye Fortier; Guang Wu; Trevor W. Hayton","Synthesis of a Nitrido-Substituted Analogue of the Uranyl Ion, [N=U=O]+","Journal of the American Chemical Society","2010","132","","6888","6889","10.1021/ja101567h","","","0.71073","MoKα","","0.1521","0.064","","","0.1183","0.1467","","","","","","0.873","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102430","12.188","0.0016","25.359","0.003","18.12","0.002","90","","96.97","0.002","90","","5559.1","1.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H89 N6 Si10 U2 -","- C30 H84 N6 Si10 U2 -","- C120 H336 N24 Si40 U8 -","4","1","","Skye Fortier; Guang Wu; Trevor W. Hayton","Synthesis of a Nitrido-Substituted Analogue of the Uranyl Ion, [N=U=O]+","Journal of the American Chemical Society","2010","132","","6888","6889","10.1021/ja101567h","","","0.71073","MoKα","","0.0675","0.0434","","","0.1127","0.1314","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102431","13.891","0.002","22.52","0.003","22.837","0.003","90","","91.564","0.002","90","","7141.3","1.7","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C42.75 H120.5 N6 Na O5.25 Si10 U2 -","- C41 H107 N6 Na O5.25 Si10 U2 -","- C164 H428 N24 Na4 O21 Si40 U8 -","4","1","","Skye Fortier; Guang Wu; Trevor W. Hayton","Synthesis of a Nitrido-Substituted Analogue of the Uranyl Ion, [N=U=O]+","Journal of the American Chemical Society","2010","132","","6888","6889","10.1021/ja101567h","","","0.71073","MoKα","","0.1272","0.0571","","","0.116","0.1453","","","","","","0.963","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102432","10.578","0.002","14.574","0.003","16.226","0.004","65.745","0.004","77.764","0.004","82.348","0.004","2225.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H53 N4 Rh -","- C56 H53 N4 Rh -","- C112 H106 N8 Rh2 -","2","1","","Yun Wai Chan; Kin Shing Chan","Metalloradical-Catalyzed Aliphatic Carbon-Carbon Activation of Cyclooctane","Journal of the American Chemical Society","2010","132","","6920","6922","10.1021/ja101586w","","","0.71073","MoKα","","0.0522","0.0424","","","0.1119","0.1208","","","","","","1.054","","","","has coordinates,has disorder","156328","2020-10-21","18:00:00","" "4102433","23.601","0.004","25.572","0.005","27.944","0.005","90","","90","","90","","16865","5","90","2","90","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C103 H210 N45.62 O63.86 Pt6 -","- C103 H146 N45.62 O63.86 Pt6 -","- C412 H584 N182.48 O255.44 Pt24 -","4","1","","Tomohisa Sawada; Makoto Fujita","A Single Watson-Crick G.C Base Pair in Water: Aqueous Hydrogen Bonds in Hydrophobic Cavities","Journal of the American Chemical Society","2010","132","","7194","7201","10.1021/ja101718c","","","0.71073","MoKα","","0.0748","0.0496","","","0.1293","0.1459","","","","","","1.075","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102434","15.826","0.002","15.826","0.002","21.639","0.006","90","","90","","90","","5419.8","1.8","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C58 H44 Cd Cl2 N12 O12 -","- C58 H44 Cd Cl2 N12 O12 -","- C232 H176 Cd4 Cl8 N48 O48 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0831","0.0783","","","0.2143","0.2177","","","","","","1.133","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102435","15.8539","0.001","15.8539","0.001","21.66","0.003","90","","90","","90","","5444.2","0.9","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C58 H44 Cd Cl2 N12 O12 -","- C58 H44 Cd Cl2 N12 O12 -","- C232 H176 Cd4 Cl8 N48 O48 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.07","0.0638","","","0.1725","0.1775","","","","","","1.11","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102436","15.8773","0.0012","15.8773","0.0012","21.684","0.003","90","","90","","90","","5466.3","1","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C58 H44 Cd Cl2 N12 O12 -","- C58 H44 Cd Cl2 N12 O12 -","- C232 H176 Cd4 Cl8 N48 O48 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0728","0.0622","","","0.1704","0.1786","","","","","","1.091","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102437","15.937","0.002","15.937","0.002","21.884","0.007","90","","90","","90","","5558","2","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C58 H44 Cd Cl2 N12 O12 -","- C58 H44 Cd Cl2 N12 O12 -","- C232 H176 Cd4 Cl8 N48 O48 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0672","0.0578","","","0.1607","0.1671","","","","","","1.106","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102438","15.8926","0.0019","15.8926","0.0019","21.972","0.005","90","","90","","90","","5549.6","1.6","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C58 H44 Cd Cl2 N12 O12 -","- C58 H44 Cd Cl2 N12 O12 -","- C232 H176 Cd4 Cl8 N48 O48 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0685","0.0554","","","0.1533","0.165","","","","","","1.052","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102439","15.8318","0.0013","15.8318","0.0013","21.957","0.004","90","","90","","90","","5503.4","1.2","123","2","123","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C58 H44 Cd Cl2 N12 O10 S2 -","- C58 H44 Cd Cl2 N12 O10 S2 -","- C232 H176 Cd4 Cl8 N48 O40 S8 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0686","0.0593","","","0.1471","0.1526","","","","","","1.089","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102440","15.844","0.001","15.844","0.001","21.837","0.003","90","","90","","90","","5481.8","0.9","123","2","123","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C58 H44 Cd Cl2 N12 O10 S2 -","- C58 H44 Cd Cl2 N12 O10 S2 -","- C232 H176 Cd4 Cl8 N48 O40 S8 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0723","0.0584","","","0.1425","0.1512","","","","","","1.078","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102441","15.8792","0.0011","15.8792","0.0011","21.594","0.003","90","","90","","90","","5444.9","0.9","123","2","123","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C53 H40 Cd Cl2 N12 O9 S -","- C53 H40 Cd Cl2 N12 O9 S -","- C212 H160 Cd4 Cl8 N48 O36 S4 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0877","0.0693","","","0.1682","0.1774","","","","","","1.11","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102442","15.8271","0.0009","15.8271","0.0009","21.856","0.002","90","","90","","90","","5474.9","0.7","123","2","123","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C58 H44 Cd Cl2 N12 O10 S2 -","- C58 H44 Cd Cl2 N12 O10 S2 -","- C232 H176 Cd4 Cl8 N48 O40 S8 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0578","0.0521","","","0.1344","0.1388","","","","","","1.077","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102443","15.8731","0.001","15.8731","0.001","21.776","0.003","90","","90","","90","","5486.6","0.9","123","2","123","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C53 H40 Cd Cl2 N12 O9 S -","- C53 H40 Cd Cl2 N12 O9 S -","- C212 H160 Cd4 Cl8 N48 O36 S4 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0708","0.0632","","","0.169","0.1749","","","","","","1.097","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102444","15.877","0.0012","15.877","0.0012","21.806","0.003","90","","90","","90","","5496.8","1","123","2","123","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C53 H40 Cd Cl2 N12 O9 S -","- C53 H40 Cd Cl2 N12 O9 S -","- C212 H160 Cd4 Cl8 N48 O36 S4 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0756","0.0706","","","0.1819","0.1856","","","","","","1.165","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102445","15.8721","0.0009","15.8721","0.0009","21.636","0.003","90","","90","","90","","5450.6","0.9","123","2","123","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C53 H40 Cd Cl2 N12 O9 S -","- C53 H40 Cd Cl2 N12 O9 S -","- C212 H160 Cd4 Cl8 N48 O36 S4 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0651","0.0595","","","0.1659","0.1698","","","","","","1.14","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102446","15.8496","0.0016","15.8496","0.0016","21.709","0.004","90","","90","","90","","5453.5","1.3","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0554","0.0501","","","0.1294","0.1328","","","","","","1.082","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102447","15.8633","0.0016","15.8633","0.0016","21.76","0.003","90","","90","","90","","5475.8","1.1","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0542","0.0489","","","0.1329","0.1383","","","","","","1.091","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102448","15.8635","0.0008","15.8635","0.0008","21.463","0.002","90","","90","","90","","5401.2","0.6","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0449","0.0423","","","0.1138","0.116","","","","","","1.065","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102449","15.8832","0.0012","15.8832","0.0012","21.7","0.003","90","","90","","90","","5474.4","1","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0612","0.0531","","","0.1429","0.1482","","","","","","1.067","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102450","15.8725","0.0012","15.8725","0.0012","21.673","0.003","90","","90","","90","","5460.2","1","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0581","0.0528","","","0.1492","0.1533","","","","","","1.078","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102451","15.8878","0.0011","15.8878","0.0011","21.703","0.003","90","","90","","90","","5478.3","0.9","123","2","123","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0627","0.0544","","","0.1463","0.1524","","","","","","1.08","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102452","15.88","0.0013","15.88","0.0013","21.505","0.003","90","","90","","90","","5423","1","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.074","0.0521","","","0.131","0.143","","","","","","1.041","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102453","15.8809","0.0012","15.8809","0.0012","21.81","0.003","90","","90","","90","","5500.5","1","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C55 H45 Cd Cl2 N13 O8 -","- C55 H45 Cd Cl2 N13 O8 -","- C220 H180 Cd4 Cl8 N52 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0678","0.0563","","","0.1521","0.1616","","","","","","1.067","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102454","15.8508","0.0009","15.8508","0.0009","21.766","0.002","90","","90","","90","","5468.7","0.7","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C60 H50 Cd Cl2 N14 O8 -","- C60 H50 Cd Cl2 N14 O8 -","- C240 H200 Cd4 Cl8 N56 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0571","0.0543","","","0.154","0.1559","","","","","","1.107","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102455","15.8548","0.001","15.8548","0.001","21.746","0.003","90","","90","","90","","5466.4","0.9","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C60 H50 Cd Cl2 N14 O8 -","- C60 H50 Cd Cl2 N14 O8 -","- C240 H200 Cd4 Cl8 N56 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0498","0.0482","","","0.1381","0.1398","","","","","","1.086","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102456","15.8029","0.0019","15.8029","0.0019","21.845","0.005","90","","90","","90","","5455.4","1.6","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C60 H50 Cd Cl2 N14 O8 -","- C60 H50 Cd Cl2 N14 O8 -","- C240 H200 Cd4 Cl8 N56 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0539","0.0498","","","0.1353","0.1404","","","","","","1.081","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102457","15.8562","0.0013","15.8562","0.0013","21.765","0.004","90","","90","","90","","5472.1","1.2","123","2","123","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C60 H50 Cd Cl2 N14 O8 -","- C60 H50 Cd Cl2 N14 O8 -","- C240 H200 Cd4 Cl8 N56 O32 -","4","0.5","","Qi-Kui Liu; Jian-Ping Ma; Yu-Bin Dong","Adsorption and Separation of Reactive Aromatic Isomers and Generation and Stabilization of Their Radicals within Cadmium(II)-Triazole Metal-Organic Confined Space in a Single-Crystal-to-Single-Crystal Fashion","Journal of the American Chemical Society","2010","132","","7005","7017","10.1021/ja101807c","","","0.71073","MoKα","","0.0534","0.0505","","","0.1416","0.1444","","","","","","1.08","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102458","17.302","0.006","15.691","0.006","21.597","0.007","90","","110.365","0.014","90","","5497","3","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40.18 H40.18 Mn2 N28 O14 -","- C40.1756 H40.1756 Mn2 N28 O14 -","- C160.702 H160.702 Mn8 N112 O56 -","4","0.5","","Yasushi Morita; Yumi Yakiyama; Shigeaki Nakazawa; Tsuyoshi Murata; Tomoaki Ise; Daisuke Hashizume; Daisuke Shiomi; Kazunobu Sato; Masahiro Kitagawa; Kazuhiro Nakasuji; Takeji Takui","Triple-Stranded Metallo-Helicates Addressable as Lloyd's Electron Spin Qubits","Journal of the American Chemical Society","2010","132","","6944","6946","10.1021/ja102030w","","","0.71073","MoKα","","0.0527","0.0451","","","0.1352","0.1446","","","","","","1.043","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102459","27.4205","0.0013","12.9142","0.0008","17.9911","0.0009","90","","99.7512","0.0012","90","","6278.9","0.6","293.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H22 Cl3 N14 O8 Zn -","- C21 H22 Cl3 N14 O8 Zn -","- C168 H176 Cl24 N112 O64 Zn8 -","8","1","","Yasushi Morita; Yumi Yakiyama; Shigeaki Nakazawa; Tsuyoshi Murata; Tomoaki Ise; Daisuke Hashizume; Daisuke Shiomi; Kazunobu Sato; Masahiro Kitagawa; Kazuhiro Nakasuji; Takeji Takui","Triple-Stranded Metallo-Helicates Addressable as Lloyd's Electron Spin Qubits","Journal of the American Chemical Society","2010","132","","6944","6946","10.1021/ja102030w","","","0.71075","MoKα","","","0.0708","","","","0.1771","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102460","27.4347","0.0007","12.942","0.0003","18.0111","0.0005","90","","99.7962","0.0011","90","","6301.8","0.3","200.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 Cl3 N14 O8 Zn -","- C21 H22 Cl3 N14 O8 Zn -","- C168 H176 Cl24 N112 O64 Zn8 -","8","1","","Yasushi Morita; Yumi Yakiyama; Shigeaki Nakazawa; Tsuyoshi Murata; Tomoaki Ise; Daisuke Hashizume; Daisuke Shiomi; Kazunobu Sato; Masahiro Kitagawa; Kazuhiro Nakasuji; Takeji Takui","Triple-Stranded Metallo-Helicates Addressable as Lloyd's Electron Spin Qubits","Journal of the American Chemical Society","2010","132","","6944","6946","10.1021/ja102030w","","","0.71075","MoKα","","","0.0631","","","","0.1443","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102461","8.9031","0.0009","10.912","0.0011","14.4304","0.0015","103.615","0.001","102.272","0.002","97.529","0.001","1307","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H26 Cu2 N4 O9 S2 -","- C22 H26 Cu2 N4 O9 S2 -","- C44 H52 Cu4 N8 O18 S4 -","2","1","","Honghan Fei; David L. Rogow; Scott R. J. Oliver","Reversible Anion Exchange and Catalytic Properties of Two Cationic Metal-Organic Frameworks Based on Cu(I) and Ag(I)","Journal of the American Chemical Society","2010","132","","7202","7209","10.1021/ja102134c","","","0.7749","synchrotron","","0.05","0.0371","","","0.0957","0.1021","","","","","","1.037","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102462","7.353","0.0006","17.5538","0.0013","24.646","0.0018","90","","92.247","0.005","90","","3178.7","0.4","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H58 B4 Br4 N4 O25 -","- C55 H58 B4 Br4 N4 O25 -","- C110 H116 B8 Br8 N8 O50 -","2","0.5","","Eric M. Woerly; Alan H. Cherney; Erin K. Davis; Martin D. Burke","Stereoretentive Suzuki-Miyaura Coupling of Haloallenes Enables Fully Stereocontrolled Access to (-)-Peridinin","Journal of the American Chemical Society","2010","132","","6941","6943","10.1021/ja102721p","","","0.71073","MoKα","","0.1661","0.0466","","","0.0834","0.117","","","","","","0.97","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102463","8.0323","0.0004","12.7196","0.0006","15.1008","0.0007","90","","90.019","0.003","90","","1542.81","0.13","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H19 I O3 -","- C13 H19 I O3 -","- C52 H76 I4 O12 -","4","2","","Eric M. Woerly; Alan H. Cherney; Erin K. Davis; Martin D. Burke","Stereoretentive Suzuki-Miyaura Coupling of Haloallenes Enables Fully Stereocontrolled Access to (-)-Peridinin","Journal of the American Chemical Society","2010","132","","6941","6943","10.1021/ja102721p","","","0.71073","MoKα","","0.0384","0.0293","","","0.0613","0.0652","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102464","9.35","0.003","9.005","0.003","14.078","0.004","90","","115.103","0.005","90","","1073.4","0.6","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 B Br N O4 -","- C8 H11 B Br N O4 -","- C32 H44 B4 Br4 N4 O16 -","4","1","","Eric M. Woerly; Alan H. Cherney; Erin K. Davis; Martin D. Burke","Stereoretentive Suzuki-Miyaura Coupling of Haloallenes Enables Fully Stereocontrolled Access to (-)-Peridinin","Journal of the American Chemical Society","2010","132","","6941","6943","10.1021/ja102721p","","","0.71073","MoKα","","0.0386","0.0331","","","0.09","0.0936","","","","","","1.053","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102465","12.221","0.0003","7.726","0.0002","14.1518","0.0003","90","","90.599","0.002","90","","1336.13","0.06","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H43 B O4 Si -","- C23 H43 B O4 Si -","- C46 H86 B2 O8 Si2 -","2","1","","Eric M. Woerly; Alan H. Cherney; Erin K. Davis; Martin D. Burke","Stereoretentive Suzuki-Miyaura Coupling of Haloallenes Enables Fully Stereocontrolled Access to (-)-Peridinin","Journal of the American Chemical Society","2010","132","","6941","6943","10.1021/ja102721p","","","0.71073","MoKα","","0.0484","0.037","","","0.0818","0.087","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102466","9.9461","0.0019","12.038","0.002","14.418","0.003","106.355","0.003","103.637","0.003","91.494","0.002","1601.8","0.5","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C48 H97 N2 O41.5 -","- C48 H97 N2 O41.5 -","- C48 H97 N2 O41.5 -","1","1","","Shenshen Hu; Jiuyuan Li; Junfeng Xiang; Jie Pan; Sanzhong Luo; Jin-Pei Cheng","Asymmetric Supramolecular Primary Amine Catalysis in Aqueous Buffer: Connections of Selective Recognition and Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","7216","7228","10.1021/ja102819g","","","0.71073","MoKα","","0.0522","0.0504","","","0.1282","0.13","","","","","","1.091","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102467","17.3691","0.0003","13.0764","0.0002","15.8971","0.0003","90","","111.277","0.002","90","","3364.52","0.11","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H50 N4 Si -","- C36 H50 N4 Si -","- C144 H200 N16 Si4 -","4","1","","Yun Xiong; Shenglai Yao; Robert Müller; Martin Kaupp; Matthias Driess","Activation of Ammonia by a Si=O Double Bond and Formation of a Unique Pair of Sila-Hemiaminal and Silanoic Amide Tautomers","Journal of the American Chemical Society","2010","132","","6912","6913","10.1021/ja1031024","","","0.71073","MoKα","","0.0578","0.0445","","","0.101","0.1068","","","","","","1.077","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102468","9.2101","0.0003","12.0914","0.0004","18.2291","0.0007","95.548","0.003","104.5","0.003","94.189","0.003","1946.19","0.12","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H54 Cl4 N4 O Si -","- C38 H54 Cl4 N4 O Si -","- C76 H108 Cl8 N8 O2 Si2 -","2","1","","Yun Xiong; Shenglai Yao; Robert Müller; Martin Kaupp; Matthias Driess","Activation of Ammonia by a Si=O Double Bond and Formation of a Unique Pair of Sila-Hemiaminal and Silanoic Amide Tautomers","Journal of the American Chemical Society","2010","132","","6912","6913","10.1021/ja1031024","","","0.71073","MoKα","","0.0668","0.0543","","","0.1332","0.1393","","","","","","1.118","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102469","23.9515","0.0009","20.835","0.0007","28.7818","0.0013","90","","109.422","0.005","90","","13545.6","1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C143 H199 N12 O4 Si4 -","- C143 H199 N12 O4 Si4 -","- C572 H796 N48 O16 Si16 -","4","1","","Yun Xiong; Shenglai Yao; Robert Müller; Martin Kaupp; Matthias Driess","Activation of Ammonia by a Si=O Double Bond and Formation of a Unique Pair of Sila-Hemiaminal and Silanoic Amide Tautomers","Journal of the American Chemical Society","2010","132","","6912","6913","10.1021/ja1031024","","","0.71073","MoKα","","0.1354","0.0589","","","0.1004","0.1182","","","","","","0.889","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102470","12.107","0.005","12.881","0.005","18.51","0.005","102.521","0.005","103.388","0.005","103.748","0.005","2612.4","1.6","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H20 Cl4 F20 N6 Ni2 O2 -","- C58 H20 Cl4 F20 N6 Ni2 O2 -","- C116 H40 Cl8 F40 N12 Ni4 O4 -","2","1","","Taro Koide; Ko Furukawa; Hiroshi Shinokubo; Jae-Yoon Shin; Kil Suk Kim; Dongho Kim; Atsuhiro Osuka","A Stable Non-Kekulé Singlet Biradicaloid from meso-Free 5,10,20,25-Tetrakis(Pentafluorophenyl)-Substituted [26]Hexaphyrin(1.1.1.1.1.1)","Journal of the American Chemical Society","2010","132","","7246","7247","10.1021/ja101040s","","","0.71069","MoKα","","0.1102","0.0695","","","0.1763","0.2034","","","","","","1.029","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102471","10.068","0.004","27.269","0.007","11.909","0.004","90","","113.082","0.013","90","","3007.8","1.8","123","2","123","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C62 H32 Cl8 F20 N6 O2 -","- C62 H32 Cl8 F20 N6 O2 -","- C124 H64 Cl16 F40 N12 O4 -","2","0.5","","Taro Koide; Ko Furukawa; Hiroshi Shinokubo; Jae-Yoon Shin; Kil Suk Kim; Dongho Kim; Atsuhiro Osuka","A Stable Non-Kekulé Singlet Biradicaloid from meso-Free 5,10,20,25-Tetrakis(Pentafluorophenyl)-Substituted [26]Hexaphyrin(1.1.1.1.1.1)","Journal of the American Chemical Society","2010","132","","7246","7247","10.1021/ja101040s","","","0.71075","MoKα","","0.1091","0.0778","","","0.2301","0.2555","","","","","","1.071","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102472","9.0488","0.0006","19.7697","0.0013","23.4059","0.0015","90","","94.775","0.002","90","","4172.6","0.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H50 I2 N O3 Si2 U -","- C35 H50 I2 N O3 Si2 U -","- C140 H200 I8 N4 O12 Si8 U4 -","4","1","","Jessie L. Brown; Guang Wu; Trevor W. Hayton","Oxo Ligand Silylation in a Uranyl β-Ketoiminate Complex","Journal of the American Chemical Society","2010","132","","7248","7249","10.1021/ja1013739","","","0.71073","MoKα","","0.0618","0.045","","","0.1064","0.1187","","","","","","1.119","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102473","15.8994","0.001","19.2681","0.0013","22.9828","0.0014","90","","90","","90","","7040.8","0.8","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C68 H86 F6 N2 O12 S2 U -","- C68 H75 F6 N2 O12 S2 U -","- C272 H300 F24 N8 O48 S8 U4 -","4","1","","Jessie L. Brown; Guang Wu; Trevor W. Hayton","Oxo Ligand Silylation in a Uranyl β-Ketoiminate Complex","Journal of the American Chemical Society","2010","132","","7248","7249","10.1021/ja1013739","","","0.71073","MoKα","","0.0942","0.063","","","0.1458","0.1612","","","","","","0.983","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102474","7.781","0.002","9.048","0.003","10.23","0.003","111.583","0.004","101.318","0.004","101.33","0.004","627.5","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H22 B2 N Na O2 -","- C8 H22 B2 N Na O2 -","- C16 H44 B4 N2 Na2 O4 -","2","1","","Scott R. Daly; Brian J. Bellott; Do Young Kim; Gregory S. Girolami","Synthesis of the Long-Sought Unsubstituted Aminodiboranate Na(H3B-NH2-BH3) and Its N-Alkyl Analogs","Journal of the American Chemical Society","2010","132","","7254","7255","10.1021/ja1016427","","","0.71073","MoKα","","0.0905","0.0525","","","0.1489","0.1586","","","","","","0.962","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102475","8.2911","0.0003","9.9884","0.0004","10.8264","0.0004","91.984","0.002","97.495","0.002","114.189","0.002","807.02","0.05","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H14 B2 N Na O -","- C3 H14 B2 N Na O -","- C12 H56 B8 N4 Na4 O4 -","4","2","","Scott R. Daly; Brian J. Bellott; Do Young Kim; Gregory S. Girolami","Synthesis of the Long-Sought Unsubstituted Aminodiboranate Na(H3B-NH2-BH3) and Its N-Alkyl Analogs","Journal of the American Chemical Society","2010","132","","7254","7255","10.1021/ja1016427","","","0.71073","MoKα","","0.043","0.0319","","","0.0781","0.082","","","","","","1.007","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102476","9.9649","0.0004","21.9294","0.0008","11.2331","0.0004","90","","90.552","0.002","90","","2454.59","0.16","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H40 B2 Cl2 Er N O4 -","- C16 H40 B2 Cl2 Er N O4 -","- C64 H160 B8 Cl8 Er4 N4 O16 -","4","1","","Scott R. Daly; Brian J. Bellott; Do Young Kim; Gregory S. Girolami","Synthesis of the Long-Sought Unsubstituted Aminodiboranate Na(H3B-NH2-BH3) and Its N-Alkyl Analogs","Journal of the American Chemical Society","2010","132","","7254","7255","10.1021/ja1016427","","","0.71073","MoKα","","0.0303","0.0229","","","0.0525","0.0554","","","","","","1.073","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102477","7.9953","0.0012","8.958","0.0013","9.566","0.002","106.786","0.004","98.357","0.002","110.88","0.002","588.79","0.18","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H20 B2 N Na O2 -","- C6 H20 B2 N Na O2 -","- C12 H40 B4 N2 Na2 O4 -","2","1","","Scott R. Daly; Brian J. Bellott; Do Young Kim; Gregory S. Girolami","Synthesis of the Long-Sought Unsubstituted Aminodiboranate Na(H3B-NH2-BH3) and Its N-Alkyl Analogs","Journal of the American Chemical Society","2010","132","","7254","7255","10.1021/ja1016427","","","0.71073","MoKα","","0.0933","0.0547","","","0.1555","0.1751","","","","","","1.094","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102478","9.974","0.002","13.917","0.003","15.741","0.003","96.21","0.03","100.13","0.03","110.94","0.03","1973.8","0.9","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C86 H90 N4 Na2 O14 -","- C86 H90 N4 Na2 O14 -","- C86 H90 N4 Na2 O14 -","1","0.5","","Qiang Zhang; Ming Cheng; Xiaoyu Hu; Bo-Gang Li; Jian-Xin Ji","Gold-Catalyzed Three-Component Tandem Process: An Efficient and Facile Assembly of Complex Butenolides from Alkynes, Amines, and Glyoxylic Acid","Journal of the American Chemical Society","2010","132","","7256","7257","10.1021/ja101804p","","","0.71073","MoKα","","0.0735","0.0418","","","0.1155","0.147","","","","","","1.165","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102479","15.1267","0.0009","20.0939","0.0013","7.4239","0.0005","90","","90","","90","","2256.5","0.2","193","2","193","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C12 H34 Cl6 Cu N4 O3 -","- C12 H34 Cl6 Cu N4 O3 -","- C48 H136 Cl24 Cu4 N16 O12 -","4","1","","Wen Zhang; Heng-Yun Ye; Hong-Ling Cai; Jia-Zhen Ge; Ren-Gen Xiong; Songping D. Huang","Discovery of New Ferroelectrics: [H2dbco]2.[Cl3].[CuCl3(H2O)2].H2O (dbco = 1,4-Diaza-bicyclo[2.2.2]octane)","Journal of the American Chemical Society","2010","132","","7300","7302","10.1021/ja102573h","","","0.71073","MoKα","","0.0408","0.0363","","","0.0821","0.0962","","","","","","1.104","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102480","15.0638","0.0008","20.0568","0.0015","7.4158","0.0005","90","","90","","90","","2240.5","0.3","93","2","93","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C12 H34 Cl6 Cu N4 O3 -","- C12 H34 Cl6 Cu N4 O3 -","- C48 H136 Cl24 Cu4 N16 O12 -","4","1","","Wen Zhang; Heng-Yun Ye; Hong-Ling Cai; Jia-Zhen Ge; Ren-Gen Xiong; Songping D. Huang","Discovery of New Ferroelectrics: [H2dbco]2.[Cl3].[CuCl3(H2O)2].H2O (dbco = 1,4-Diaza-bicyclo[2.2.2]octane)","Journal of the American Chemical Society","2010","132","","7300","7302","10.1021/ja102573h","","","0.71073","MoKα","","0.0322","0.0306","","","0.0836","0.0909","","","","","","1.144","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102481","15.209","0.006","7.457","0.003","20.158","0.008","90","","90","","90","","2286.2","1.6","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C12 H34 Cl6 Cu N4 O3 -","- C12 H34 Cl6 Cu N4 O3 -","- C48 H136 Cl24 Cu4 N16 O12 -","4","0.5","","Wen Zhang; Heng-Yun Ye; Hong-Ling Cai; Jia-Zhen Ge; Ren-Gen Xiong; Songping D. Huang","Discovery of New Ferroelectrics: [H2dbco]2.[Cl3].[CuCl3(H2O)2].H2O (dbco = 1,4-Diaza-bicyclo[2.2.2]octane)","Journal of the American Chemical Society","2010","132","","7300","7302","10.1021/ja102573h","","","0.71073","MoKα","","0.0625","0.0554","","","0.1729","0.1839","","","","","","1.331","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102482","9.2753","0.0019","15.671","0.003","17.772","0.004","90","","90","","90","","2583.2","0.9","110","2","110","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 O8 -","- C32 H30 O8 -","- C128 H120 O32 -","4","1","","K. C. Nicolaou; Qiang Kang; T. Robert Wu; Chek Shik Lim; David Y.-K. Chen","Total Synthesis and Biological Evaluation of the Resveratrol-Derived Polyphenol Natural Products Hopeanol and Hopeahainol A","Journal of the American Chemical Society","2010","132","","7540","7548","10.1021/ja102623j","","","0.71073","MoKα","","0.0527","0.049","","","0.1226","0.1273","","","","","","1.092","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102483","10.659","0.002","11.461","0.002","12.651","0.003","110.36","0.03","104.81","0.03","97.4","0.03","1359.8","0.7","110","2","110","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H30 O9 -","- C34 H30 O9 -","- C68 H60 O18 -","2","1","","K. C. Nicolaou; Qiang Kang; T. Robert Wu; Chek Shik Lim; David Y.-K. Chen","Total Synthesis and Biological Evaluation of the Resveratrol-Derived Polyphenol Natural Products Hopeanol and Hopeahainol A","Journal of the American Chemical Society","2010","132","","7540","7548","10.1021/ja102623j","","","0.71073","MoKα","","0.0691","0.0626","","","0.1627","0.1713","","","","","","1.143","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102484","12.148","0.003","11.807","0.002","20.471","0.003","90","","90.269","0.015","90","","2936.2","1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H39 N2 O -","- C34 H39 N2 O -","- C136 H156 N8 O4 -","4","1","","Daniel Mendoza-Espinosa; Bruno Donnadieu; Guy Bertrand","Synthesis of 4- and 4,5-Functionalized Imidazol-2-ylidenes from a Single 4,5-Unsubstituted Imidazol-2-ylidene","Journal of the American Chemical Society","2010","132","","7264","7265","10.1021/ja102639a","","","0.71073","MoKα","","0.085","0.0763","","","0.219","0.2273","","","","","","1.114","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102485","16.5148","0.0017","10.5459","0.0012","20.489","0.002","90","","107.355","0.003","90","","3406","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H45 N2 P -","- C39 H45 N2 P -","- C156 H180 N8 P4 -","4","1","","Daniel Mendoza-Espinosa; Bruno Donnadieu; Guy Bertrand","Synthesis of 4- and 4,5-Functionalized Imidazol-2-ylidenes from a Single 4,5-Unsubstituted Imidazol-2-ylidene","Journal of the American Chemical Society","2010","132","","7264","7265","10.1021/ja102639a","","","0.71073","MoKα","","0.0679","0.0437","","","0.0998","0.1148","","","","","","1.025","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102486","10.2949","0.0004","11.0431","0.0005","12.1455","0.0005","90.047","0.002","109.009","0.002","105.465","0.002","1252.39","0.09","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H12 N2 O2 -","- C15 H12 N2 O2 -","- C60 H48 N8 O8 -","4","2","","Shunsuke Chiba; Line Zhang; Jian-Yuan Lee","Copper-Catalyzed Synthesis of Azaspirocyclohexadienones from α-Azido-N-arylamides under an Oxygen Atmosphere","Journal of the American Chemical Society","2010","132","","7266","7267","10.1021/ja1027327","","","0.71073","MoKα","","0.0558","0.0427","","","0.1185","0.1366","","","","","","1.068","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102487","7.0717","0.0009","10.4575","0.0014","11.1343","0.0015","79.445","0.008","73.634","0.007","76.889","0.007","763.16","0.18","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H14 N2 O2 -","- C19 H14 N2 O2 -","- C38 H28 N4 O4 -","2","1","","Shunsuke Chiba; Line Zhang; Jian-Yuan Lee","Copper-Catalyzed Synthesis of Azaspirocyclohexadienones from α-Azido-N-arylamides under an Oxygen Atmosphere","Journal of the American Chemical Society","2010","132","","7266","7267","10.1021/ja1027327","","","0.71073","MoKα","","0.0593","0.0453","","","0.128","0.143","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102488","14.4572","0.0006","8.1856","0.0003","24.7724","0.0012","90","","90","","90","","2931.6","0.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H16 N2 O2 -","- C17 H16 N2 O2 -","- C136 H128 N16 O16 -","8","1","","Shunsuke Chiba; Line Zhang; Jian-Yuan Lee","Copper-Catalyzed Synthesis of Azaspirocyclohexadienones from α-Azido-N-arylamides under an Oxygen Atmosphere","Journal of the American Chemical Society","2010","132","","7266","7267","10.1021/ja1027327","","","0.71073","MoKα","","0.1099","0.0579","","","0.1458","0.1852","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102489","9.7481","0.0002","17.0985","0.0003","17.9066","0.0003","90","","102.687","0.001","90","","2911.76","0.09","103","2","103","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H18 N2 O -","- C17 H18 N2 O -","- C136 H144 N16 O8 -","8","4","","Shunsuke Chiba; Line Zhang; Jian-Yuan Lee","Copper-Catalyzed Synthesis of Azaspirocyclohexadienones from α-Azido-N-arylamides under an Oxygen Atmosphere","Journal of the American Chemical Society","2010","132","","7266","7267","10.1021/ja1027327","","","0.71073","MoKα","","0.0528","0.0411","","","0.1035","0.1178","","","","","","1.059","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102490","12.9595","0.0001","16.0569","0.0002","13.3906","0.0002","90","","92.764","0.001","90","","2783.2","0.06","103","2","103","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C128 H128 N16 O16 -","8","4","","Shunsuke Chiba; Line Zhang; Jian-Yuan Lee","Copper-Catalyzed Synthesis of Azaspirocyclohexadienones from α-Azido-N-arylamides under an Oxygen Atmosphere","Journal of the American Chemical Society","2010","132","","7266","7267","10.1021/ja1027327","","","0.71073","MoKα","","0.0604","0.0413","","","0.1012","0.1248","","","","","","1.083","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102491","13.8529","0.0007","13.5891","0.0007","30.6143","0.0017","90","","90","","90","","5763.1","0.5","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C25 H38 Cl F6 N5 P Pd -","- C25 H38 Cl F6 N5 P Pd -","- C200 H304 Cl8 F48 N40 P8 Pd8 -","8","1","","Julia R. Khusnutdinova; Nigam P. Rath; Liviu M. Mirica","Stable Mononuclear Organometallic Pd(III) Complexes and Their C-C Bond Formation Reactivity","Journal of the American Chemical Society","2010","132","","7303","7305","10.1021/ja103001g","","","0.71073","MoKα","","0.0368","0.0266","","","0.0586","0.0639","","","","","","1.075","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102492","18.5827","0.0019","12.2413","0.0013","13.9679","0.0014","90","","101.714","0.003","90","","3111.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H40 Cl2 N5 O4 Pd -","- C30 H40 Cl2 N5 O4 Pd -","- C120 H160 Cl8 N20 O16 Pd4 -","4","1","","Julia R. Khusnutdinova; Nigam P. Rath; Liviu M. Mirica","Stable Mononuclear Organometallic Pd(III) Complexes and Their C-C Bond Formation Reactivity","Journal of the American Chemical Society","2010","132","","7303","7305","10.1021/ja103001g","","","0.71073","MoKα","","0.0384","0.0261","","","0.0567","0.0629","","","","","","1.032","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102493","13.8149","0.0012","13.4404","0.0011","29.924","0.003","90","","90","","90","","5556.2","0.9","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H41 Cl N5 O4 Pd -","- C26 H41 Cl N5 O4 Pd -","- C208 H328 Cl8 N40 O32 Pd8 -","8","1","","Julia R. Khusnutdinova; Nigam P. Rath; Liviu M. Mirica","Stable Mononuclear Organometallic Pd(III) Complexes and Their C-C Bond Formation Reactivity","Journal of the American Chemical Society","2010","132","","7303","7305","10.1021/ja103001g","","","0.71073","MoKα","","0.0258","0.023","","","0.0535","0.0548","","","","","","1.081","","","","has coordinates","178770","2020-10-21","18:00:00","" "4102494","18.504","0.005","15.432","0.005","18.133","0.005","90","0.005","98.356","0.005","90","0.005","5123","3","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H24 B3 N12 U -","- C18 H24 B3 N12 U -","- C144 H192 B24 N96 U8 -","8","1","","Jeffrey D. Rinehart; Katie R. Meihaus; Jeffrey R. Long","Observation of a Secondary Slow Relaxation Process for the Field-Induced Single-Molecule Magnet U(H2BPz2)3","Journal of the American Chemical Society","2010","132","","7572","7573","10.1021/ja1009019","","","0.71069","MoKα","","0.0602","0.0313","","","0.0557","0.0639","","","","","","1.038","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102495","8.866","0.002","11.297","0.003","11.831","0.003","90","","90","","90","","1185","0.5","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 N2 -","- C14 H18 N2 -","- C56 H72 N8 -","4","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0353","0.0328","","","0.0856","0.0875","","","","","","0.979","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102496","8.2067","0.0003","7.3911","0.0004","18.6167","0.0007","90","","98.415","0.002","90","","1117.07","0.08","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 N2 -","- C13 H16 N2 -","- C52 H64 N8 -","4","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0671","0.0448","","","0.117","0.1319","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102497","8.4037","0.0003","7.1986","0.0003","17.2511","0.0007","90","","100.69","0.003","90","","1025.49","0.07","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N2 -","- C12 H14 N2 -","- C48 H56 N8 -","4","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0704","0.0541","","","0.1525","0.1636","","","","","","1.089","","","","has coordinates,has disorder","178770","2020-10-21","18:00:00","" "4102498","8.2311","0.0008","7.3758","0.0007","15.2252","0.0015","90","","93.874","0.002","90","","922.22","0.15","103","2","103","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 N2 -","- C11 H12 N2 -","- C44 H48 N8 -","4","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0848","0.0823","","","0.168","0.1693","","","","","","1.291","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102499","8.1086","0.0008","15.061","0.0014","8.6327","0.0008","90","","90","","90","","1054.26","0.17","103","2","103","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C12 H14 N2 -","- C12 H14 N2 -","- C48 H56 N8 -","4","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0721","0.0714","","","0.1769","0.1773","","","","","","1.253","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102500","11.5057","0.0005","8.482","0.0005","19.2656","0.0012","90","","90","","90","","1880.16","0.18","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C11 H12 N2 -","- C11 H12 N2 -","- C88 H96 N16 -","8","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0738","0.043","","","0.1048","0.1225","","","","","","1.051","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102501","5.5395","0.0002","8.7722","0.0005","8.7887","0.0005","90","","90.678","0.003","90","","427.04","0.04","200","2","200","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C10 H10 N2 -","- C10 H10 N2 -","- C20 H20 N4 -","2","1","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0538","0.0436","","","0.1104","0.117","","","","","","1.072","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102502","16.649","0.003","14.441","0.002","20.354","0.003","90","","92.7","0.03","90","","4888.2","1.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H18 N2 -","- C13 H18 N2 -","- C208 H288 N32 -","16","2","","Sergey I. Druzhinin; Peter Mayer; Dietmar Stalke; Rixa von Bülow; Mathias Noltemeyer; Klaas A. Zachariasse","Intramolecular Charge Transfer with 1-tert-Butyl-6-cyano-1,2,3,4-tetrahydroquinoline (NTC6) and Other Aminobenzonitriles. A Comparison of Experimental Vapor Phase Spectra and Crystal Structures with Calculations","Journal of the American Chemical Society","2010","132","","7730","7744","10.1021/ja101336n","","","0.71073","MoKα","","0.0709","0.0491","","0.1328","0.1142","","","","1.051","1.063","1.063","","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102503","16.193","0.002","18.918","0.003","24.58","0.003","90","","90.428","0.002","90","","7529.6","1.8","100","2","100","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C40 H46 O2 S4 -","- C40 H46 O2 S4 -","- C320 H368 O16 S32 -","8","4","","Eric L. Dane; Sarah B. King; Timothy M. Swager","Conjugated Polymers That Respond to Oxidation with Increased Emission","Journal of the American Chemical Society","2010","132","","7758","7768","10.1021/ja1019063","","","0.71073","MoKα","","0.0998","0.0619","","","0.1413","0.1675","","","","","","1.018","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102504","10.2502","0.001","16.2024","0.0016","13.2468","0.0013","90","","106.117","0.002","90","","2113.5","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H54 O5 S4 -","- C44 H54 O5 S4 -","- C88 H108 O10 S8 -","2","0.5","","Eric L. Dane; Sarah B. King; Timothy M. Swager","Conjugated Polymers That Respond to Oxidation with Increased Emission","Journal of the American Chemical Society","2010","132","","7758","7768","10.1021/ja1019063","","","0.71073","MoKα","","0.0475","0.0391","","","0.1033","0.1107","","","","","","1.044","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102505","9.9066","0.0007","12.6542","0.0009","13.0668","0.0009","61.879","0.001","75.556","0.001","76.302","0.001","1385.32","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H36 I2 S4 -","- C24 H36 I2 S4 -","- C48 H72 I4 S8 -","2","1","","Eric L. Dane; Sarah B. King; Timothy M. Swager","Conjugated Polymers That Respond to Oxidation with Increased Emission","Journal of the American Chemical Society","2010","132","","7758","7768","10.1021/ja1019063","","","0.71073","MoKα","","0.0239","0.0211","","","0.0511","0.0526","","","","","","1.038","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102506","10.8588","0.0005","13.3188","0.0006","16.0558","0.0007","90","","97.524","0.001","90","","2302.1","0.18","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","ToMZnCl","tris(4,4-dimethyl-2-oxazolinyl)phenylborato chlorozinc","","- C21 H29 B Cl N3 O3 Zn -","- C21 H29 B Cl N3 O3 Zn -","- C84 H116 B4 Cl4 N12 O12 Zn4 -","4","1","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0291","0.0244","","","0.0672","0.0694","","","","","","1.052","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102507","9.9164","0.0007","15.0927","0.001","24.2345","0.0016","97.893","0.001","98.38","0.001","106.934","0.001","3370.3","0.4","153","2","153","2","","","","","","","","7","P -1","-P 1","2","ToMZnN(SiHMe2)2","tris(4,4-dimethyl-2-oxazolinyl)phenylborato tetramethyldisilazato zinc","","- C28.5 H47 B N4 O3 Si2 Zn -","- C28.5 H47 B N4 O3 Si2 Zn -","- C114 H188 B4 N16 O12 Si8 Zn4 -","4","2","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0671","0.0431","","","0.105","0.1161","","","","","","1.021","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102508","10.6937","0.0005","13.4024","0.0006","15.9975","0.0008","90","","99.784","0.001","90","","2259.43","0.18","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","ToMZnH","tris(4,4-dimethyl-2-oxazolinyl)phenylborato hydridozinc","","- C21 H30 B N3 O3 Zn -","- C21 H30 B N3 O3 Zn -","- C84 H120 B4 N12 O12 Zn4 -","4","1","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0329","0.0264","","","0.0688","0.0722","","","","","","1.024","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102509","8.9377","0.0005","11.6073","0.0007","13.8143","0.0009","96.095","0.001","108.524","0.001","91.233","0.001","1348.88","0.14","153","2","153","2","","","","","","","","6","P -1","-P 1","2","ToMZnOtBu","tris(4,4-dimethyl-2-oxazolinyl)phenylborato t-butoxido zinc","","- C25 H38 B N3 O4 Zn -","- C25 H38 B N3 O4 Zn -","- C50 H76 B2 N6 O8 Zn2 -","2","1","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0452","0.0341","","","0.0785","0.0833","","","","","","1.024","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102510","13.135","0.003","16.024","0.004","22.34","0.006","90","","98.613","0.004","90","","4649","2","153","2","153","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","[THF2Li][ToMZn(Cl)N(SiHMe2)2]","bis(tetrahydrofuran)lithium tris(4,4-dimethyl-2-oxazolinyl)phenylborato chloro tetramethyldisilazato Zinc","","- C37 H67 B Cl Li N4 O6 Si2 Zn -","- C37 H67 B Cl Li N4 O6 Si2 Zn -","- C148 H268 B4 Cl4 Li4 N16 O24 Si8 Zn4 -","4","1","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0897","0.0522","","","0.1178","0.1362","","","","","","1.016","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102511","21.8574","0.0009","14.4461","0.0006","15.6143","0.0006","90","","90","","90","","4930.3","0.3","153","2","153","2","","","","","","","","8","P n a 21","P 2c -2n","33","[NBu4][ToMZn(Cl)N(SiHMe2)2]","[NBu4]chloro tris(4,4-Me-2-oxazolinyl)phenylborato tetramethyldisilazato zinc","","- C41 H79 B Cl N5 O3 Si2 Zn -","- C41 H79 B Cl N5 O3 Si2 Zn -","- C164 H316 B4 Cl4 N20 O12 Si8 Zn4 -","4","1","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0461","0.033","","","0.0705","0.0754","","","","","","1.028","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102512","9.8932","0.0018","10.985","0.002","15.147","0.003","76.651","0.003","75.037","0.003","81.611","0.003","1540.8","0.5","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H43 B N4 O3 Si2 Zn -","- C25 H43 B N4 O3 Si2 Zn -","- C50 H86 B2 N8 O6 Si4 Zn2 -","2","1","","Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow","Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl","Journal of the American Chemical Society","2010","132","","7582","7583","10.1021/ja102323g","","","0.71073","MoKα","","0.0928","0.0638","","","0.1439","0.1565","","","","","","1.065","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102513","37.6605","0.0008","12.54627","0.00017","25.9227","0.0005","90","","120.282","0.003","90","","10577.2","0.5","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[(μ-but-2-yn-1,4-diylidyne)bis(di{1,2-bis(diphenylphosphino)ethane} ({4-trimethylsilyl}buta-1,3-diynyl)tungsten)]","","- C122 H114 P8 Si2 W2 -","- C122 H114 P8 Si2 W2 -","- C488 H456 P32 Si8 W8 -","4","0.5","","Sergey N. Semenov; Shiva F. Taghipourian; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","An Iron-Capped Metal-Organic Polyyne: {[Fe](C\τbC)2[W]\τbCC\τbCC\τb[W](C\τbC)2[Fe]}","Journal of the American Chemical Society","2010","132","","7584","7585","10.1021/ja102570f","","","0.71073","MoKα","","0.0394","0.0262","","","0.0518","0.0531","","","","","","0.914","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102514","36.6258","0.0011","13.1143","0.0004","20.2917","0.0005","90","","103.53","0.003","90","","9476.1","0.5","183","2","183","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","[(μ-but-2-yn-1,4-diylidyne)bis(di{1,2-bis(diphenylphosphino)ethane} (buta-1,3-diynyl)tungsten)]","","- C116 H98 P8 W2 -","- C116 H98 P8 W2 -","- C464 H392 P32 W8 -","4","0.5","","Sergey N. Semenov; Shiva F. Taghipourian; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","An Iron-Capped Metal-Organic Polyyne: {[Fe](C\τbC)2[W]\τbCC\τbCC\τb[W](C\τbC)2[Fe]}","Journal of the American Chemical Society","2010","132","","7584","7585","10.1021/ja102570f","","","0.71073","MoKα","","0.0896","0.0376","","","0.0446","0.0494","","","","","","0.752","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102515","46.1875","0.0007","19.2094","0.0003","17.58","0.0003","90","","93.679","0.001","90","","15565.4","0.4","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[bis(μ-buta-1,3-diynyl)(μ-but-2-yn-1,4-diylidyne)bis (di{1,2-bis(diphenylphosphino)ethane}tungsten)bis (di{1,2-bis(diethylphosphino)ethane}chloroiron)]","","- C158 H196 Cl6 Fe2 P16 W2 -","- C158.01 H196.02 Cl6.02 Fe2 P16 W2 -","- C632.04 H784.08 Cl24.08 Fe8 P64 W8 -","4","0.5","","Sergey N. Semenov; Shiva F. Taghipourian; Olivier Blacque; Thomas Fox; Koushik Venkatesan; Heinz Berke","An Iron-Capped Metal-Organic Polyyne: {[Fe](C\τbC)2[W]\τbCC\τbCC\τb[W](C\τbC)2[Fe]}","Journal of the American Chemical Society","2010","132","","7584","7585","10.1021/ja102570f","","","0.71073","MoKα","","0.0598","0.0379","","","0.0951","0.0997","","","","","","0.968","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102516","5.5909","0.0005","17.6944","0.0017","19.0577","0.0018","90","","90","","90","","1885.3","0.3","173","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H18.5 N O3 Pt S -","- C21 H18.5 N O3 Pt S -","- C84 H74 N4 O12 Pt4 S4 -","4","1","","Peter D. Frischmann; Samuel Guieu; Raymond Tabeshi; Mark J. MacLachlan","Columnar Organization of Head-to-Tail Self-Assembled Pt4 Rings","Journal of the American Chemical Society","2010","132","","7668","7675","10.1021/ja910886g","","","0.71073","MoKα","","0.0564","0.0441","","","0.1059","0.1146","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102517","12.5982","0.0008","16.8143","0.0013","18.3347","0.0016","89.132","0.004","84.653","0.004","77.708","0.004","3778.2","0.5","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C28 H33 B Mo N8 O S2 -","- C28 H33 B Mo N8 O S2 -","- C112 H132 B4 Mo4 N32 O4 S8 -","4","2","","Kelly G. Matz; Regina P. Mtei; Belinda Leung; Sharon J. Nieter Burgmayer; Martin L. Kirk","Noninnocent Dithiolene Ligands: A New Oxomolybdenum Complex Possessing a Donor-Acceptor Dithiolene Ligand","Journal of the American Chemical Society","2010","132","","7830","7831","10.1021/ja100220x","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102518","28.618","0.011","8.227","0.003","14.935","0.006","90","","113.601","0.008","90","","3222","2","90","","90","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H22 N2 -","- C20 H22 N2 -","- C160 H176 N16 -","8","1","","Atsuya Muranaka; Mitsuhiro Yonehara; Masanobu Uchiyama","Azulenocyanine: A New Family of Phthalocyanines with Intense Near-IR Absorption","Journal of the American Chemical Society","2010","132","","7844","7845","10.1021/ja101818g","","","0.71073","MoKα","","0.0719","0.0531","","","0.1336","0.1451","","","","","","1.089","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102519","10.0634","0.0002","16.7202","0.0003","15.7994","0.0003","90","","91.718","0.001","90","","2657.24","0.09","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H36 Cl2 Cu N5 O8 -","- C17 H36 Cl2 Cu N5 O8 -","- C68 H144 Cl8 Cu4 N20 O32 -","4","1","","Moushumi Sarma; Apurba Kalita; Pankaj Kumar; Amardeep Singh; Biplab Mondal","Reduction of Copper(II) Complexes of Tripodal Ligands by Nitric Oxide and Trinitrosation of the Ligands","Journal of the American Chemical Society","2010","132","","7846","7847","10.1021/ja102279c","","","0.71073","MoKα","","0.0725","0.0532","","","0.1755","0.187","","","","","","1.089","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102520","11.6744","0.0003","18.4324","0.0004","10.8887","0.0002","90","","90","","90","","2343.11","0.09","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H34 Cl N7 O7 -","- C15 H34 Cl N7 O7 -","- C60 H136 Cl4 N28 O28 -","4","1","","Moushumi Sarma; Apurba Kalita; Pankaj Kumar; Amardeep Singh; Biplab Mondal","Reduction of Copper(II) Complexes of Tripodal Ligands by Nitric Oxide and Trinitrosation of the Ligands","Journal of the American Chemical Society","2010","132","","7846","7847","10.1021/ja102279c","","","0.71073","MoKα","","0.0692","0.0537","","","0.1545","0.1687","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102521","7.30154","0.00013","8.94536","0.00016","12.5868","0.0002","75.579","0.001","88.793","0.001","84.44","0.001","792.45","0.02","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","4-Acetoxy-5,5-dimethylcyclopenta-1,3-diene-1,2,3-tricarboxylic acid trimethyl ester","","- C15 H18 O8 -","- C15 H18 O8 -","- C30 H36 O16 -","2","1","","Yu Shibata; Keiichi Noguchi; Ken Tanaka","Cationic Rhodium(I) Complex-Catalyzed [3 + 2] and [2 + 1] Cycloadditions of Propargyl Esters with Electron-Deficient Alkynes and Alkenes","Journal of the American Chemical Society","2010","132","","7896","7898","10.1021/ja102418h","","","1.54187","CuKα","","0.0369","0.0335","","","0.0913","0.0945","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102522","15.6993","0.0004","6.8584","0.0002","28.0209","0.0008","90","","90","","90","","3017.07","0.15","193","2","193","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-(1-Acetoxy-2-methylpropenyl)-2-dimethylcarbamoylcyclopropanecarboxylic acid methyl ester","","- C14 H21 N O5 -","- C14 H21 N O5 -","- C112 H168 N8 O40 -","8","2","","Yu Shibata; Keiichi Noguchi; Ken Tanaka","Cationic Rhodium(I) Complex-Catalyzed [3 + 2] and [2 + 1] Cycloadditions of Propargyl Esters with Electron-Deficient Alkynes and Alkenes","Journal of the American Chemical Society","2010","132","","7896","7898","10.1021/ja102418h","","","1.54187","CuKα","","0.1776","0.1264","","","0.278","0.32","","","","","","1.006","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102523","13.331","0.004","13.03","0.004","22.476","0.007","90","","105.846","0.003","90","","3756","2","173","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C24 H19 N O -","- C24 H19 N O -","- C192 H152 N8 O8 -","8","2","","Itaru Nakamura; Dong Zhang; Masahiro Terada","Copper-Catalyzed Tandem [2,3]-Rearrangement and 6π-3-Azatriene Electrocyclization in (E)-O-Propargylic α,β-Unsaturated Oximes","Journal of the American Chemical Society","2010","132","","7884","7886","10.1021/ja102436z","","","0.7107","MoKα","","","0.0393","","","","0.0857","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102524","6.4942","0.0002","7.334","0.0002","15.1138","0.0004","90","","94.397","0.003","90","","717.73","0.04","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C16 H22 O4 -","- C16 H22 O4 -","- C32 H44 O8 -","2","1","","Sara Graus; Rosa M. Tejedor; Santiago Uriel; José Luis Serrano; Ibon Alkorta; José Elguero","Crystallization of an Achiral Cyclohexanone Ethylene Ketal in Enantiomorphs and Determination of the Absolute Structure","Journal of the American Chemical Society","2010","132","","7862","7863","10.1021/ja1025062","","","0.71073","MoKα","","0.065","0.0359","","","0.0631","0.0683","","","","","","0.86","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102525","9.586","0.0006","16.484","0.0007","21.679","0.001","90","","95.596","0.004","90","","3409.3","0.3","110","","110","","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H62 N2 P2 Ru -","- C34 H62 N2 P2 Ru -","- C136 H248 N8 P8 Ru4 -","4","1","","Rebeca Reguillo; Mary Grellier; Nicolas Vautravers; Laure Vendier; Sylviane Sabo-Etienne","Ruthenium-Catalyzed Hydrogenation of Nitriles: Insights into the Mechanism","Journal of the American Chemical Society","2010","132","","7854","7855","10.1021/ja102759z","","","0.71073","MoKα","","0.0385","0.0357","","","0.0734","0.0748","","","","","","1.096","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102526","9.7949","0.0005","20.8165","0.0011","19.1507","0.001","90","","91.271","0.002","90","","3903.8","0.4","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H66 N2 P2 Ru -","- C44 H66 N2 P2 Ru -","- C176 H264 N8 P8 Ru4 -","4","1","","Rebeca Reguillo; Mary Grellier; Nicolas Vautravers; Laure Vendier; Sylviane Sabo-Etienne","Ruthenium-Catalyzed Hydrogenation of Nitriles: Insights into the Mechanism","Journal of the American Chemical Society","2010","132","","7854","7855","10.1021/ja102759z","","","0.71073","MoKα","","0.0797","0.0608","","","0.1328","0.1392","","","","","","1.155","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102527","13.835","0.0007","16.048","0.0008","15.987","0.0009","90","","107.519","0.003","90","","3384.9","0.3","110","2","110","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C37 H60 N P2 Ru -","- C37 H60 N P2 Ru -","- C148 H240 N4 P8 Ru4 -","4","2","","Rebeca Reguillo; Mary Grellier; Nicolas Vautravers; Laure Vendier; Sylviane Sabo-Etienne","Ruthenium-Catalyzed Hydrogenation of Nitriles: Insights into the Mechanism","Journal of the American Chemical Society","2010","132","","7854","7855","10.1021/ja102759z","","","0.71073","MoKα","","0.054","0.0429","","","0.094","0.1","","","","","","1.055","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102528","25.163","0.0019","48.087","0.003","34.425","0.002","90","","106.451","0.004","90","","39949","5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C177 H159 Cl15 N34 O44 -","- C177 H159 Cl15 N34 O44.5 -","- C1416 H1272 Cl120 N272 O356 -","8","2","","Yann Ferrand; Amol M. Kendhale; Brice Kauffmann; Axelle Grélard; Cécile Marie; Virginie Blot; Muriel Pipelier; Didier Dubreuil; Ivan Huc","Diastereoselective Encapsulation of Tartaric Acid by a Helical Aromatic Oligoamide","Journal of the American Chemical Society","2010","132","","7858","7859","10.1021/ja102794a","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102529","16.0418","0.0015","5.51815","0.00062","7.86214","0.00077","90","","93.9617","0.0095","90","","694.3","0.12","298","2","298","2","","","","","","","synthesis","3","P 1 21/c 1","-P 2ybc","14","","4,4'-bis(1H-pyrazol-4-yl)biphenyl","","- C18 H14 N4 -","- C18 H14 N4 -","- C36 H28 N8 -","2","0.5","","Norberto Masciocchi; Simona Galli; Valentina Colombo; Angelo Maspero; Giovanni Palmisano; Behnam Seyyedi; Carlo Lamberti; Silvia Bordiga","Cubic Octanuclear Ni(II) Clusters in Highly Porous Polypyrazolyl-Based Materials","Journal of the American Chemical Society","2010","132","","7902","7904","10.1021/ja102862j","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102530","5.25025","0.0004","5.36079","0.00033","24.3757","0.0016","90","","90.4795","0.0035","90","","686.04","0.08","298","2","298","2","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","2,6-bis(1H-pyrazol-4-yl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H, 6H)-tetrone","","- C16 H8 N6 O4 -","- C16 H8 N6 O4 -","- C32 H16 N12 O8 -","2","0.5","","Norberto Masciocchi; Simona Galli; Valentina Colombo; Angelo Maspero; Giovanni Palmisano; Behnam Seyyedi; Carlo Lamberti; Silvia Bordiga","Cubic Octanuclear Ni(II) Clusters in Highly Porous Polypyrazolyl-Based Materials","Journal of the American Chemical Society","2010","132","","7902","7904","10.1021/ja102862j","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102531","31.3584","0.003","31.3584","0.003","31.3584","0.003","90","","90","","90","","30836","5","298","2","298","2","","","","","","","synthesis","5","F m -3 m","-F 4 2 3","225","","","","- C108 H80 N24 Ni8 O6 -","- C108 H78 N24 Ni8 O6 -","- C432 H312 N96 Ni32 O24 -","4","0.0208333","","Norberto Masciocchi; Simona Galli; Valentina Colombo; Angelo Maspero; Giovanni Palmisano; Behnam Seyyedi; Carlo Lamberti; Silvia Bordiga","Cubic Octanuclear Ni(II) Clusters in Highly Porous Polypyrazolyl-Based Materials","Journal of the American Chemical Society","2010","132","","7902","7904","10.1021/ja102862j","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102532","30.5846","0.0022","30.5846","0.0022","30.5846","0.0022","90","","90","","90","","28609","4","298","2","298","2","","","","","","","synthesis","5","F m -3 m","-F 4 2 3","225","","","","- C96 H56 N36 Ni8 O36 -","- C96 H54 N36 Ni8 O36 -","- C384 H216 N144 Ni32 O144 -","4","0.0208333","","Norberto Masciocchi; Simona Galli; Valentina Colombo; Angelo Maspero; Giovanni Palmisano; Behnam Seyyedi; Carlo Lamberti; Silvia Bordiga","Cubic Octanuclear Ni(II) Clusters in Highly Porous Polypyrazolyl-Based Materials","Journal of the American Chemical Society","2010","132","","7902","7904","10.1021/ja102862j","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102533","6.31493","0.00075","3.6201","0.0012","18.4226","0.0027","94.855","0.028","109.926","0.0093","89.246","0.032","394.46","0.15","298","2","298","2","","","","","","","synthesis","6","P -1","-P 1","2","","","","- C16 H8 Cl2 N6 Ni O4 -","- C16 H8 Cl2 N6 Ni O4 -","- C16 H8 Cl2 N6 Ni O4 -","1","0.5","","Norberto Masciocchi; Simona Galli; Valentina Colombo; Angelo Maspero; Giovanni Palmisano; Behnam Seyyedi; Carlo Lamberti; Silvia Bordiga","Cubic Octanuclear Ni(II) Clusters in Highly Porous Polypyrazolyl-Based Materials","Journal of the American Chemical Society","2010","132","","7902","7904","10.1021/ja102862j","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102534","9.6908","0.0019","9.49","0.0019","16.734","0.003","90","","91.27","0.03","90","","1538.6","0.5","110","2","110","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H28 O3 -","- C17 H28 O3 -","- C68 H112 O12 -","4","1","","K. C. Nicolaou; Qiang Kang; Sin Yee Ng; David Y.-K. Chen","Total Synthesis of Englerin A","Journal of the American Chemical Society","2010","132","","8219","8222","10.1021/ja102927n","","","0.71073","MoKα","","0.0778","0.0662","","","0.1571","0.1692","","","","","","1.147","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102535","16.9004","0.0018","20.028","0.002","30.412","0.003","108.507","0.001","91.274","0.001","90.732","0.001","9757","1.7","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C136 H166 N39 O76 Pd6 -","- C136 H166 N38.915 O76.166 Pd6 -","- C272 H332 N77.83 O152.332 Pd12 -","2","1","","Takashi Murase; Kosuke Otsuka; Makoto Fujita","Pairwise Selective Formation of Aromatic Stacks in a Coordination Cage","Journal of the American Chemical Society","2010","132","","7864","7865","10.1021/ja103109z","","","0.71073","MoKα","","0.1035","0.077","","","0.2199","0.252","","","","","","1.03","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102536","16.5029","0.0004","20.8999","0.0005","30.0805","0.0007","90","","90","","90","","10375","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44.61 H68.61 Cl1.83 N4 O7 -","- C44.61 H68.61 Cl1.83 N4 O7 -","- C356.88 H548.88 Cl14.64 N32 O56 -","8","2","","Li Guo; Aaron M. Almeida; Weicheng Zhang; Andrew G. Reidenbach; Soo Hyuk Choi; Ilia A. Guzei; Samuel H. Gellman","Helix Formation in Preorganized β/γ-Peptide Foldamers: Hydrogen-Bond Analogy to the α-Helix without α-Amino Acid Residues","Journal of the American Chemical Society","2010","132","","7868","7869","10.1021/ja103233a","","","1.54178","Cu-Kα","","0.063","0.0511","","","0.1353","0.1436","","","","","","0.978","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102537","10.9331","0.0002","18.5573","0.0003","24.7143","0.0004","90","","90","","90","","5014.26","0.15","100","1","100","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C50 H76 Br N5 O8 -","- C50 H76 Br N5 O8 -","- C200 H304 Br4 N20 O32 -","4","1","","Li Guo; Aaron M. Almeida; Weicheng Zhang; Andrew G. Reidenbach; Soo Hyuk Choi; Ilia A. Guzei; Samuel H. Gellman","Helix Formation in Preorganized β/γ-Peptide Foldamers: Hydrogen-Bond Analogy to the α-Helix without α-Amino Acid Residues","Journal of the American Chemical Society","2010","132","","7868","7869","10.1021/ja103233a","","","1.54178","CuKα","","0.0915","0.0576","","","0.1434","0.1695","","","","","","0.951","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102538","17.741","0.002","26.137","0.003","13.6513","0.0017","90","","89.915","0.003","90","","6330.1","1.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C76 H84 Ga2 N4 -","- C76 H84 Ga2 N4 -","- C304 H336 Ga8 N16 -","4","1","","Igor L. Fedushkin; Alexander S. Nikipelov; Konstantin A. Lyssenko","Reversible Addition of Alkynes to Gallium Complex of Chelating Diamide Ligand","Journal of the American Chemical Society","2010","132","","7874","7875","10.1021/ja103467a","","","0.71073","MoKα","","0.0898","0.0465","","","0.0908","0.1059","","","","","","1.006","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102539","17.3786","0.0019","26.579","0.003","17.903","0.002","90","","108.121","0.002","90","","7859.3","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C92.3 H102.75 Ga2 N4 O2.15 -","- C92.3 H102.75 Ga2 N4 O2.15 -","- C369.2 H411 Ga8 N16 O8.6 -","4","1","","Igor L. Fedushkin; Alexander S. Nikipelov; Konstantin A. Lyssenko","Reversible Addition of Alkynes to Gallium Complex of Chelating Diamide Ligand","Journal of the American Chemical Society","2010","132","","7874","7875","10.1021/ja103467a","","","0.71073","MoKα","","0.0593","0.0388","","","0.089","0.0987","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102540","29.176","0.004","12.985","0.002","39.497","0.006","90","","100.678","0.003","90","","14704","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H98 Ga2 N4 O4 -","- C88 H98 Ga2 N4 O4 -","- C704 H784 Ga16 N32 O32 -","8","1","","Igor L. Fedushkin; Alexander S. Nikipelov; Konstantin A. Lyssenko","Reversible Addition of Alkynes to Gallium Complex of Chelating Diamide Ligand","Journal of the American Chemical Society","2010","132","","7874","7875","10.1021/ja103467a","","","0.71073","MoKα","","0.1475","0.0616","","","0.1061","0.1355","","","","","","0.956","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102541","15.546","0.006","15.791","0.006","21.274","0.008","70.086","0.007","76.781","0.008","61.731","0.006","4310","3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C102 H114 Ga2 N4 O4 -","- C102 H114 Ga2 N4 O4 -","- C204 H228 Ga4 N8 O8 -","2","1","","Igor L. Fedushkin; Alexander S. Nikipelov; Konstantin A. Lyssenko","Reversible Addition of Alkynes to Gallium Complex of Chelating Diamide Ligand","Journal of the American Chemical Society","2010","132","","7874","7875","10.1021/ja103467a","","","0.71073","MoKα","","0.2192","0.0883","","","0.1518","0.2026","","","","","","0.993","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102542","7.473","0.003","12.669","0.005","14.171","0.005","90","","100.228","0.016","90","","1320.3","0.9","123.1","","123.1","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H20 Cl2 F8 Ir2 -","- C28 H20 Cl2 F8 Ir2 -","- C56 H40 Cl4 F16 Ir4 -","2","1","","Takahiro Nishimura; Yuichi Yasuhara; Takahiro Sawano; Tamio Hayashi","Iridium/Chiral Diene-Catalyzed Asymmetric 1,6-Addition of Arylboroxines to α,β,γ,δ-Unsaturated Carbonyl Compounds","Journal of the American Chemical Society","2010","132","","7872","7873","10.1021/ja1034842","","","0.71075","MoKα","","","0.0236","","","","0.0507","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102543","14.37","0.0008","16.818","0.001","18.917","0.0011","90","","90","","90","","4571.8","0.5","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","JK_011","","","- C21 H36 Cl2 Ir N2 P -","- C21 H36 Cl2 Ir N2 P -","- C168 H288 Cl16 Ir8 N16 P8 -","8","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71073","MoKα","","0.0216","0.0194","","","0.0466","0.0478","","","","","","1.038","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102544","14.682","0.0012","9.297","0.0007","31.39","0.003","90","","94.991","0.001","90","","4268.4","0.6","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","JK_009","","","- C19 H32 Cl2 Ir N2 P -","- C19 H32 Cl2 Ir N2 P -","- C152 H256 Cl16 Ir8 N16 P8 -","8","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71069","MoKα","","0.0229","0.0206","","","0.0474","0.0483","","","","","","1.05","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102545","8.508","0.0009","16.9056","0.0017","19.041","0.002","90","","96.289","0.002","90","","2722.2","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H30 Cl4 Ir N2 P -","- C26 H30 Cl4 Ir N2 P -","- C104 H120 Cl16 Ir4 N8 P4 -","4","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71073","MoKα","","0.0257","0.0221","","","0.0515","0.054","","","","","","1.011","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102546","19.69","0.003","8.3304","0.0012","17.34","0.003","90","","99.315","0.002","90","","2806.7","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H44 Cl2 Ir N2 P -","- C25 H44 Cl2 Ir N2 P -","- C100 H176 Cl8 Ir4 N8 P4 -","4","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71073","MoKα","","0.0681","0.0377","","","0.0694","0.0756","","","","","","1.05","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102547","8.0066","0.0013","26.544","0.005","10.5213","0.0018","90","","110.995","0.002","90","","2087.6","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H33 Cl Ir N2 P -","- C19 H33 Cl Ir N2 P -","- C76 H132 Cl4 Ir4 N8 P4 -","4","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71073","MoKα","","0.0333","0.0312","","","0.0883","0.0904","","","","","","1.132","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102548","8.784","0.0007","16.0209","0.0013","9.8555","0.0008","90","","103.218","0.001","90","","1350.2","0.19","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C25 H45 Cl Ir N2 P -","- C25 H45 Cl1.01 Ir N2 P -","- C50 H90 Cl2.02 Ir2 N4 P2 -","2","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71073","MoKα","","0.0259","0.0241","","","0.0479","0.0484","","","","","","1.072","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102549","15.407","0.0016","12.52","0.0013","23.931","0.002","90","","104.693","0.002","90","","4465.2","0.8","208","2","208","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","JK_00K","","","- C43 H32 B Cl F20 Ir N2 P -","- C43 H32 B Cl F20 Ir N2 P -","- C172 H128 B4 Cl4 F80 Ir4 N8 P4 -","4","1","","Douglas B. Grotjahn; John E. Kraus; Hani Amouri; Marie-Noelle Rager; Andrew L. Cooksy; Amy J. Arita; Sara A. Cortes-Llamas; Arthur A. Mallari; Antonio G. DiPasquale; Curtis E. Moore; Louise M. Liable-Sands; James D. Golen; Lev N. Zakharov; Arnold L. Rheingold","Multimodal Study of Secondary Interactions in Cp*Ir Complexes of Imidazolylphosphines Bearing an NH Group","Journal of the American Chemical Society","2010","132","","7919","7934","10.1021/ja906712g","","","0.71073","MoKα","","0.0389","0.0309","","","0.0761","0.0794","","","","","","1.056","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102550","7.8947","0.0002","29.6787","0.0007","8.5746","0.0002","90","","105.441","0.001","90","","1936.55","0.08","210","2","210","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H34 Cl O P Pd -","- C16 H34 Cl O P Pd -","- C64 H136 Cl4 O4 P4 Pd4 -","4","1","","Delphine Gauthier; Anders T. Lindhardt; Esben P. K. Olsen; Jacob Overgaard; Troels Skrydstrup","In Situ Generated Bulky Palladium Hydride Complexes as Catalysts for the Efficient Isomerization of Olefins. Selective Transformation of Terminal Alkenes to 2-Alkenes","Journal of the American Chemical Society","2010","132","","7998","8009","10.1021/ja9108424","","x-ray","0.71073","MoKα","","0.0455","0.0308","","","0.0704","0.076","","","","","","1.026","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102551","17.7592","0.0003","19.4726","0.0002","18.2732","0.0002","90","","90","","90","","6319.2","0.14","160","1","160","1","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C21 H21 B11 Cl6 F4 Si -","- C21 H21 B11 Cl6 F4 Si -","- C168 H168 B88 Cl48 F32 Si8 -","8","1","","Paola Romanato; Simon Duttwyler; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Intramolecular Halogen Stabilization of Silylium Ions Directs Gearing Dynamics","Journal of the American Chemical Society","2010","132","","7828","7829","10.1021/ja9109665","","","0.71073","MoKα","","0.0545","0.0357","","","0.0812","0.0913","","","","","","1.038","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102552","15.9428","0.0004","17.3376","0.0003","19.1253","0.0003","76.719","0.0013","76.937","0.0011","79.5644","0.0012","4965.13","0.17","160","1","160","1","","","","","","","","6","P -1","-P 1","2","","","","- C102 H62.71 B2 F48 O2 Si2 -","- C99 H55.71 B2 F48 O2 Si2 -","- C198 H111.42 B4 F96 O4 Si4 -","2","1","","Paola Romanato; Simon Duttwyler; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Intramolecular Halogen Stabilization of Silylium Ions Directs Gearing Dynamics","Journal of the American Chemical Society","2010","132","","7828","7829","10.1021/ja9109665","","","0.71073","MoKα","","0.0646","0.0441","","","0.1137","0.1235","","","","","","1.046","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102553","11.3614","0.0003","14.0989","0.0003","29.8844","0.0006","92.823","0.001","95.642","0.002","107.824","0.002","4519.2","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H137 Cl Mo N10 O2 -","- C92 H137 Cl Mo N10 O2 -","- C184 H274 Cl2 Mo2 N20 O4 -","2","1","","Michael R. Reithofer; Richard R. Schrock; Peter Müller","Synthesis of [(DPPNCH2CH2)3N]3- Molybdenum Complexes (DPP = 3,5-(2,5-Diisopropylpyrrolyl)2C6H3) and Studies Relevant to Catalytic Reduction of Dinitrogen","Journal of the American Chemical Society","2010","132","","8349","8358","10.1021/ja1008213","","","1.54178","CuKα","","0.0507","0.0454","","","0.1088","0.1114","","","","","","1.183","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102554","12.746","0.0002","18.0416","0.0003","27.6442","0.0004","92.626","0.001","100.951","0.001","106.505","0.001","5950.36","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C130 H183 Mo N13 -","- C130 H183 Mo N13 -","- C260 H366 Mo2 N26 -","2","1","","Michael R. Reithofer; Richard R. Schrock; Peter Müller","Synthesis of [(DPPNCH2CH2)3N]3- Molybdenum Complexes (DPP = 3,5-(2,5-Diisopropylpyrrolyl)2C6H3) and Studies Relevant to Catalytic Reduction of Dinitrogen","Journal of the American Chemical Society","2010","132","","8349","8358","10.1021/ja1008213","","","1.54178","CuKα","","0.0545","0.0497","","","0.1317","0.1358","","","","","","1.075","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102555","30.239","0.004","23.407","0.003","27.664","0.003","90","","116.633","0.002","90","","17503","4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C93 H126 Mo N11 -","- C93 H126 Mo N11 -","- C744 H1008 Mo8 N88 -","8","2","","Michael R. Reithofer; Richard R. Schrock; Peter Müller","Synthesis of [(DPPNCH2CH2)3N]3- Molybdenum Complexes (DPP = 3,5-(2,5-Diisopropylpyrrolyl)2C6H3) and Studies Relevant to Catalytic Reduction of Dinitrogen","Journal of the American Chemical Society","2010","132","","8349","8358","10.1021/ja1008213","","","0.71073","MoKα","","0.103","0.053","","","0.1193","0.1497","","","","","","1.025","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102556","14.9816","0.0003","20.9091","0.0004","43.6033","0.0009","89.795","0.001","89.692","0.001","70.328","0.001","12861.4","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C134 H148 B F24 Mo N11 -","- C134 H148 B F24 Mo N11 -","- C536 H592 B4 F96 Mo4 N44 -","4","2","","Michael R. Reithofer; Richard R. Schrock; Peter Müller","Synthesis of [(DPPNCH2CH2)3N]3- Molybdenum Complexes (DPP = 3,5-(2,5-Diisopropylpyrrolyl)2C6H3) and Studies Relevant to Catalytic Reduction of Dinitrogen","Journal of the American Chemical Society","2010","132","","8349","8358","10.1021/ja1008213","","","1.54178","CuKα","","0.055","0.0486","","","0.1215","0.1258","","","","","","1.049","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102557","14.5735","0.0003","30.3139","0.0006","31.0683","0.0006","90","","102.451","0.001","90","","13402.5","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C134.5 H167 B F24 Mo N12 -","- C134.5 H167 B F24 Mo N12 -","- C538 H668 B4 F96 Mo4 N48 -","4","1","","Michael R. Reithofer; Richard R. Schrock; Peter Müller","Synthesis of [(DPPNCH2CH2)3N]3- Molybdenum Complexes (DPP = 3,5-(2,5-Diisopropylpyrrolyl)2C6H3) and Studies Relevant to Catalytic Reduction of Dinitrogen","Journal of the American Chemical Society","2010","132","","8349","8358","10.1021/ja1008213","","","1.54178","CuKα","","0.0792","0.0568","","","0.1405","0.1563","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102558","12.8824","0.0012","7.9467","0.0007","16.7333","0.0016","90","","107.709","0.001","90","","1631.9","0.3","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 Br O2 -","- C18 H19 Br O2 -","- C72 H76 Br4 O8 -","4","1","","Dipannita Kalyani; Andrew D. Satterfield; Melanie S. Sanford","Palladium-Catalyzed Oxidative Arylhalogenation of Alkenes: Synthetic Scope and Mechanistic Insights","Journal of the American Chemical Society","2010","132","","8419","8427","10.1021/ja101851v","","","0.71073","MoKα","","0.0405","0.03","","","0.0726","0.0784","","","","","","1.011","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102559","10.422","0.0007","14.4036","0.0009","16.715","0.001","102.594","0.001","99.673","0.001","103.003","0.001","2323","0.3","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H25 Cl O2 -","- C29 H25 Cl O2 -","- C116 H100 Cl4 O8 -","4","2","","Dipannita Kalyani; Andrew D. Satterfield; Melanie S. Sanford","Palladium-Catalyzed Oxidative Arylhalogenation of Alkenes: Synthetic Scope and Mechanistic Insights","Journal of the American Chemical Society","2010","132","","8419","8427","10.1021/ja101851v","","","0.71073","MoKα","","0.0657","0.0417","","","0.1013","0.1141","","","","","","1.01","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102560","11.893","0.0014","25.281","0.004","8.5184","0.0008","90","","109.522","0.006","90","","2414","0.5","85","2","85","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H29 Cl O4 -","- C28 H29 Cl O4 -","- C112 H116 Cl4 O16 -","4","1","","Dipannita Kalyani; Andrew D. Satterfield; Melanie S. Sanford","Palladium-Catalyzed Oxidative Arylhalogenation of Alkenes: Synthetic Scope and Mechanistic Insights","Journal of the American Chemical Society","2010","132","","8419","8427","10.1021/ja101851v","","","0.71073","MoKα","","0.0392","0.0359","","","0.0932","0.0956","","","","","","1.083","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102561","40.194","0.002","7.0805","0.0004","26.8602","0.0014","90","","130.586","0.004","90","","5805.3","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H29 N3 O3 S2 -","- C36 H29 N3 O3 S2 -","- C288 H232 N24 O24 S16 -","8","1","","Rocío Ponce Ortiz; Helena Herrera; Raúl Blanco; Hui Huang; Antonio Facchetti; Tobin J. Marks; Yan Zheng; José L. Segura","Organic n-Channel Field-Effect Transistors Based on Arylenediimide-Thiophene Derivatives","Journal of the American Chemical Society","2010","132","","8440","8452","10.1021/ja1018783","","","1.54178","CuKα","","0.0924","0.054","","","0.1238","0.142","","","","","","1.027","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102562","8.9014","0.0002","11.7597","0.0002","17.7704","0.0004","90","","90","","90","","1860.17","0.07","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H22 N2 O3 S -","- C21 H22 N2 O3 S -","- C84 H88 N8 O12 S4 -","4","1","","Barry M. Trost; Steven M. Silverman","Enantioselective Construction of Highly Substituted Pyrrolidines by Palladium-Catalyzed Asymmetric [3+2] Cycloaddition of Trimethylenemethane with Ketimines","Journal of the American Chemical Society","2010","132","","8238","8240","10.1021/ja102102d","","","1.54178","CuKα","","0.0259","0.0252","","","0.0662","0.0666","","","","","","1.045","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102563","9.2738","0.0002","9.2738","0.0002","10.7801","0.0004","90","","90","","120","","802.91","0.04","290","","290","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Ca3 Li O6 Os -","- Ca3 Li O6 Os -","- Ca18 Li6 O36 Os6 -","6","0.166667","","Youguo Shi; Yanfeng Guo; Shan Yu; Masao Arai; Akira Sato; Alexei A. Belik; Kazunari Yamaura; Eiji Takayama-Muromachi","Crystal Growth and Structure and Magnetic Properties of the 5d Oxide Ca3LiOsO6: Extended Superexchange Magnetic Interaction in Oxide","Journal of the American Chemical Society","2010","132","","8474","8483","10.1021/ja102606q","","","0.71073","MoKα","","0.0224","0.0218","","","0.0584","0.059","","","","","","1.218","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102564","8.1985","0.0016","15.429","0.003","17.096","0.003","90","","90","","90","","2162.6","0.7","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 N2 O4 S -","- C22 H26 N2 O4 S -","- C88 H104 N8 O16 S4 -","4","1","","Porino Va; Erica L. Campbell; William M. Robertson; Dale L. Boger","Total Synthesis and Evaluation of a Key Series of C5-Substituted Vinblastine Derivatives","Journal of the American Chemical Society","2010","132","","8489","8495","10.1021/ja1027748","","","0.71073","MoKα","","0.0584","0.0556","","","0.1408","0.1431","","","","","","1.157","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102565","10.341","0.002","10.798","0.002","18.045","0.004","90","","90","","90","","2014.9","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H24 N2 O5 -","- C23 H24 N2 O5 -","- C92 H96 N8 O20 -","4","1","","Porino Va; Erica L. Campbell; William M. Robertson; Dale L. Boger","Total Synthesis and Evaluation of a Key Series of C5-Substituted Vinblastine Derivatives","Journal of the American Chemical Society","2010","132","","8489","8495","10.1021/ja1027748","","","0.71073","MoKα","","0.1213","0.0844","","","0.1399","0.1543","","","","","","1.1","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102566","10.547","0.002","12.693","0.003","17.13","0.003","90","","90","","90","","2293.2","0.8","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 N2 O4 S -","- C24 H30 N2 O4 S -","- C96 H120 N8 O16 S4 -","4","1","","Porino Va; Erica L. Campbell; William M. Robertson; Dale L. Boger","Total Synthesis and Evaluation of a Key Series of C5-Substituted Vinblastine Derivatives","Journal of the American Chemical Society","2010","132","","8489","8495","10.1021/ja1027748","","","0.71073","MoKα","","0.0524","0.0446","","","0.0972","0.1012","","","","","","1.036","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102567","11.401","0.006","28.72","0.01","6.709","0.003","90","","113.897","0.002","90","","2008.5","1.6","270","2","270","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C38 H32 Co Fe2 N14 O4 -","- C38 H20 Co Fe2 N14 O4 -","- C76 H40 Co2 Fe4 N28 O8 -","2","0.25","","Tao Liu; Yan-Juan Zhang; Shinji Kanegawa; Osamu Sato","Photoinduced Metal-to-Metal Charge Transfer toward Single-Chain Magnet","Journal of the American Chemical Society","2010","132","","8250","8251","10.1021/ja1027953","","","0.71073","MoKα","","0.0355","0.028","","","0.079","0.0825","","","","","","1.046","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102568","11.134","0.002","28.383","0.006","6.6499","0.0013","90","","113.7","0.03","90","","1924.2","0.8","173","2","173","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C38 H32 Co Fe2 N14 O4 -","- C38 H20 Co Fe2 N14 O4 -","- C76 H40 Co2 Fe4 N28 O8 -","2","0.25","","Tao Liu; Yan-Juan Zhang; Shinji Kanegawa; Osamu Sato","Photoinduced Metal-to-Metal Charge Transfer toward Single-Chain Magnet","Journal of the American Chemical Society","2010","132","","8250","8251","10.1021/ja1027953","","","0.71073","MoKα","","0.0776","0.0687","","","0.1398","0.1452","","","","","","1.078","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102569","11.059","0.002","28.269","0.006","6.625","0.001","90","","113.79","0.03","90","","1895.2","0.7","100","2","100","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C38 H32 Co Fe2 N14 O4 -","- C38 H20 Co Fe2 N14 O4 -","- C76 H40 Co2 Fe4 N28 O8 -","2","0.25","","Tao Liu; Yan-Juan Zhang; Shinji Kanegawa; Osamu Sato","Photoinduced Metal-to-Metal Charge Transfer toward Single-Chain Magnet","Journal of the American Chemical Society","2010","132","","8250","8251","10.1021/ja1027953","","","0.71073","MoKα","","0.0714","0.0594","","","0.1307","0.1369","","","","","","1.179","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102570","19.844","0.0002","18.8816","0.0001","30.8966","0.0003","90","","90","","90","","11576.5","0.17","100","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C64 H108 B2 Li2 O2 -","- C64 H108 B2 Li2 O2 -","- C512 H864 B16 Li16 O16 -","8","1","","Yoshiaki Shoji; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","A Stable Doubly Hydrogen-Bridged Butterfly-Shaped Diborane(4) Compound","Journal of the American Chemical Society","2010","132","","8258","8260","10.1021/ja102913g","","","0.8","synchrotron","","0.1046","0.0527","","","0.1302","0.1562","","","","","","0.911","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102571","21.6307","0.0004","10.3196","0.0002","22.3696","0.0004","90","","91.727","0.0009","90","","4991.08","0.16","90","","90","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C56 H92 B2 -","- C56 H92 B2 -","- C224 H368 B8 -","4","0.5","","Yoshiaki Shoji; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","A Stable Doubly Hydrogen-Bridged Butterfly-Shaped Diborane(4) Compound","Journal of the American Chemical Society","2010","132","","8258","8260","10.1021/ja102913g","","","0.71073","MoKα","","0.0713","0.0416","","","0.1223","0.1357","","","","","","1.022","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102572","9.574","0.005","10.277","0.005","12.803","0.007","90","","102.881","0.007","90","","1228","1.1","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H32 O7 -","- C27 H32 O7 -","- C54 H64 O14 -","2","1","","Ashok K. Basak; Naoyuki Shimada; William F. Bow; David A. Vicic; Marcus A. Tius","An Organocatalytic Asymmetric Nazarov Cyclization","Journal of the American Chemical Society","2010","132","","8266","8267","10.1021/ja103028r","","","0.71075","MoKα","","0.1157","0.0588","","","0.1033","0.1258","","","","","","1.006","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102573","13.841","0.003","11.389","0.003","18.565","0.004","90","","94.159","0.003","90","","2918.8","1.2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 N2 O6 S -","- C34 H32 N2 O6 S -","- C136 H128 N8 O24 S4 -","4","1","","John D. Trzupek; Dongjoo Lee; Brendan M. Crowley; Vasilios M. Marathias; Samuel J. Danishefsky","Total Synthesis of Enantiopure Phalarine via a Stereospecific Pictet-Spengler Reaction: Traceless Transfer of Chirality from l-Tryptophan","Journal of the American Chemical Society","2010","132","","8506","8512","10.1021/ja1030968","","","0.71073","MoKα","","0.0793","0.0434","","","0.1088","0.1321","","","","","","1.022","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102574","10.0705","0.0007","7.586","0.0006","11.9468","0.0009","90","","114.183","0.003","90","","832.58","0.11","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","TM-148","toste14","","- C17 H24 O6 -","- C17 H24 O6 -","- C34 H48 O12 -","2","1","","Steven G. Sethofer; Timo Mayer; F. Dean Toste","Gold(I)-Catalyzed Enantioselective Polycyclization Reactions","Journal of the American Chemical Society","2010","132","","8276","8277","10.1021/ja103544p","","","1.54178","CuKα","","0.026","0.0253","","","0.0666","0.0672","","","","","","1.064","","","","has coordinates,has disorder","204147","2020-10-21","18:00:00","" "4102575","22.632","0.003","38.947","0.005","13.0122","0.0016","90","","90","","90","","11470","3","143","2","143","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","SGS5-4","toste09","","- C70 H96 Au2 Cl2 O2 P2 -","- C70 H96 Au2 Cl2 O2 P2 -","- C420 H576 Au12 Cl12 O12 P12 -","6","1.5","","Steven G. Sethofer; Timo Mayer; F. Dean Toste","Gold(I)-Catalyzed Enantioselective Polycyclization Reactions","Journal of the American Chemical Society","2010","132","","8276","8277","10.1021/ja103544p","","","0.71073","MoKα","","0.0415","0.0326","","","0.0827","0.0869","","","","","","1.05","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102576","8.7941","0.0006","10.3348","0.0007","12.3385","0.0009","88.425","0.002","70.796","0.002","70.657","0.002","995.02","0.12","100","2","100","2","","","","","","","","3","P -1","-P 1","2","SGS5-83","toste17","","- C22 H28 O6 -","- C22 H28 O6 -","- C44 H56 O12 -","2","1","","Steven G. Sethofer; Timo Mayer; F. Dean Toste","Gold(I)-Catalyzed Enantioselective Polycyclization Reactions","Journal of the American Chemical Society","2010","132","","8276","8277","10.1021/ja103544p","","","1.54178","CuKα","","0.0359","0.0345","","","0.0873","0.0886","","","","","","1.026","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102577","9.6322","0.0006","9.7408","0.0006","14.0139","0.0009","90","","91.456","0.002","90","","1314.43","0.14","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","SGS5_151","toste18","","- C29 H40 O6 -","- C29 H40 O6 -","- C58 H80 O12 -","2","1","","Steven G. Sethofer; Timo Mayer; F. Dean Toste","Gold(I)-Catalyzed Enantioselective Polycyclization Reactions","Journal of the American Chemical Society","2010","132","","8276","8277","10.1021/ja103544p","","","1.54178","CuKα","","0.0298","0.0296","","","0.083","0.0832","","","","","","1.094","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102578","19.107","0.002","22.61","0.003","28.544","0.006","98.529","0.011","96.193","0.012","114.274","0.008","10920","3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C196 H216 Au38 S24 -","- C180 H184 Au38 S24 -","- C360 H368 Au76 S48 -","2","1","","Huifeng Qian; William T. Eckenhoff; Yan Zhu; Tomislav Pintauer; Rongchao Jin","Total Structure Determination of Thiolate-Protected Au38 Nanoparticles","Journal of the American Chemical Society","2010","132","","8280","8281","10.1021/ja103592z","","","0.71073","MoKα","","0.2424","0.0754","","","0.1385","0.2078","","","","","","0.964","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102579","17.844","0.005","12.072","0.004","21.601","0.006","90","","103.645","0.004","90","","4522","2","123","2","123","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","09092a","","","- C26 H18 Cl6 D36 F6 Fe N10 O7 S2 -","- C26 H18 Cl6 D36 F6 Fe N10 O7 S2 -","- C104 H72 Cl24 D144 F24 Fe4 N40 O28 S8 -","4","1","","Jason England; Yisong Guo; Erik R. Farquhar; Victor G. Young Jr.; Eckard Münck; Lawrence Que Jr.","The Crystal Structure of a High-Spin Oxoiron(IV) Complex and Characterization of Its Self-Decay Pathway","Journal of the American Chemical Society","2010","132","","8635","8644","10.1021/ja100366c","","","0.71073","MoKα","","0.0777","0.0462","","","0.1037","0.1218","","","","","","1.055","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102580","22.0889","0.0004","22.0889","0.0004","13.8862","0.0004","90","","90","","90","","6775.3","0.3","295","2","295","2","","","","","","","","6","I -4","I -4","82","","","","- C30 H28 Cl2 F6 O6 Pd2 -","- C30 H28 Cl2 F6 O6 Pd2 -","- C240 H224 Cl16 F48 O48 Pd16 -","8","1","","Parthasarathy Gandeepan; Kanniyappan Parthasarathy; Chien-Hong Cheng","Synthesis of Phenanthrone Derivatives from sec-Alkyl Aryl Ketones and Aryl Halides via a Palladium-Catalyzed Dual C-H Bond Activation and Enolate Cyclization","Journal of the American Chemical Society","2010","132","","8569","8571","10.1021/ja1026248","","","0.71073","MoKα","","0.0694","0.0409","","","0.0867","0.1003","","","","","","1.012","","","","has coordinates,has disorder","178771","2020-10-21","18:00:00","" "4102581","9.153","0.006","11.934","0.008","4.372","0.003","90","","90","","90","","477.6","0.6","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- B3 Be Na O6 -","- B3 Be Na O6 -","- B12 Be4 Na4 O24 -","4","1","","Shichao Wang; Ning Ye; Wei Li; Dan Zhao","Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals","Journal of the American Chemical Society","2010","132","","8779","8786","10.1021/ja102737t","","","0.71073","MoKα","","0.0438","0.0378","","","0.0741","0.0763","","","","","","1.11","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102582","10.405","0.01","9.001","0.007","6.559","0.014","90","","114.543","0.011","90","","558.8","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- B3 Be2 K O7 -","- B3 Be2 K O7 -","- B12 Be8 K4 O28 -","4","0.5","","Shichao Wang; Ning Ye; Wei Li; Dan Zhao","Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals","Journal of the American Chemical Society","2010","132","","8779","8786","10.1021/ja102737t","","","0.71073","MoKα","","0.0244","0.0235","","","0.0612","0.0619","","","","","","1.171","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102583","7.639","0.006","17.464","0.013","4.376","0.003","90","","90","","90","","583.8","0.7","293","2","293","2","","","","","","","","4","P m n 21","P 2ac -2","31","","","","- B3 Be2 K O7 -","- B3 Be2 K O7 -","- B12 Be8 K4 O28 -","4","1","","Shichao Wang; Ning Ye; Wei Li; Dan Zhao","Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals","Journal of the American Chemical Society","2010","132","","8779","8786","10.1021/ja102737t","","","0.71073","MoKα","","0.029","0.0271","","","0.0675","0.069","","","","","","1.068","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102584","7.4766","0.0013","13.2701","0.0018","9.3263","0.0017","90","","111.272","0.01","90","","862.3","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- B9 Be6 K3 O21 -","- B9 Be6 K3 O21 -","- B18 Be12 K6 O42 -","2","1","","Shichao Wang; Ning Ye; Wei Li; Dan Zhao","Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals","Journal of the American Chemical Society","2010","132","","8779","8786","10.1021/ja102737t","","","0.71073","MoKα","","0.0465","0.0405","","","0.1141","0.1195","","","","","","1.092","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102585","7.687","0.004","17.724","0.009","4.393","0.002","90","","90","","90","","598.5","0.5","293","2","293","2","","","","","","","","4","P m n 21","P 2ac -2","31","","","","- B3 Be2 O7 Rb -","- B3 Be2 O7 Rb -","- B12 Be8 O28 Rb4 -","4","1","","Shichao Wang; Ning Ye; Wei Li; Dan Zhao","Alkaline Beryllium Borate NaBeB3O6 and ABe2B3O7 (A = K, Rb) as UV Nonlinear Optical Crystals","Journal of the American Chemical Society","2010","132","","8779","8786","10.1021/ja102737t","","","0.71073","MoKα","","0.04","0.0338","","","0.074","0.0767","","","","","","1.012","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102586","10.8373","0.0009","10.8373","0.0009","14.8921","0.0013","90","","90","","90","","1749","0.3","100","","100","","","","","","","","dichloromethane","4","P 41","P 4w","76","","2-(R)-ethoxy-5,5-di(4-bromophenyl)tetrahydrofuran","","- C18 H18 Br2 O2 -","- C18 H18 Br2 O2 -","- C72 H72 Br8 O8 -","4","1","","Ilija Čorić; Sreekumar Vellalath; Benjamin List","Catalytic Asymmetric Transacetalization","Journal of the American Chemical Society","2010","132","","8536","8537","10.1021/ja102753d","","","1.54178","Cu-Kα","","0.0168","0.0168","","","0.0407","0.0407","","","","","","1.133","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102587","13.856","0.003","4.105","0.0008","12.343","0.003","90","","118.55","0.03","90","","616.7","0.3","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- La3 O3 Sb -","- La3 O3 Sb -","- La12 O12 Sb4 -","4","0.5","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.1104","0.0486","","","0.0589","0.0737","","","","","","0.629","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102588","13.332","0.002","3.9501","0.0004","11.9187","0.0018","90","","118.31","0.011","90","","552.6","0.14","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- O3 Sb Sm3 -","- O3 Sb Sm3 -","- O12 Sb4 Sm12 -","4","0.5","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.0654","0.0319","","","0.0448","0.05","","","","","","0.823","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102589","13.462","0.003","3.8629","0.0008","15.23","0.003","90","","106.77","0.03","90","","758.3","0.3","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- O8 Sb3 Sm8 -","- O8 Sb2.976 Sm8 -","- O16 Sb5.952 Sm16 -","2","0.25","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.0909","0.0389","","","0.0465","0.054","","","","","","0.801","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102590","13.272","0.003","3.8971","0.0008","11.878","0.002","90","","118.4","0.03","90","","540.4","0.2","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Gd3 O3 Sb -","- Gd3 O3 Sb -","- Gd12 O12 Sb4 -","4","0.5","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.109","0.0664","","","0.1347","0.1475","","","","","","1.018","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102591","13.394","0.003","3.8191","0.0008","15.104","0.003","90","","107.05","0.03","90","","738.7","0.3","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Gd8 O8 Sb3 -","- Gd8 O8 Sb3 -","- Gd16 O16 Sb6 -","2","0.25","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.0876","0.0463","","","0.0875","0.0963","","","","","","0.922","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102592","13.014","0.003","3.8218","0.0007","11.679","0.002","90","","118.213","0.014","90","","511.87","0.19","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ho3 O3 Sb -","- Ho3 O3 Sb -","- Ho12 O12 Sb4 -","4","0.5","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.1185","0.0518","","","0.0788","0.0943","","","","","","0.914","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102593","13.1368","0.0011","3.7609","0.0002","14.87","0.0013","90","","106.958","0.007","90","","702.73","0.1","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ho8 O8 Sb3 -","- Ho8 O8 Sb2.95 -","- Ho16 O16 Sb5.9 -","2","0.25","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.0737","0.041","","","0.066","0.072","","","","","","1.015","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102594","13.1445","0.0017","3.7597","0.0005","14.874","0.002","90","","107.025","0.005","90","","702.85","0.16","296","2","296","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ho8 O8 Sb3 -","- Ho8 O8 Sb2.946 -","- Ho16 O16 Sb5.892 -","2","0.25","","Peng Wang; Scott Forbes; Taras Kolodiazhnyi; Kosuke Kosuda; Yurij Mozharivskyj","Synthesis, Crystal and Electronic Structures of New Narrow-Band-Gap Semiconducting Antimonide Oxides RE3SbO3 and RE8Sb3-δO8, with RE = La, Sm, Gd, and Ho","Journal of the American Chemical Society","2010","132","","8795","8803","10.1021/ja1027698","","","0.71073","MoKα","","0.0467","0.0353","","","0.0666","0.0706","","","","","","1.04","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102595","14.2752","0.0006","14.173","0.0006","19.8547","0.0009","90","","92.571","0.001","90","","4013","0.3","296","2","191","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C74 H92 Dy4 N8 O30 -","- C74 H92 Dy4 N8 O30 -","- C148 H184 Dy8 N16 O60 -","2","0.5","","Yun-Nan Guo; Gong-Feng Xu; Patrick Gamez; Lang Zhao; Shuang-Yan Lin; Ruiping Deng; Jinkui Tang; Hong-Jie Zhang","Two-Step Relaxation in a Linear Tetranuclear Dysprosium(III) Aggregate Showing Single-Molecule Magnet Behavior","Journal of the American Chemical Society","2010","132","","8538","8539","10.1021/ja103018m","","","0.71073","MoKα","","0.0201","0.0186","","","0.0462","0.0468","","","","","","1.096","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102596","18.2908","0.0002","19.333","0.0002","22.0646","0.0004","90","","94.6278","0.0004","90","","7776.96","0.18","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C132 H220 N12 O15 P8 Ru4 -","- C132 H220 N12 O15 P8 Ru4 -","- C264 H440 N24 O30 P16 Ru8 -","2","0.5","","Eugene Khaskin; Mark A. Iron; Linda J. W. Shimon; Jing Zhang; David Milstein","N-H Activation of Amines and Ammonia by Ru via Metal-Ligand Cooperation","Journal of the American Chemical Society","2010","132","","8542","8543","10.1021/ja103130u","","","0.71073","MoKα","","0.0742","0.058","","","0.145","0.1525","","","","","","1.052","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102597","22.375","0.002","8.3133","0.001","30.838","0.003","90","","101.635","0.005","90","","5618.3","1","150","2","150","2","","","","","","","Synthesized by the authors. See text","4","C 1 2/c 1","-C 2yc","15","","","","- C39 H29 N O2 -","- C39 H29 N O2 -","- C312 H232 N8 O16 -","8","1","","Jeanne Leblond; Hui Gao; Anne Petitjean; Jean-Christophe Leroux","pH-Responsive Molecular Tweezers","Journal of the American Chemical Society","2010","132","","8544","8545","10.1021/ja103153t","","","1.54178","CuKα","","0.0784","0.0539","","","0.118","0.1302","","","","","","1.087","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102598","13.118","0.003","15.53","0.003","7.7261","0.0015","90","","101.78","0.03","90","","1540.8","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C72 H76 N4 O8 -","4","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.1517","0.0919","","","0.2053","0.2344","","","","","","1.078","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102599","9.0122","0.0018","9.7153","0.0019","10.094","0.002","113.58","0.03","98.95","0.03","101.5","0.03","766","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C36 H38 N2 O4 -","2","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.0748","0.0666","","","0.1868","0.1945","","","","","","1.057","","","","has coordinates","178771","2020-10-21","18:00:00","" "4102600","8.8196","0.0018","11.018","0.002","15.998","0.003","90","","99.85","0.03","90","","1531.7","0.5","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 O3 -","- C18 H20 O3 -","- C72 H80 O12 -","4","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.089","0.049","","","0.0968","0.1118","","","","","","1.015","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102601","13.39","0.003","7.864","0.0016","16.575","0.003","90","","107.64","0.03","90","","1663.3","0.6","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C76 H88 O12 -","4","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.0868","0.0657","","","0.169","0.183","","","","","","1.081","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102602","16.428","0.003","9.6578","0.0019","20.204","0.004","90","","90.45","0.03","90","","3205.4","1.1","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C152 H176 O24 -","8","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.053","0.0436","","","0.104","0.1104","","","","","","1.059","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102603","7.6864","0.0015","10.286","0.002","10.406","0.002","109.63","0.03","106.62","0.03","103.44","0.03","691.6","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H20 O3 -","- C14 H20 O3 -","- C28 H40 O6 -","2","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.1469","0.0802","","","0.1762","0.2118","","","","","","1.03","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102604","30.462","0.006","8.0445","0.0016","16.349","0.003","90","","122.21","0.03","90","","3389.8","1.6","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 O3 -","- C20 H24 O3 -","- C160 H192 O24 -","8","1","","Paresma R. Patel; Dale L. Boger","Intramolecular [1 + 2] and [3 + 2] Cycloaddition Reactions of Cyclopropenone Ketals","Journal of the American Chemical Society","2010","132","","8527","8529","10.1021/ja103933n","","","0.71073","MoKα","","0.087","0.0674","","","0.1712","0.1826","","","","","","1.128","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102605","20.708","0.01","7.698","0.004","25.356","0.012","90","","90","","90","","4042","3","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,4-Diacetoxy-8,9-dibromo-5,12-dihydro-5,12-methanotetracene","","- C23 H16 Br2 O4 -","- C23 H16 Br2 O4 -","- C184 H128 Br16 O32 -","8","1","","Georg Jansen; Björn Kahlert; Frank-Gerrit Klärner; Roland Boese; Dieter Bläser","Intramolecular Electronic Interactions between Nonconjugated Arene and Quinone Chromophores","Journal of the American Chemical Society","2010","132","","8581","8592","10.1021/ja910362j","","","0.71073","MoKα","","0.1178","0.0376","","","0.0758","0.1008","","","","","","0.992","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102606","8.471","0.01","26.9","0.03","8.217","0.009","90","","93.28","0.02","90","","1869","4","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Diacetoxy-5,12-dihydro-5,12-methanotetracene","","- C23 H18 O4 -","- C23 H18 O4 -","- C92 H72 O16 -","4","1","","Georg Jansen; Björn Kahlert; Frank-Gerrit Klärner; Roland Boese; Dieter Bläser","Intramolecular Electronic Interactions between Nonconjugated Arene and Quinone Chromophores","Journal of the American Chemical Society","2010","132","","8581","8592","10.1021/ja910362j","","","0.71073","MoKα","","0.1746","0.0571","","","0.1344","0.1728","","","","","","0.962","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102607","11.917","0.008","10.215","0.007","15.634","0.01","90","","102.999","0.014","90","","1854","2","223","2","223","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-Dimethoxy-5,14-dihydro-5,14-methanopentacene","","- C25 H20 O2 -","- C25 H20 O2 -","- C100 H80 O8 -","4","1","","Georg Jansen; Björn Kahlert; Frank-Gerrit Klärner; Roland Boese; Dieter Bläser","Intramolecular Electronic Interactions between Nonconjugated Arene and Quinone Chromophores","Journal of the American Chemical Society","2010","132","","8581","8592","10.1021/ja910362j","","","0.71073","MoKα","","0.1048","0.0452","","","0.0987","0.1195","","","","","","0.995","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102608","15.2702","0.0005","10.1219","0.0004","15.6273","0.0005","90","","96.918","0.002","90","","2397.82","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H11 Fe2 N O8 S2 -","- C25 H11 Fe2 N O8 S2 -","- C100 H44 Fe8 N4 O32 S8 -","4","1","","Amanda P. S. Samuel; Dick T. Co; Charlotte L. Stern; Michael R. Wasielewski","Ultrafast Photodriven Intramolecular Electron Transfer from a Zinc Porphyrin to a Readily Reduced Diiron Hydrogenase Model Complex","Journal of the American Chemical Society","2010","132","","8813","8815","10.1021/ja100016v","","","0.71073","MoKα","","0.0414","0.0288","","","0.0704","0.0802","","","","","","1.041","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102609","8.5625","0.0011","8.5625","0.0011","8.5625","0.0011","90","","90","","90","","627.77","0.14","100","3","100","3","","","","","","","","4","I m -3 m","-I 4 2 3","229","","","","- Ga6 Ge6 Mn Y4 -","- Ga6 Ge6 Mn Y4 -","- Ga12 Ge12 Mn2 Y8 -","2","0.0208333","","Melanie C. Francisco; Christos D. Malliakas; Paula M. B. Piccoli; Matthias J. Gutmann; Arthur J. Schultz; Mercouri G. Kanatzidis","Development and Loss of Ferromagnetism Controlled by the Interplay of Ge Concentration and Mn Vacancies in Structurally Modulated Y4Mn1-xGa12-yGey","Journal of the American Chemical Society","2010","132","","8998","9006","10.1021/ja1009986","","","0.71073","MoKα","","0.0274","0.0268","","","0.0775","0.0775","","","","","","3.713","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102610","8.5481","0.0007","8.5481","0.0007","8.5481","0.0007","90","","90","","90","","624.61","0.09","100","1","100","1","","","","","","","","4","I m -3 m","-I 4 2 3","229","","","","- Ga6 Ge6 Mn Y4 -","- Ga6 Ge6 Mn Y4 -","- Ga12 Ge12 Mn2 Y8 -","2","0.0208333","","Melanie C. Francisco; Christos D. Malliakas; Paula M. B. Piccoli; Matthias J. Gutmann; Arthur J. Schultz; Mercouri G. Kanatzidis","Development and Loss of Ferromagnetism Controlled by the Interplay of Ge Concentration and Mn Vacancies in Structurally Modulated Y4Mn1-xGa12-yGey","Journal of the American Chemical Society","2010","132","","8998","9006","10.1021/ja1009986","","","0.71073","MoKα","","0.0246","0.0237","","","0.0502","0.0503","","","","","","2.246","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102611","8.598","0.0027","8.598","0.0027","8.598","0.0027","90","","90","","90","","635.6","0.3","260","","260","1","","","","","","","","4","I m -3 m","-I 4 2 3","229","","","","- Ga10.98 Ge1.02 Mn0.9 Y4 -","- Ga10.98 Ge1.02 Mn0.904 Y4 -","- Ga21.96 Ge2.04 Mn1.808 Y8 -","2","0.0208333","","Melanie C. Francisco; Christos D. Malliakas; Paula M. B. Piccoli; Matthias J. Gutmann; Arthur J. Schultz; Mercouri G. Kanatzidis","Development and Loss of Ferromagnetism Controlled by the Interplay of Ge Concentration and Mn Vacancies in Structurally Modulated Y4Mn1-xGa12-yGey","Journal of the American Chemical Society","2010","132","","8998","9006","10.1021/ja1009986","powder diffraction","neutron","","neutron","","0.066","0.066","","","","0.133","","","1.75","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00","" "4102612","8.586","0.002","8.586","0.002","8.586","0.002","90","","90","","90","","633","0.3","298","","298","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","","","- Ga7.98 Ge4.02 Mn0.95 Y4 -","- Ga7.98 Ge4.02 Mn0.951 Y4 -","- Ga15.96 Ge8.04 Mn1.902 Y8 -","2","0.0208333","","Melanie C. Francisco; Christos D. Malliakas; Paula M. B. Piccoli; Matthias J. Gutmann; Arthur J. Schultz; Mercouri G. Kanatzidis","Development and Loss of Ferromagnetism Controlled by the Interplay of Ge Concentration and Mn Vacancies in Structurally Modulated Y4Mn1-xGa12-yGey","Journal of the American Chemical Society","2010","132","","8998","9006","10.1021/ja1009986","powder diffraction","neutron","","neutron","","0.087","0.071","","","","0.103","","","1.24","","","","","","","has coordinates,has Fobs","178772","2020-10-21","18:00:00","" "4102613","13.551","0.005","11.403","0.004","11.442","0.004","90","","96.214","0.007","90","","1757.7","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 N O4 S -","- C19 H25 N O4 S -","- C76 H100 N4 O16 S4 -","4","1","","Michal Szostak; Lei Yao; Victor W. Day; Douglas R. Powell; Jeffrey Aubé","Structural Characterization of N-Protonated Amides: Regioselective N-Activation of Medium-Bridged Twisted Lactams","Journal of the American Chemical Society","2010","132","","8836","8837","10.1021/ja101690u","","","0.71073","MoKα","","0.0682","0.0621","","","0.1396","0.1434","","","","","","1.018","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102614","9.579","0.003","10.318","0.003","11.947","0.003","102.329","0.006","98.412","0.006","97.361","0.006","1125.5","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H29 N O4 S -","- C25 H29 N O4 S -","- C50 H58 N2 O8 S2 -","2","1","","Michal Szostak; Lei Yao; Victor W. Day; Douglas R. Powell; Jeffrey Aubé","Structural Characterization of N-Protonated Amides: Regioselective N-Activation of Medium-Bridged Twisted Lactams","Journal of the American Chemical Society","2010","132","","8836","8837","10.1021/ja101690u","","","0.71073","MoKα","","0.0931","0.0829","","","0.1871","0.1925","","","","","","1.045","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102615","12.836","0.002","10.012","0.002","18.519","0.003","90","","103.541","0.004","90","","2313.8","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H28 Br N O4 S -","- C25 H28 Br N O4 S -","- C100 H112 Br4 N4 O16 S4 -","4","1","","Michal Szostak; Lei Yao; Victor W. Day; Douglas R. Powell; Jeffrey Aubé","Structural Characterization of N-Protonated Amides: Regioselective N-Activation of Medium-Bridged Twisted Lactams","Journal of the American Chemical Society","2010","132","","8836","8837","10.1021/ja101690u","","","0.71073","MoKα","","0.0536","0.0377","","","0.0899","0.0947","","","","","","1.036","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102616","9.5638","0.0019","6.2274","0.0012","29.609","0.006","90","","96.414","0.003","90","","1752.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H29 N O2 -","- C20 H29 N O2 -","- C80 H116 N4 O8 -","4","1","","Michal Szostak; Lei Yao; Victor W. Day; Douglas R. Powell; Jeffrey Aubé","Structural Characterization of N-Protonated Amides: Regioselective N-Activation of Medium-Bridged Twisted Lactams","Journal of the American Chemical Society","2010","132","","8836","8837","10.1021/ja101690u","","","0.71073","MoKα","","0.1285","0.1267","","","0.2739","0.2752","","","","","","1.161","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102617","14.5938","0.0015","11.0075","0.0009","32.94","0.003","90","","99.129","0.004","90","","5224.5","0.8","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C94 H14 Ce2 O2 S4 -","- C94 H14 Ce2 O2 S4 -","- C376 H56 Ce8 O8 S16 -","4","1","","Dirk M. Guldi; Lai Feng; Shankara Gayathri Radhakrishnan; Hidefumi Nikawa; Michio Yamada; Naomi Mizorogi; Takahiro Tsuchiya; Takeshi Akasaka; Shigeru Nagase; M. Ángeles Herranz; Nazario Martín","A Molecular Ce2@Ih-C80 Switch-Unprecedented Oxidative Pathway in Photoinduced Charge Transfer Reactivity","Journal of the American Chemical Society","2010","132","","9078","9086","10.1021/ja101856j","","","0.71075","MoKα","","0.0994","0.0901","","","0.2602","0.2653","","","","","","1.118","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102618","7.1406","0.0003","24.5387","0.0011","11.2924","0.0006","90","","98.649","0.002","90","","1956.16","0.16","171","2","171","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H22 Br2 O2 -","- C21 H22 Br2 O2 -","- C84 H88 Br8 O8 -","4","2","","Kento Ishida; Hiroyuki Kusama; Nobuharu Iwasawa","Enantioselective Preparation of 8-Oxabicyclo[3.2.1]octane Derivatives via Asymmetric [3+2]-Cycloaddition of Platinum-Containing Carbonyl Ylides with Vinyl Ethers","Journal of the American Chemical Society","2010","132","","8842","8843","10.1021/ja102391t","","","0.71075","MoKα","","0.0456","0.0357","","","0.0959","0.1109","","","","","","0.728","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102619","15.3063","0.0009","11.4749","0.0007","19.1538","0.0012","90","","94.055","0.001","90","","3355.7","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H42 Cl Ir O2 P2 Si -","- C35 H42 Cl Ir O2 P2 Si -","- C140 H168 Cl4 Ir4 O8 P8 Si4 -","4","1","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0719","0.0357","","","0.0533","0.0592","","","","","","0.723","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102620","17.0033","0.0011","19.284","0.0013","10.0283","0.0007","90","","90","","90","","3288.2","0.4","100","2","100","0.2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C32 H38 Br Cl2 Ir P2 Si -","- C32 H38 Br Cl2 Ir P2 Si -","- C128 H152 Br4 Cl8 Ir4 P8 Si4 -","4","1","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0359","0.0266","","","0.0406","0.0416","","","","","","0.814","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102621","11.3007","0.0007","18.6699","0.0012","13.9997","0.0009","90","","99.925","0.001","90","","2909.5","0.3","100","2","100","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H36 Br Ir P2 Si -","- C31 H36 Br Ir P2 Si -","- C124 H144 Br4 Ir4 P8 Si4 -","4","1","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0285","0.0211","","","0.04","0.0409","","","","","","0.891","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102622","7.8913","0.0003","22.2515","0.0008","9.1239","0.0003","90","","111.896","0.001","90","","1486.52","0.09","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C31 H36 I Ir P2 Si -","- C31 H36 I Ir P2 Si -","- C62 H72 I2 Ir2 P4 Si2 -","2","0.5","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0199","0.0186","","","0.0415","0.0419","","","","","","1.045","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102623","11.4095","0.0008","18.8397","0.0013","14.1399","0.001","90","","100.888","0.001","90","","2984.7","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H36 Br Ir O P2 Si -","- C32 H36 Br Ir O P2 Si -","- C128 H144 Br4 Ir4 O4 P8 Si4 -","4","1","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0313","0.0235","","","0.0467","0.0478","","","","","","0.911","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102624","7.6296","0.0006","20.834","0.0016","21.0695","0.0016","90","","90","","90","","3349.1","0.4","100","2","100","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C34 H41 Cl3 Ir N P2 Si -","- C34 H41 Cl3 Ir N P2 Si -","- C136 H164 Cl12 Ir4 N4 P8 Si4 -","4","0.5","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0535","0.0301","","","0.0429","0.0461","","","","","","0.883","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102625","10.5097","0.0009","20.8031","0.0017","14.1343","0.0012","90","","91.806","0.002","90","","3088.7","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H39 Ir O2 P2 Si -","- C33 H39 Ir O2 P2 Si -","- C132 H156 Ir4 O8 P8 Si4 -","4","1","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0809","0.0425","","","0.0588","0.0659","","","","","","0.767","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102626","14.116","0.0006","19.3072","0.0008","22.4163","0.0009","90","","90","","90","","6109.3","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C33 H38 Cl Ir P2 Si -","- C33 H38 Cl Ir P2 Si -","- C264 H304 Cl8 Ir8 P16 Si8 -","8","2","","Eduardo Sola; Alba García-Camprubí; José L. Andrés; Marta Martín; Pablo Plou","Iridium Compounds with κ-P,P,Si(biPSi) Pincer Ligands: Favoring Reactive Structures in Unsaturated Complexes","Journal of the American Chemical Society","2010","132","","9111","9121","10.1021/ja102479h","","","0.71073","MoKα","","0.0619","0.0379","","","0.0532","0.058","","","","","","0.71","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102627","7.785","0.0005","10.978","0.0012","11.403","0.0011","95.927","0.007","103.375","0.007","96.072","0.008","934.54","0.15","122","2","122","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H58 N2 O Si2 -","- C38 H58 N2 O Si2 -","- C38 H58 N2 O Si2 -","1","0.5","","Søren Lindbaek Broman; Michael Åxman Petersen; Christian G. Tortzen; Anders Kadziola; Kristine Kilså; Mogens Brøndsted Nielsen","Arylethynyl Derivatives of the Dihydroazulene/Vinylheptafulvene Photo/Thermoswitch: Tuning the Switching Event","Journal of the American Chemical Society","2010","132","","9165","9174","10.1021/ja103235g","","","0.71073","MoKα","","0.1312","0.0942","","","0.1911","0.2159","","","","","","1.078","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102628","8.5537","0.0002","15.3855","0.0003","16.0317","0.0003","78.407","0.002","78.195","0.002","87.104","0.001","2022.97","0.08","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C34.5 H55 B Cl4 Ga N2 P -","- C34.5 H55 B Cl4 Ga N2 P -","- C69 H110 B2 Cl8 Ga2 N4 P2 -","2","1","","Florie Lavigne; Eddy Maerten; Gilles Alcaraz; Nathalie Saffon-Merceron; Carles Acosta-Silva; Vicenç Branchadell; Antoine Baceiredo","Borylated Methylenephosphonium Salts: Precursors of Elusive Boryl(phosphino)carbenes","Journal of the American Chemical Society","2010","132","","8864","8865","10.1021/ja103422b","","","0.71073","MoKα","","0.0655","0.0398","","","0.0885","0.1001","","","","","","1.006","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102629","11.1594","0.0004","9.2248","0.0004","30.9493","0.0012","90","","98.917","0.003","90","","3147.5","0.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H50 B N2 P -","- C31 H50 B N2 P -","- C124 H200 B4 N8 P4 -","4","1","","Florie Lavigne; Eddy Maerten; Gilles Alcaraz; Nathalie Saffon-Merceron; Carles Acosta-Silva; Vicenç Branchadell; Antoine Baceiredo","Borylated Methylenephosphonium Salts: Precursors of Elusive Boryl(phosphino)carbenes","Journal of the American Chemical Society","2010","132","","8864","8865","10.1021/ja103422b","","","0.71073","MoKα","","0.1721","0.0684","","","0.1403","0.1787","","","","","","1.011","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102630","11.7546","0.0003","8.5825","0.0002","19.6622","0.0006","90","","103.959","0.001","90","","1925.02","0.09","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C52 H42 B Fe N O2 -","- C52 H42 B Fe N O2 -","- C104 H84 B2 Fe2 N2 O4 -","2","1","","Giorgio Mirri; Steven D. Bull; Peter N. Horton; Tony D. James; Louise Male; James H. R. Tucker","Electrochemical Method for the Determination of Enantiomeric Excess of Binol Using Redox-Active Boronic Acids as Chiral Sensors","Journal of the American Chemical Society","2010","132","","8903","8905","10.1021/ja103462x","","","0.71073","MoKα","","0.0721","0.0592","","","0.1183","0.1307","","","","","","1.164","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102631","10.1494","0.0002","14.1915","0.0003","24.3721","0.0006","90","","98.372","0.001","90","","3473.03","0.13","296","2","296","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C34 H48 N2 O7 S -","- C34 H48 N2 O7 S -","- C136 H192 N8 O28 S4 -","4","2","","Łukasz Albrecht; Hao Jiang; Gustav Dickmeiss; Björn Gschwend; Signe Grann Hansen; Karl Anker Jørgensen","Asymmetric Formal trans-Dihydroxylation and trans-Aminohydroxylation of α,β-Unsaturated Aldehydes via an Organocatalytic Reaction Cascade","Journal of the American Chemical Society","2010","132","","9188","9196","10.1021/ja103538s","","x-ray","0.71073","MoKα","","0.0567","0.0468","","","0.133","0.1422","","","","","","1.024","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102632","15.346","0.004","15.422","0.004","17.595","0.004","113.517","0.003","98.507","0.003","103.154","0.003","3582.7","1.6","110","2","110","2","","","","","","","","7","P 1","P 1","1","1-CyD","","","- C98 H204 Fe2 N Na O107 S3 -","- C98 H145 Fe2 N Na O104.84 S3 -","- C98 H145 Fe2 N Na O104.84 S3 -","1","1","","Michael L. Singleton; Joseph H. Reibenspies; Marcetta Y. Darensbourg","A Cyclodextrin Host/Guest Approach to a Hydrogenase Active Site Biomimetic Cavity","Journal of the American Chemical Society","2010","132","","8870","8871","10.1021/ja103774j","","","0.71073","MoKα","","0.1277","0.0832","","","0.1797","0.2086","","","","","","0.999","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102633","22.1279","0.0002","7.6853","0.0005","16.7425","0.001","90","","99.752","0.002","90","","2806.1","0.2","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","TEA1","","","- C22 H24 Fe2 N2 O9 S3 -","- C22 H24 Fe2 N2 O9 S3 -","- C88 H96 Fe8 N8 O36 S12 -","4","1","","Michael L. Singleton; Joseph H. Reibenspies; Marcetta Y. Darensbourg","A Cyclodextrin Host/Guest Approach to a Hydrogenase Active Site Biomimetic Cavity","Journal of the American Chemical Society","2010","132","","8870","8871","10.1021/ja103774j","","","0.71073","MoKα","","0.0575","0.0408","","","0.0888","0.0941","","","","","","1.064","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102634","20.8279","0.0004","15.5918","0.0003","10.3665","0.0002","90","","110.947","0.001","90","","3143.98","0.11","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","P(CH2Ad)(i-Pr)2","","","- C17 H31 P -","- C17 H31 P -","- C136 H248 P8 -","8","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","1.54178","CuKα","","0.0281","0.0269","","","0.0718","0.0726","","","","","","1.04","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102635","10.314","0.0016","12.636","0.0019","13.91","0.002","97.399","0.002","95.803","0.002","92.354","0.002","1785.9","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","H2IrCl(P(CH2Ad)(i-Pr)2)2","","","- C36 H69 Cl Ir O0.5 P2 -","- C34 H64 Cl Ir P2 -","- C68 H128 Cl2 Ir2 P4 -","2","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0379","0.0295","","","0.0562","0.0584","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102636","10.9025","0.0004","11.8348","0.0004","13.4097","0.0005","90","","111.181","0.002","90","","1613.35","0.1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","H2Ir(kappa-2-C,P-(P(CH2Ad)(i-Pr)2))(P(CH2Ad)(i-Pr)2)","","","- C34 H62 Ir P2 -","- C34 H62 Ir P2 -","- C68 H124 Ir2 P4 -","2","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0304","0.0273","","","0.0641","0.0654","","","","","","1.048","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102637","10.429","0.005","13.741","0.005","13.801","0.005","116.142","0.005","90.733","0.005","105.16","0.005","1694.8","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","H2Ir(OH)(P(CH2Ad)(i-Pr)2)2","","","- C34 H65 Ir O P2 -","- C34 H65 Ir O P2 -","- C68 H130 Ir2 O2 P4 -","2","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71069","MoKα","","0.0224","0.0199","","","0.042","0.0435","","","","","","1.04","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102638","15.694","0.0009","13.116","0.0007","17.2375","0.0009","90","","102.654","0.001","90","","3462","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","HIr(N2)(P(CH2Ad)(i-Pr)2)2","","","- C34 H63 Ir N2 P2 -","- C34 H63 Ir N2 P2 -","- C136 H252 Ir4 N8 P8 -","4","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0192","0.0172","","","0.0462","0.0494","","","","","","1.014","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102639","13.1354","0.0009","11.1154","0.0008","22.907","0.0016","90","","100.983","0.001","90","","3283.3","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","H3Ir(P(CH2Ad)(i-Pr)2)2","","","- C34 H65 Ir P2 -","- C34 H65 Ir P2 -","- C136 H260 Ir4 P8 -","4","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0437","0.0345","","","0.0689","0.0737","","","","","","1.053","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102640","10.918","0.003","16.463","0.005","21.628","0.007","90","","90","","90","","3887","2","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Li(Et2O)][HIr(kappa-2-C,P-(P(CH2Ad)(i-Pr)2))(P(CH2Ad)(i-Pr)2)","","","- C38 H72 Ir Li O P2 -","- C38 H72 Ir Li O P2 -","- C152 H288 Ir4 Li4 O4 P8 -","4","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0514","0.0437","","","0.105","0.1116","","","","","","1.046","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102641","10.776","0.013","12.182","0.014","26.9","0.03","90","","98.916","0.015","90","","3489","7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","H5Ir(P(CH2Ad)(i-Pr)2)2","","","- C34 H67 Ir P2 -","- C34 H67 Ir P2 -","- C136 H268 Ir4 P8 -","4","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0683","0.0451","","","0.0945","0.1048","","","","","","1.033","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102642","13.1359","0.0011","14.0399","0.0012","15.8641","0.0014","87.976","0.001","86.669","0.001","89.379","0.001","2918.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Li(12-c-4)2][HIr(kappa-2-C,P-(P(CH2Ad)(i-Pr)2)(P(CH2Ad)(i-Pr)2)]","","","- C58 H114 Ir Li O10 P2 -","- C50 H94 Ir Li O8 P2 -","- C100 H188 Ir2 Li2 O16 P4 -","2","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0437","0.0365","","","0.0721","0.0752","","","","","","1.045","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102643","10.332","0.001","13.264","0.0012","16.494","0.0017","104.808","0.001","93.177","0.001","110.705","0.001","2017.4","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","H2Ir(OC6F5)(P(CH2Ad)(i-Pr)2)2","","","- C40 H64 F5 Ir O P2 -","- C40 H64 F5 Ir O P2 -","- C80 H128 F10 Ir2 O2 P4 -","2","1","","Matthew D. Millard; Curtis E. Moore; Arnold L. Rheingold; Joshua S. Figueroa","Four-Coordinate Iridium(I) Monohydrides: Reversible Dinitrogen Binding, Bond Activations, and Deprotonations","Journal of the American Chemical Society","2010","132","","8921","8923","10.1021/ja1037808","","","0.71073","MoKα","","0.0331","0.0286","","","0.0754","0.0821","","","","","","1.041","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102644","6.8952","0.001","8.7695","0.0013","8.9826","0.0013","69.553","0.001","72.897","0.001","80.674","0.002","485.36","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H15 N O2 -","- C10 H15 N O2 -","- C20 H30 N2 O4 -","2","1","","Gardner S. Creech; Ohyun Kwon","Tandem 6π-Electrocyclization and Cycloaddition of Nitrodienes to Yield Multicyclic Nitroso Acetals","Journal of the American Chemical Society","2010","132","","8876","8877","10.1021/ja1038819","","","0.71073","MoKα","","0.0423","0.0375","","","0.1037","0.1076","","","","","","1.086","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102645","7.1535","0.0013","18.602","0.003","9.932","0.0017","90","","90.295","0.002","90","","1321.6","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H21 N O4 -","- C14 H21 N O4 -","- C56 H84 N4 O16 -","4","1","","Gardner S. Creech; Ohyun Kwon","Tandem 6π-Electrocyclization and Cycloaddition of Nitrodienes to Yield Multicyclic Nitroso Acetals","Journal of the American Chemical Society","2010","132","","8876","8877","10.1021/ja1038819","","","0.71073","MoKα","","0.0517","0.0384","","","0.1004","0.1081","","","","","","1.044","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102646","8.931","0.002","8.324","0.002","10.071","0.002","90","","109.397","0.003","90","","706.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","silver(I) (1-amino-2,2-dinitrovinyl)amide ammonia","","- C2 H6 Ag N5 O4 -","- C2 H6 Ag N5 O4 -","- C8 H24 Ag4 N20 O16 -","4","1","","Sonali Garg; Haixiang Gao; Young-Hyuk Joo; Damon A. Parrish; Yangen Huang; Jean'ne M. Shreeve","Taming of the Silver FOX","Journal of the American Chemical Society","2010","132","","8888","8890","10.1021/ja103935q","","","0.71073","MoKα","","0.0196","0.0192","","","0.048","0.0482","","","","","","1.303","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102647","8.3696","0.0002","11.8615","0.0003","13.5708","0.0003","100.375","0.001","97.124","0.001","104.482","0.001","1262.74","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H40 Ni O4 P2 -","- C23 H40 Ni O4 P2 -","- C46 H80 Ni2 O8 P4 -","2","1","","Sumit Chakraborty; Jie Zhang; Jeanette A. Krause; Hairong Guan","An Efficient Nickel Catalyst for the Reduction of Carbon Dioxide with a Borane","Journal of the American Chemical Society","2010","132","","8872","8873","10.1021/ja103982t","","","1.54178","CuKα","","0.0509","0.0396","","","0.1014","0.1087","","","","","","1.023","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102648","27.4021","0.0004","17.3999","0.0002","27.9819","0.0004","90","","90","","90","","13341.6","0.3","150","2","150","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C68 H77 N Ni O P3 S3 Si3 -","- C68 H77 N Ni O P3 S3 Si3 -","- C544 H616 N8 Ni8 O8 P24 S24 Si24 -","8","1","","Chien-Ming Lee; Chien-Hong Chen; Fu-Xing Liao; Ching-Han Hu; Gene-Hsiang Lee","Mononuclear NiIII-Alkyl Complexes (Alkyl = Me and Et): Relevance to the Acetyl-CoA Synthase and Methyl-CoM Reductase","Journal of the American Chemical Society","2010","132","","9256","9258","10.1021/ja102430d","","","0.71073","MoKα","","0.1212","0.0516","","","0.1205","0.14","","","","","","1.066","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102649","27.4736","0.0005","17.4627","0.0003","27.9844","0.0005","90","","90","","90","","13425.9","0.4","150","2","150","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C69 H79 N Ni O P3 S3 Si3 -","- C69 H79 N Ni O P3 S3 Si3 -","- C552 H632 N8 Ni8 O8 P24 S24 Si24 -","8","1","","Chien-Ming Lee; Chien-Hong Chen; Fu-Xing Liao; Ching-Han Hu; Gene-Hsiang Lee","Mononuclear NiIII-Alkyl Complexes (Alkyl = Me and Et): Relevance to the Acetyl-CoA Synthase and Methyl-CoM Reductase","Journal of the American Chemical Society","2010","132","","9256","9258","10.1021/ja102430d","","","0.71073","MoKα","","0.0864","0.0506","","","0.1384","0.1574","","","","","","1.038","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102650","14.1385","0.0005","27.79","0.0008","15.1434","0.0005","90","","93.491","0.002","90","","5938.9","0.3","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H54 Cl8 N4 Ni O4 -","- C60 H54 Cl8 N4 Ni O4 -","- C240 H216 Cl32 N16 Ni4 O16 -","4","0.5","","Andrew G. Tennyson; Vincent M. Lynch; Christopher W. Bielawski","Arrested Catalysis: Controlling Kumada Coupling Activity via a Redox-Active N-Heterocyclic Carbene","Journal of the American Chemical Society","2010","132","","9420","9429","10.1021/ja102686u","","","0.71069","MoKα","","0.0504","0.0457","","","0.1179","0.122","","","","","","1.078","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102651","14.5799","0.0005","27.869","0.001","15.8661","0.0006","90","","90","","90","","6446.8","0.4","153","2","153","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C58 H52 Cl2 N4 O4 Pd -","- C58 H52 Cl2 N4 O4 Pd -","- C232 H208 Cl8 N16 O16 Pd4 -","4","0.25","","Andrew G. Tennyson; Vincent M. Lynch; Christopher W. Bielawski","Arrested Catalysis: Controlling Kumada Coupling Activity via a Redox-Active N-Heterocyclic Carbene","Journal of the American Chemical Society","2010","132","","9420","9429","10.1021/ja102686u","","","0.71073","MoKα","","0.111","0.059","","","0.1469","0.1631","","","","","","1.052","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102652","14.708","0.006","27.671","0.012","16.028","0.007","90","","90","","90","","6523","5","233","2","233","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C63 H64 Cl2 N4 O4 Pt -","- C58 H52 Cl2 N4 O4 Pt -","- C232 H208 Cl8 N16 O16 Pt4 -","4","0.25","","Andrew G. Tennyson; Vincent M. Lynch; Christopher W. Bielawski","Arrested Catalysis: Controlling Kumada Coupling Activity via a Redox-Active N-Heterocyclic Carbene","Journal of the American Chemical Society","2010","132","","9420","9429","10.1021/ja102686u","","","0.71069","MoKα","","0.0604","0.0534","","","0.1263","0.1286","","","","","","1.908","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102653","42.9245","0.0002","42.9245","0.0002","42.9245","0.0002","90","","90","","90","","79088.9","0.6","258","2","258","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","IRMOF-76","","","- C69 H45 N6 O13 Zn4 -","- C69 H51 N6 O13 Zn4 -","- C552 H408 N48 O104 Zn32 -","8","0.0416667","","Kounosuke Oisaki; Qiaowei Li; Hiroyasu Furukawa; Alexander U. Czaja; Omar M. Yaghi","A Metal-Organic Framework with Covalently Bound Organometallic Complexes","Journal of the American Chemical Society","2010","132","","9262","9264","10.1021/ja103016y","","","1.54178","CuKα","","0.1669","0.1465","","","0.4135","0.4378","","","","","","1.941","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102654","31.0845","0.0004","31.0845","0.0004","71.018","0.002","90","","90","","120","","59427","2","258","2","258","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","IRMOF-77","","","- C84 H63 I6 N9 O30 Pd3 Zn4 -","- C84 H63 I6 N9 O30 Pd3 Zn4 -","- C1008 H756 I72 N108 O360 Pd36 Zn48 -","12","0.333333","","Kounosuke Oisaki; Qiaowei Li; Hiroyasu Furukawa; Alexander U. Czaja; Omar M. Yaghi","A Metal-Organic Framework with Covalently Bound Organometallic Complexes","Journal of the American Chemical Society","2010","132","","9262","9264","10.1021/ja103016y","","","1.54178","CuKα","","0.1754","0.1033","","","0.2897","0.3399","","","","","","1.141","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102655","31.0845","0.0004","31.0845","0.0004","71.018","0.002","90","","90","","120","","59427","2","258","2","258","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","IRMOF-77squeeze","","","- C84 H63 I6 N9 O13 Pd3 Zn4 -","- C84 H63 I6 N9 O13 Pd3 Zn4 -","- C1008 H756 I72 N108 O156 Pd36 Zn48 -","12","0.333333","","Kounosuke Oisaki; Qiaowei Li; Hiroyasu Furukawa; Alexander U. Czaja; Omar M. Yaghi","A Metal-Organic Framework with Covalently Bound Organometallic Complexes","Journal of the American Chemical Society","2010","132","","9262","9264","10.1021/ja103016y","","","1.54178","CuKα","","0.107","0.056","","","0.1239","0.1389","","","","","","0.95","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102656","5.2508","0.0002","6.6452","0.0003","18.5082","0.0009","84.069","0.002","86.195","0.002","69.564","0.003","601.6","0.05","120","2","120","2","","","","","","","","3","P 1","P 1","1","","","","- C14 H16 S8 -","- C14 H16 S8 -","- C14 H16 S8 -","1","1","","José R. Galán-Mascarós; Eugenio Coronado; Paul A. Goddard; John Singleton; Amalia I. Coldea; John D. Wallis; Simon J. Coles; Antonio Alberola","A Chiral Ferromagnetic Molecular Metal","Journal of the American Chemical Society","2010","132","","9271","9273","10.1021/ja103147k","","","0.71073","MoKα","","0.0731","0.0647","","","0.1746","0.1826","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102657","12.1989","0.0006","12.711","0.0006","18.6558","0.001","81.461","0.001","70.925","0.001","76.345","0.001","2648.6","0.2","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C62 H56 N6 O6 -","- C62 H56 N6 O6 -","- C124 H112 N12 O12 -","2","1","","Daniel M. D'Souza; David A. Leigh; Loïc Mottier; Kathleen M. Mullen; Francesco Paolucci; Simon J. Teat; Songwei Zhang","Nitrone [2]Rotaxanes: Simultaneous Chemical Protection and Electrochemical Activation of a Functional Group","Journal of the American Chemical Society","2010","132","","9465","9470","10.1021/ja1034683","","","0.71073","MoKα","","0.1423","0.0594","","","0.0941","0.1214","","","","","","0.987","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102658","14.547","0.004","11.196","0.003","16.222","0.004","90","","108.408","0.004","90","","2506.9","1.1","150","2","150","2","","","","","","","?","4","P 1 21/c 1","-P 2ybc","14","","","","- C60 H54 N8 O6 -","- C60 H54 N8 O6 -","- C120 H108 N16 O12 -","2","0.5","","Daniel M. D'Souza; David A. Leigh; Loïc Mottier; Kathleen M. Mullen; Francesco Paolucci; Simon J. Teat; Songwei Zhang","Nitrone [2]Rotaxanes: Simultaneous Chemical Protection and Electrochemical Activation of a Functional Group","Journal of the American Chemical Society","2010","132","","9465","9470","10.1021/ja1034683","","","0.6884","Synchrotron","","0.1499","0.1012","","0.2693","0.2311","","","","1.053","1.18","1.18","","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102659","15.331","0.002","11.1669","0.0014","18.44","0.002","90","","110.639","0.002","90","","2954.3","0.6","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C66 H72 N10 O10 -","- C66 H68 N10 O8 -","- C132 H136 N20 O16 -","2","0.5","","Daniel M. D'Souza; David A. Leigh; Loïc Mottier; Kathleen M. Mullen; Francesco Paolucci; Simon J. Teat; Songwei Zhang","Nitrone [2]Rotaxanes: Simultaneous Chemical Protection and Electrochemical Activation of a Functional Group","Journal of the American Chemical Society","2010","132","","9465","9470","10.1021/ja1034683","","","0.71073","MoKα","","0.2759","0.0971","","","0.1735","0.2495","","","","","","1.063","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102660","9.7107","0.0004","12.3459","0.0005","20.2414","0.0008","90","","90","","90","","2426.69","0.17","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H32 N2 O -","- C28 H32 N2 O -","- C112 H128 N8 O4 -","4","1","","Adam R. Brown; Wen-Hsin Kuo; Eric N. Jacobsen","Enantioselective Catalytic α-Alkylation of Aldehydes via an SN1 Pathway","Journal of the American Chemical Society","2010","132","","9286","9288","10.1021/ja103618r","","x-ray","0.71073","MoKα","","0.0426","0.0393","","","0.1023","0.1054","","","","","","1.056","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102661","18.935","0.004","10.6904","0.0009","30.382","0.006","90","","103.88","0.02","90","","5970.4","1.9","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H47 F3 N3 Na Zn -","- C26 H47 F3 N3 Na Zn -","- C208 H376 F24 N24 Na8 Zn8 -","8","2","","David R. Armstrong; Victoria L. Blair; William Clegg; Sophie H. Dale; Joaquin Garcia-Alvarez; Gordon W. Honeyman; Eva Hevia; Robert E. Mulvey; Luca Russo","Structural Basis for Regioisomerization in the Alkali-Metal-Mediated Zincation (AMMZn) of Trifluoromethyl Benzene by Isolation of Kinetic and Thermodynamic Intermediates","Journal of the American Chemical Society","2010","132","","9480","9487","10.1021/ja1038598","","","0.71073","MoKα","","0.1487","0.102","","","0.1871","0.2046","","","","","","1.186","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102662","10.4379","0.0004","10.592","0.0004","17.3032","0.0007","88.91","0.003","89.721","0.003","60.559","0.002","1665.65","0.12","150","2","150","2","","","","","","","","6","P 1","P 1","1","","","","- C27 H54 F3 N4 Na Zn -","- C27 H54 F3 N4 Na Zn -","- C54 H108 F6 N8 Na2 Zn2 -","2","2","","David R. Armstrong; Victoria L. Blair; William Clegg; Sophie H. Dale; Joaquin Garcia-Alvarez; Gordon W. Honeyman; Eva Hevia; Robert E. Mulvey; Luca Russo","Structural Basis for Regioisomerization in the Alkali-Metal-Mediated Zincation (AMMZn) of Trifluoromethyl Benzene by Isolation of Kinetic and Thermodynamic Intermediates","Journal of the American Chemical Society","2010","132","","9480","9487","10.1021/ja1038598","","","0.71073","MoKα","","0.1003","0.0712","","","0.1874","0.2021","","","","","","1.118","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102663","11.5889","0.0007","13.1255","0.0008","11.0959","0.0006","90","","97.599","0.001","90","","1672.98","0.17","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 O4 -","- C18 H22 O4 -","- C72 H88 O16 -","4","1","","Tse-Min Teng; Rai-Shung Liu","Gold-Catalyzed Stereocontrolled Oxacyclization/[4+2]-Cycloaddition Cascade of Ketone-Allene Substrates","Journal of the American Chemical Society","2010","132","","9298","9300","10.1021/ja1043837","","","0.71073","MoKα","","0.0749","0.0486","","","0.1234","0.1428","","","","","","1.025","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102664","10.7084","0.0009","16.545","0.002","16.912","0.002","116.991","0.008","99.824","0.009","94.007","0.009","2593.5","0.5","299","","299","","","","","","","","Local laboratory","7","P -1","-P 1","2","","","","- C55 H42 Cl4 Fe N5 O6 P2 -","- C55 H42 Cl4 Fe N5 O6 P2 -","- C110 H84 Cl8 Fe2 N10 O12 P4 -","2","1","","W. Chadwick Ellis; Camly T. Tran; Riddhi Roy; Marte Rusten; Andreas Fischer; Alexander D. Ryabov; Bruce Blumberg; Terrence J. Collins","Designing Green Oxidation Catalysts for Purifying Environmental Waters","Journal of the American Chemical Society","2010","132","","9774","9781","10.1021/ja102524v","","","0.71073","MoKα","","0.0888","0.0462","","","0.0957","0.1144","","","","","","1.036","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102665","13.603","0.018","26.57","0.03","17.956","0.018","90","","111.14","0.03","90","","6053","12","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","bis-(meso-aryldibenzodipyrrin) Zn","","","- C40 H40 N4 O4 Zn -","- C35 H35 N2 O6 Zn0.5 -","- C280 H280 N16 O48 Zn4 -","8","1","","Mikhail A. Filatov; Artem Y. Lebedev; Sergei N. Mukhin; Sergei A. Vinogradov; Andrei V. Cheprakov","π-Extended Dipyrrins Capable of Highly Fluorogenic Complexation with Metal Ions","Journal of the American Chemical Society","2010","132","","9552","9554","10.1021/ja102852v","","","0.71073","MoKα","","0.1503","0.0465","","","0.1058","0.1572","","","","","","0.599","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102666","9.747","0.004","10.219","0.004","11.139","0.004","83.48","0.04","100.08","0.03","114.46","0.03","993.3","0.7","296","","296","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H28 N2 O3 -","- C21 H28 N2 O3 -","- C42 H56 N4 O6 -","2","1","","Hirokazu Nishimaki; Takayuki Ishida","Organic Two-Step Spin-Transition-Like Behavior in a Linear S = 1 Array: 3'-Methylbiphenyl-3,5-diyl Bis(tert-butylnitroxide) and Related Compounds","Journal of the American Chemical Society","2010","132","","9598","9599","10.1021/ja102890g","","","0.71069","MoKα","","","0.0676","","","","0.1111","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102667","9.2411","0.0005","10.3875","0.0002","11.754","0.0005","110.621","0.004","96.472","0.003","112.361","0.004","936.09","0.09","116","","116","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H28 N2 O2 -","- C21 H28 N2 O2 -","- C42 H56 N4 O4 -","2","1","","Hirokazu Nishimaki; Takayuki Ishida","Organic Two-Step Spin-Transition-Like Behavior in a Linear S = 1 Array: 3'-Methylbiphenyl-3,5-diyl Bis(tert-butylnitroxide) and Related Compounds","Journal of the American Chemical Society","2010","132","","9598","9599","10.1021/ja102890g","","","0.71069","MoKα","","","0.0595","","","","0.1195","","","","","","1.102","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102668","9.435","0.0002","10.4957","0.0003","11.8671","0.0006","109.61","0.002","93.87","0.003","114.433","0.005","978.27","0.08","296","","296","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H28 N2 O2 -","- C21 H28 N2 O2 -","- C42 H56 N4 O4 -","2","1","","Hirokazu Nishimaki; Takayuki Ishida","Organic Two-Step Spin-Transition-Like Behavior in a Linear S = 1 Array: 3'-Methylbiphenyl-3,5-diyl Bis(tert-butylnitroxide) and Related Compounds","Journal of the American Chemical Society","2010","132","","9598","9599","10.1021/ja102890g","","","0.71069","MoKα","","","0.0619","","","","0.1032","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102669","22.315","0.011","22.885","0.005","27.307","0.007","110.001","0.003","105.508","0.004","99.386","0.004","12118","7","80","2","80","2","","","","","","","","5","P -1","-P 1","2","","","","- C306 H304 N85 O169.9 Pd12 -","- C306 H304 N85 O169.9 Pd12 -","- C306 H304 N85 O169.9 Pd12 -","1","0.5","","Yoshihiro Yamauchi; Yuya Hanaoka; Michito Yoshizawa; Munetaka Akita; Takahiro Ichikawa; Masafumi Yoshio; Takashi Kato; Makoto Fujita","mxn Stacks of Discrete Aromatic Stacks in Solution","Journal of the American Chemical Society","2010","132","","9555","9557","10.1021/ja103180z","","","0.71073","MoKα","","0.2591","0.1102","","","0.3053","0.4019","","","","","","1.093","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102670","8.8298","0.0002","11.8871","0.0003","21.7347","0.0006","90","","90","","90","","2281.29","0.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H27 N O5 -","- C28 H27 N O5 -","- C112 H108 N4 O20 -","4","1","","Andrew T. Parsons; Austin G. Smith; Andrew J. Neel; Jeffrey S. Johnson","Dynamic Kinetic Asymmetric Synthesis of Substituted Pyrrolidines from Racemic Cyclopropanes and Aldimines: Reaction Development and Mechanistic Insights","Journal of the American Chemical Society","2010","132","","9688","9692","10.1021/ja1032277","","","1.54178","CuKα","","0.0403","0.0349","","","0.0825","0.0855","","","","","","1.088","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102671","12.5013","0.0009","6.8025","0.0005","14.8285","0.0012","90","","97.901","0.005","90","","1249.05","0.16","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H26 Br N2 O5 -","- C28 H26 Br N3 O5 -","- C56 H52 Br2 N6 O10 -","2","1","","Andrew T. Parsons; Austin G. Smith; Andrew J. Neel; Jeffrey S. Johnson","Dynamic Kinetic Asymmetric Synthesis of Substituted Pyrrolidines from Racemic Cyclopropanes and Aldimines: Reaction Development and Mechanistic Insights","Journal of the American Chemical Society","2010","132","","9688","9692","10.1021/ja1032277","","","1.54178","CuKα","","0.177","0.1302","","","0.3042","0.3356","","","","","","1.045","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102672","8.6183","0.0003","18.135","0.0007","24.038","0.001","90","","90","","90","","3757","0.3","120","","120","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36.57 H36.28 Cl F6 N4 O4.57 S -","- C36.571 H36.284 Cl F6 N4 O4.571 S -","- C146.284 H145.136 Cl4 F24 N16 O18.284 S4 -","4","1","","Ravi P. Singh; Bruce M. Foxman; Li Deng","Asymmetric Vinylogous Aldol Reaction of Silyloxy Furans with a Chiral Organic Salt","Journal of the American Chemical Society","2010","132","","9558","9560","10.1021/ja103331t","","","0.71073","MoKα","","0.0911","0.0482","","0.1057","0.0911","0.1057","","","","","","1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102673","5.3946","0.0004","7.6287","0.0005","12.9305","0.0008","90","","91.456","0.003","90","","531.97","0.06","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H9 Br O3 -","- C11 H9 Br O3 -","- C22 H18 Br2 O6 -","2","1","","Ravi P. Singh; Bruce M. Foxman; Li Deng","Asymmetric Vinylogous Aldol Reaction of Silyloxy Furans with a Chiral Organic Salt","Journal of the American Chemical Society","2010","132","","9558","9560","10.1021/ja103331t","","","0.71073","MoKα","","0.0164","0.0157","","0.04","0.0391","0.04","","","","","","1.0342","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102674","27.0052","0.0016","16.597","0.001","15.9655","0.001","90","","90.324","0.002","90","","7155.7","0.8","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39.5 H34 Cl N5 O10 -","- C39 H33 Cl N5 O10 -","- C312 H264 Cl8 N40 O80 -","8","2","","Bo Qin; Changliang Ren; Ruijuan Ye; Chang Sun; Khalid Chiad; Xiuying Chen; Zhao Li; Feng Xue; Haibin Su; Gregory A. Chass; Huaqiang Zeng","Persistently Folded Circular Aromatic Amide Pentamers Containing Modularly Tunable Cation-Binding Cavities with High Ion Selectivity","Journal of the American Chemical Society","2010","132","","9564","9566","10.1021/ja1035804","","","0.71073","MoKα","","0.1601","0.0824","","","0.2038","0.2445","","","","","","1.027","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102675","11.6218","0.0011","11.9587","0.0011","45.248","0.004","90","","95.406","0.002","90","","6260.7","1","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H83 K N6 O15 -","- C60 H79 K N6 O15 -","- C240 H316 K4 N24 O60 -","4","1","","Bo Qin; Changliang Ren; Ruijuan Ye; Chang Sun; Khalid Chiad; Xiuying Chen; Zhao Li; Feng Xue; Haibin Su; Gregory A. Chass; Huaqiang Zeng","Persistently Folded Circular Aromatic Amide Pentamers Containing Modularly Tunable Cation-Binding Cavities with High Ion Selectivity","Journal of the American Chemical Society","2010","132","","9564","9566","10.1021/ja1035804","","","0.71073","MoKα","","0.1941","0.131","","","0.2694","0.304","","","","","","1.089","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102676","18.379","0.003","18.199","0.003","22.994","0.004","90","","112.896","0.003","90","","7085","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C69.5 H99 B0 Cs N6 O14.5 -","- C69.5 H96 Cs N6 O14.5 -","- C278 H384 Cs4 N24 O58 -","4","1","","Bo Qin; Changliang Ren; Ruijuan Ye; Chang Sun; Khalid Chiad; Xiuying Chen; Zhao Li; Feng Xue; Haibin Su; Gregory A. Chass; Huaqiang Zeng","Persistently Folded Circular Aromatic Amide Pentamers Containing Modularly Tunable Cation-Binding Cavities with High Ion Selectivity","Journal of the American Chemical Society","2010","132","","9564","9566","10.1021/ja1035804","","","0.71073","MoKα","","0.1701","0.0967","","","0.2374","0.2854","","","","","","1.023","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102677","9.661","0.004","13.796","0.005","19.08","0.007","96.296","0.005","94.822","0.003","107.981","0.006","2385.5","1.6","113","2","113","2","","","","","","","","9","P -1","-P 1","2","","","","- C47 H38 B Cl3 Cu F4 N3 O P2 -","- C47 H38 B Cl3 Cu F4 N3 O P2 -","- C94 H76 B2 Cl6 Cu2 F8 N6 O2 P4 -","2","1","","Michihiro Nishikawa; Kuniharu Nomoto; Shoko Kume; Keiichi Inoue; Makoto Sakai; Masaaki Fujii; Hiroshi Nishihara","Dual Emission Caused by Ring Inversion Isomerization of a 4-Methyl-2-pyridyl-pyrimidine Copper(I) Complex","Journal of the American Chemical Society","2010","132","","9579","9581","10.1021/ja103718e","","","0.7107","MoKα","","","0.094","","","","0.2827","","","","","","1.039","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102678","14.3648","0.0008","10.2095","0.0003","25.0281","0.0012","90","","100.934","0.002","90","","3603.9","0.3","153.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H37 Cl Ir N O P2 -","- C44 H37 Cl Ir N O P2 -","- C176 H148 Cl4 Ir4 N4 O4 P8 -","4","1","","Tomohiro Iwai; Tetsuaki Fujihara; Jun Terao; Yasushi Tsuji","Iridium-Catalyzed Annulation of N-Arylcarbamoyl Chlorides with Internal Alkynes","Journal of the American Chemical Society","2010","132","","9602","9603","10.1021/ja104153k","","","0.7107","MoKα","","","0.0327","","","","0.0645","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102679","9.335","0.005","9.749","0.005","10.565","0.005","65.996","0.019","67.2","0.02","79.05","0.02","809.1","0.7","153.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H17 N O -","- C22 H17 N O -","- C44 H34 N2 O2 -","2","1","","Tomohiro Iwai; Tetsuaki Fujihara; Jun Terao; Yasushi Tsuji","Iridium-Catalyzed Annulation of N-Arylcarbamoyl Chlorides with Internal Alkynes","Journal of the American Chemical Society","2010","132","","9602","9603","10.1021/ja104153k","","","0.7107","MoKα","","","0.0656","","","","0.1732","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102680","9.177","0.002","9.864","0.002","12.207","0.003","90","","104.397","0.003","90","","1070.3","0.4","103","2","103","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H39 N O3 -","- C21 H39 N O3 -","- C42 H78 N2 O6 -","2","1","","Matthew A. Perry; Matthew D. Morin; Brian W. Slafer; Scott A. Wolckenhauer; Scott D. Rychnovsky","Fully Substituted Carbon Centers by Diastereoselective Spirocyclization: Stereoselective Synthesis of (+)-Lepadiformine C","Journal of the American Chemical Society","2010","132","","9591","9593","10.1021/ja104250b","","","0.71073","MoKα","","0.0614","0.0535","","","0.142","0.1513","","","","","","1.044","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102681","12.5919","0.0003","12.5919","0.0003","8.2015","0.0002","90","","90","","120","","1126.18","0.05","110","","110","","","","","","","","","5","P 63","P 6c","173","","","","- C3 H7 N O6 Zn -","- C3 H7 N O6 Zn -","- C18 H42 N6 O36 Zn6 -","6","1","","Guan-Cheng Xu; Xiao-Ming Ma; Li Zhang; Zhe-Ming Wang; Song Gao","Disorder-Order Ferroelectric Transition in the Metal Formate Framework of [NH4][Zn(HCOO)3]","Journal of the American Chemical Society","2010","132","","9588","9590","10.1021/ja104263m","","","0.71073","MoKα","","0.0729","0.0306","","","0.076","0.0855","","","","","","0.907","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102682","7.3084","0.0002","7.3084","0.0002","8.1705","0.0003","90","","90","","120","","377.94","0.02","290","2","290","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","","","- C3 H7 N O6 Zn -","- C3 H7.02 N O6 Zn -","- C6 H14.04 N2 O12 Zn2 -","2","0.166667","","Guan-Cheng Xu; Xiao-Ming Ma; Li Zhang; Zhe-Ming Wang; Song Gao","Disorder-Order Ferroelectric Transition in the Metal Formate Framework of [NH4][Zn(HCOO)3]","Journal of the American Chemical Society","2010","132","","9588","9590","10.1021/ja104263m","","","0.71073","MoKα","","0.022","0.0191","","","0.0444","0.0453","","","","","","1.08","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102683","8.3421","0.0005","8.7999","0.0005","22.1725","0.0012","90","","90","","90","","1627.68","0.16","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H28 N2 O -","- C19 H28 N2 O -","- C76 H112 N8 O4 -","4","1","","Brian B. Liau; Matthew D. Shair","Total Synthesis of (+)-Fastigiatine","Journal of the American Chemical Society","2010","132","","9594","9595","10.1021/ja104575h","","","0.71073","MoKα","","0.0366","0.0356","","","0.0929","0.0938","","","","","","1.059","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102684","8.6005","0.0009","11.1107","0.0009","17.6351","0.0014","93.141","0.005","94.58","0.005","111.857","0.005","1552.5","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H2 B F25 -","- C34 H2 B F25 -","- C68 H4 B2 F50 -","2","1","","Cheng Fan; Lauren G. Mercier; Warren E. Piers; Heikki M. Tuononen; Masood Parvez","Dihydrogen Activation by Antiaromatic Pentaarylboroles","Journal of the American Chemical Society","2010","132","","9604","9606","10.1021/ja105075h","","","1.54178","CuKα","","0.0626","0.0572","","","0.1704","0.1732","","","","","","1.102","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102685","10.1608","0.0001","11.1669","0.0001","34.7339","0.0005","90","","90","","90","","3941.07","0.08","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C40 H7 B Cl2 D2 F25 N -","- C40 H9 B Cl2 F25 N -","- C160 H36 B4 Cl8 F100 N4 -","4","1","","Cheng Fan; Lauren G. Mercier; Warren E. Piers; Heikki M. Tuononen; Masood Parvez","Dihydrogen Activation by Antiaromatic Pentaarylboroles","Journal of the American Chemical Society","2010","132","","9604","9606","10.1021/ja105075h","","","0.71073","MoKα","","0.0383","0.0374","","","0.1065","0.1079","","","","","","1.063","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102686","12.052","0.007","10.973","0.005","8.45","0.004","90","","110.181","0.006","90","","1048.9","0.9","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 O3 -","- C12 H16 O3 -","- C48 H64 O12 -","4","1","","Yandong Zhang; Samuel J. Danishefsky","Total Synthesis of (\±)-Aplykurodinone-1: Traceless Stereochemical Guidance","Journal of the American Chemical Society","2010","132","","9928","9928","10.1021/ja105280j","","","0.71073","MoKα","","0.1436","0.0698","","","0.1607","0.2051","","","","","","1.074","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102687","9.9972","0.0006","6.5178","0.0004","35.853","0.002","90","","92.265","0.001","90","","2334.3","0.2","125","2","125","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H40 O4 Si -","- C23 H40 O4 Si -","- C92 H160 O16 Si4 -","4","1","","Yandong Zhang; Samuel J. Danishefsky","Total Synthesis of (\±)-Aplykurodinone-1: Traceless Stereochemical Guidance","Journal of the American Chemical Society","2010","132","","9928","9928","10.1021/ja105280j","","","0.71073","MoKα","","0.0848","0.0482","","","0.1057","0.1216","","","","","","1","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102688","10.946","0.0016","15.7","0.002","10.6744","0.0016","90","","112.131","0.002","90","","1699.3","0.4","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 O3 -","- C20 H28 O3 -","- C80 H112 O12 -","4","1","","Yandong Zhang; Samuel J. Danishefsky","Total Synthesis of (\±)-Aplykurodinone-1: Traceless Stereochemical Guidance","Journal of the American Chemical Society","2010","132","","9928","9928","10.1021/ja105280j","","","0.71073","MoKα","","0.0852","0.0499","","","0.1161","0.1323","","","","","","1.031","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102689","13.9335","0.0014","6.1672","0.0006","21.725","0.002","90","","95.724","0.002","90","","1857.5","0.3","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H24 N2 O5 S -","- C19 H24 N2 O5 S -","- C76 H96 N8 O20 S4 -","4","1","","Yandong Zhang; Samuel J. Danishefsky","Total Synthesis of (\±)-Aplykurodinone-1: Traceless Stereochemical Guidance","Journal of the American Chemical Society","2010","132","","9928","9928","10.1021/ja105280j","","","0.71073","MoKα","","0.0738","0.0437","","","0.0953","0.1079","","","","","","1.016","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102690","9.304","0.006","24.02","0.015","27.949","0.018","90","","90","","90","","6246","7","283","2","283","2","","","","","","","","6","P c 21 b","P -2bc -2c","29","","","","- C61 H77 Br2 Fe N P2 -","- C61 H77 Br2 Fe N P2 -","- C244 H308 Br8 Fe4 N4 P8 -","4","1","","Yumiko Nakajima; Yoshihide Nakao; Shigeyoshi Sakaki; Yoshinori Tamada; Teruo Ono; Fumiyuki Ozawa","Electronic Structure of Four-Coordinate Iron(I) Complex Supported by a Bis(phosphaethenyl)pyridine Ligand","Journal of the American Chemical Society","2010","132","","9934","9936","10.1021/ja102009n","","","0.7107","MoKα","","0.2277","0.1064","","","0.2273","0.2968","","","","","","0.947","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102691","10.8824","0.0002","21.4579","0.0005","24.1065","0.0006","90","","90","","90","","5629.2","0.2","103","2","103","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C59 H81 Br Fe N O P2 -","- C59 H81 Br Fe N O P2 -","- C236 H324 Br4 Fe4 N4 O4 P8 -","4","1","","Yumiko Nakajima; Yoshihide Nakao; Shigeyoshi Sakaki; Yoshinori Tamada; Teruo Ono; Fumiyuki Ozawa","Electronic Structure of Four-Coordinate Iron(I) Complex Supported by a Bis(phosphaethenyl)pyridine Ligand","Journal of the American Chemical Society","2010","132","","9934","9936","10.1021/ja102009n","","","0.71069","MoKα","","0.1165","0.0615","","","0.1008","0.1179","","","","","","1.01","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102692","10.5113","0.0008","18.911","0.0019","25.711","0.002","90","","92.062","0.002","90","","5107.5","0.8","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H63 B N2 Ni O P2 -","- C58 H63 B N2 Ni O P2 -","- C232 H252 B4 N8 Ni4 O4 P8 -","4","1","","Yasuhiro Hirata; Akira Yada; Eiji Morita; Yoshiaki Nakao; Tamejiro Hiyama; Masato Ohashi; Sensuke Ogoshi","Nickel/Lewis Acid-Catalyzed Cyanoesterification and Cyanocarbamoylation of Alkynes","Journal of the American Chemical Society","2010","132","","10070","10077","10.1021/ja102346v","","","0.71075","MoKα","","0.0838","0.0425","","","0.0834","0.1039","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102693","28.054","0.002","15.6168","0.0011","22.3246","0.0016","90","","108.859","0.001","90","","9255.7","1.1","85","2","85","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C60 H40 I10 O15 Si10 -","- C60 H40 I10 O15 Si10 -","- C240 H160 I40 O60 Si40 -","4","0.5","","M. F. Roll; J. W. Kampf; Y. Kim; E. Yi; R. M. Laine","Nano Building Blocks via Iodination of [PhSiO1.5]n, Forming [p-I-C6H4SiO1.5]n (n = 8, 10, 12), and a New Route to High-Surface-Area, Thermally Stable, Microporous Materials via Thermal Elimination of I2","Journal of the American Chemical Society","2010","132","","10171","10183","10.1021/ja102453s","","","0.71073","MoKα","","0.0492","0.0461","","","0.1152","0.117","","","","","","1.058","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102694","32.082","0.009","14.704","0.004","28.755","0.008","90","","118.438","0.004","90","","11928","6","85","2","85","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C104 H88 I12 O18 Si12 -","- C104 H88 I12 O18 Si12 -","- C416 H352 I48 O72 Si48 -","4","0.5","","M. F. Roll; J. W. Kampf; Y. Kim; E. Yi; R. M. Laine","Nano Building Blocks via Iodination of [PhSiO1.5]n, Forming [p-I-C6H4SiO1.5]n (n = 8, 10, 12), and a New Route to High-Surface-Area, Thermally Stable, Microporous Materials via Thermal Elimination of I2","Journal of the American Chemical Society","2010","132","","10171","10183","10.1021/ja102453s","","","0.71073","MoKα","","0.1064","0.0919","","","0.2732","0.2885","","","","","","1.093","","","","has coordinates","178772","2020-10-21","18:00:00","" "4102695","12.5377","0.0009","24.6836","0.0017","35.061","0.002","72.706","0.0001","80.434","0.0001","81.395","0.0001","10157.9","1.2","85","2","85","2","","","","","","","","4","P -1","-P 1","2","","","","- C67 H58 O15 Si10 -","- C67 H58 O15 Si10 -","- C402 H348 O90 Si60 -","6","3","","M. F. Roll; J. W. Kampf; Y. Kim; E. Yi; R. M. Laine","Nano Building Blocks via Iodination of [PhSiO1.5]n, Forming [p-I-C6H4SiO1.5]n (n = 8, 10, 12), and a New Route to High-Surface-Area, Thermally Stable, Microporous Materials via Thermal Elimination of I2","Journal of the American Chemical Society","2010","132","","10171","10183","10.1021/ja102453s","","","0.71073","MoKα","","0.0561","0.0411","","","0.1001","0.1094","","","","","","1.014","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102696","17.158","0.002","18.8062","0.0018","20.0326","0.0019","74.075","0.003","89.79","0.004","71.856","0.003","5883.2","1.1","93.1","","93.1","","","","","","","","","7","P -1","-P 1","2","","","","- C204 H146 F24 N30 O34 Pd2 S4 -","- C204 H142 F24 N30 O34 Pd2 S4 -","- C204 H142 F24 N30 O34 Pd2 S4 -","1","0.5","","Guido H. Clever; Shohei Tashiro; Mitsuhiko Shionoya","Light-Triggered Crystallization of a Molecular Host-Guest Complex","Journal of the American Chemical Society","2010","132","","9973","9975","10.1021/ja103620z","","","0.71075","MoKα","","","0.1794","","","","0.4945","","","","","","1.269","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102697","15.3688","0.0005","23.8539","0.001","24.8502","0.001","90","","90","","90","","9110.2","0.6","123.1","","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C119 H84 Cl2 Fe2 N6 O4 -","- C119 H84 Cl2 Fe2 N6 O4 -","- C476 H336 Cl8 Fe8 N24 O16 -","4","1","","Tatsuhiko Honda; Tatsuaki Nakanishi; Kei Ohkubo; Takahiko Kojima; Shunichi Fukuzumi","Structure and Photoinduced Electron Transfer Dynamics of a Series of Hydrogen-Bonded Supramolecular Complexes Composed of Electron Donors and a Saddle-Distorted Diprotonated Porphyrin","Journal of the American Chemical Society","2010","132","","10155","10163","10.1021/ja103889f","","","0.7107","MoKα","","","0.0693","","","","0.1922","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102698","20.81","0.004","9.6243","0.0019","33.923","0.007","90","","104.28","0.03","90","","6584","2","133","2","133","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H40 F6 N2 Si -","- C35 H40 F6 N2 Si -","- C280 H320 F48 N16 Si8 -","8","1","","Anukul Jana; Prinson P. Samuel; Gašper Tavčar; Herbert W. Roesky; Carola Schulzke","Selective Aromatic C-F and C-H Bond Activation with Silylenes of Different Coordinate Silicon","Journal of the American Chemical Society","2010","132","","10164","10170","10.1021/ja103988d","","","0.71073","MoKα","","0.0515","0.035","","","0.0772","0.0818","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102699","9.785","0.002","9.976","0.002","13.842","0.003","89.57","0.03","82.58","0.03","89.18","0.03","1339.7","0.5","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H23 Cl F8 N2 Si -","- C22 H23 Cl F8 N2 Si -","- C44 H46 Cl2 F16 N4 Si2 -","2","1","","Anukul Jana; Prinson P. Samuel; Gašper Tavčar; Herbert W. Roesky; Carola Schulzke","Selective Aromatic C-F and C-H Bond Activation with Silylenes of Different Coordinate Silicon","Journal of the American Chemical Society","2010","132","","10164","10170","10.1021/ja103988d","","","0.71073","MoKα","","0.1125","0.0832","","","0.221","0.2396","","","","","","1.038","","","","has coordinates,has disorder","178772","2020-10-21","18:00:00","" "4102700","9.832","0.002","10.142","0.002","14.53","0.003","88.37","0.03","88.69","0.03","71.03","0.03","1369.5","0.5","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H31 Cl F5 N3 Si -","- C27 H31 Cl F5 N3 Si -","- C54 H62 Cl2 F10 N6 Si2 -","2","1","","Anukul Jana; Prinson P. Samuel; Gašper Tavčar; Herbert W. Roesky; Carola Schulzke","Selective Aromatic C-F and C-H Bond Activation with Silylenes of Different Coordinate Silicon","Journal of the American Chemical Society","2010","132","","10164","10170","10.1021/ja103988d","","","0.71073","MoKα","","0.0803","0.055","","","0.1416","0.1493","","","","","","1.065","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102701","9.5252","0.0019","17.166","0.003","10.174","0.002","90","","93.36","0.03","90","","1660.7","0.6","133","2","133","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C35 H41 F5 N2 Si -","- C35 H41 F5 N2 Si -","- C70 H82 F10 N4 Si2 -","2","1","","Anukul Jana; Prinson P. Samuel; Gašper Tavčar; Herbert W. Roesky; Carola Schulzke","Selective Aromatic C-F and C-H Bond Activation with Silylenes of Different Coordinate Silicon","Journal of the American Chemical Society","2010","132","","10164","10170","10.1021/ja103988d","","","0.71073","MoKα","","0.0482","0.0432","","","0.1062","0.1087","","","","","","1.072","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102702","3.8197","0.0001","3.8197","0.0001","6.2587","0.0002","90","","90","","90","","91.315","0.004","250","2","250","2","","","","","","","","2","P 4/n m m :2","-P 4a 2a","129","Iron Telluride","Iron Telluride","","- Fe1.12 Te -","- Fe1.119 Te -","- Fe2.238 Te2 -","2","0.125","","Efrain E. Rodriguez; Peter Zavalij; Ping-Yen Hsieh; Mark A. Green","Iodine as an Oxidant in the Topotactic Deintercalation of Interstitial Iron in Fe1+xTe","Journal of the American Chemical Society","2010","132","","10006","10008","10.1021/ja104004t","","","0.71073","MoKα","","0.0092","0.0092","","","0.0217","0.0217","","","","","","1.001","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102703","3.8139","0.0003","3.8139","0.0003","6.2631","0.0009","90","","90","","90","","91.102","0.017","250","2","250","2","","","","","","","","2","P 4/n m m :2","-P 4a 2a","129","Iron telluride","Iron telluride","","- Fe1.095 Te -","- Fe1.095 Te -","- Fe2.19 Te2 -","2","0.125","","Efrain E. Rodriguez; Peter Zavalij; Ping-Yen Hsieh; Mark A. Green","Iodine as an Oxidant in the Topotactic Deintercalation of Interstitial Iron in Fe1+xTe","Journal of the American Chemical Society","2010","132","","10006","10008","10.1021/ja104004t","","","0.71073","MoKα","","0.0117","0.0117","","","0.0258","0.0258","","","","","","1","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102704","32.472","0.002","6.2695","0.0007","36.429","0.002","90","","95.889","0.002","90","","7377.2","1","153","2","153","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C39 H36 Ag Cl N2 S4 -","- C39 H36 Ag Cl N2 S4 -","- C312 H288 Ag8 Cl8 N16 S32 -","8","1","","Adam B. Powell; Christopher W. Bielawski; Alan H. Cowley","Design, Synthesis, and Study of Main Chain Poly(N-Heterocyclic Carbene) Complexes: Applications in Electrochromic Devices","Journal of the American Chemical Society","2010","132","","10184","10194","10.1021/ja104051x","","","0.71069","MoKα","","0.1067","0.0593","","","0.1258","0.1431","","","","","","1.226","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102705","11.495","0.003","13.381","0.003","14.703","0.004","103.717","0.005","92.327","0.006","101.007","0.006","2147.9","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H47 Ag N2 O3 S4 -","- C41 H39 Ag N2 O2 S4 -","- C82 H78 Ag2 N4 O4 S8 -","2","1","","Adam B. Powell; Christopher W. Bielawski; Alan H. Cowley","Design, Synthesis, and Study of Main Chain Poly(N-Heterocyclic Carbene) Complexes: Applications in Electrochromic Devices","Journal of the American Chemical Society","2010","132","","10184","10194","10.1021/ja104051x","","","0.71069","MoKα","","0.0983","0.0756","","","0.1838","0.1986","","","","","","1.16","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102706","14.114","0.003","26.755","0.006","10.005","0.002","90","","107.286","0.006","90","","3607.4","1.3","233","2","233","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H36 N2 S5 -","- C39 H36 N2 S5 -","- C156 H144 N8 S20 -","4","1","","Adam B. Powell; Christopher W. Bielawski; Alan H. Cowley","Design, Synthesis, and Study of Main Chain Poly(N-Heterocyclic Carbene) Complexes: Applications in Electrochromic Devices","Journal of the American Chemical Society","2010","132","","10184","10194","10.1021/ja104051x","","","0.71069","MoKα","","0.1361","0.0678","","","0.1364","0.1622","","","","","","1.098","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102707","11.4299","0.0009","12.082","0.001","15.5","0.0013","106.613","0.001","100.313","0.002","90.68","0.002","2013.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H59 Cl2 N3 Si -","- C44 H59 Cl2 N3 Si -","- C88 H118 Cl4 N6 Si2 -","2","1","","Rajendra S. Ghadwal; Herbert W. Roesky; Markus Granitzka; Dietmar Stalke","A Facile Route to Functionalized N-Heterocyclic Carbenes (NHCs) with NHC Base-Stabilized Dichlorosilylene","Journal of the American Chemical Society","2010","132","","10018","10020","10.1021/ja104386g","","","0.71073","MoKα","","0.0538","0.0378","","","0.0843","0.0918","","","","","","1.018","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102708","11.9004","0.0015","15.3835","0.0019","15.9396","0.0019","76.172","0.002","73.774","0.002","69.913","0.002","2598.1","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C57.5 H77.25 Cl2 N6 Si -","- C57.5 H77.16 Cl2 N6 Si -","- C115 H154.32 Cl4 N12 Si2 -","2","1","","Rajendra S. Ghadwal; Herbert W. Roesky; Markus Granitzka; Dietmar Stalke","A Facile Route to Functionalized N-Heterocyclic Carbenes (NHCs) with NHC Base-Stabilized Dichlorosilylene","Journal of the American Chemical Society","2010","132","","10018","10020","10.1021/ja104386g","","","0.71073","MoKα","","0.1069","0.0615","","","0.1409","0.1631","","","","","","1.031","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102709","7.794","0.003","21.889","0.007","8.579","0.003","90","","92.618","0.006","90","","1462.1","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H18 B10 O -","- C9 H18 B10 O -","- C36 H72 B40 O4 -","4","1","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0824","0.0589","","","0.1653","0.1903","","","","","","1.078","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102710","7.8439","0.0007","9.9497","0.0009","11.2367","0.0011","101.613","0.002","108.27","0.002","100.565","0.002","786.55","0.13","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H20 B10 O -","- C10 H20 B10 O -","- C20 H40 B20 O2 -","2","1","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0495","0.0453","","","0.1289","0.1341","","","","","","1.066","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102711","6.9769","0.0002","12.9283","0.0004","17.4054","0.0005","90","","94.134","0.001","90","","1565.87","0.08","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H20 B10 O -","- C10 H20 B10 O -","- C40 H80 B40 O4 -","4","1","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0555","0.0486","","","0.1501","0.1651","","","","","","1.07","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102712","14.6074","0.0011","18.193","0.0014","14.4027","0.001","90","","97.537","0.001","90","","3794.5","0.5","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H26 B10 O -","- C13 H26 B10 O -","- C104 H208 B80 O8 -","8","1","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0842","0.0618","","","0.1779","0.2061","","","","","","1.023","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102713","9.776","0.002","12.704","0.003","21.986","0.005","90","","90","","90","","2730.5","1.1","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C9 H18 B10 -","- C9 H18 B10 -","- C72 H144 B80 -","8","1","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0902","0.0636","","","0.1623","0.191","","","","","","1.039","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102714","6.9669","0.0003","12.1166","0.0006","9.4462","0.0004","90","","90.395","0.001","90","","797.38","0.06","296","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C11 H22 B10 O -","- C11 H22 B10 O -","- C22 H44 B20 O2 -","2","0.5","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0627","0.0525","","","0.1544","0.1662","","","","","","1.044","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102715","32.546","0.003","6.9766","0.0006","11.6982","0.001","90","","90","","90","","2656.2","0.4","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C8 H16 B10 O -","- C8 H16 B10 O -","- C64 H128 B80 O8 -","8","2","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.1238","0.087","","","0.2239","0.2611","","","","","","1.027","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102716","18.488","0.002","6.9305","0.0007","22.339","0.003","90","","91.126","0.002","90","","2861.8","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H18 B10 O -","- C9 H18 B10 O -","- C72 H144 B80 O8 -","8","2","","Sunewang R. Wang; Zaozao Qiu; Zuowei Xie","Insertion of Carboryne into Aromatic Rings: Formation of Cyclooctatetraenocarboranes","Journal of the American Chemical Society","2010","132","","9988","9989","10.1021/ja1044488","","","0.71073","MoKα","","0.0933","0.0851","","","0.2574","0.265","","","","","","1.117","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102717","10.9774","0.0004","19.1174","0.0006","27.1633","0.001","90","","90","","90","","5700.5","0.3","100","2","100","2","","","","","","","","8","P c c n","-P 2ab 2ac","56","2.2MeOH.Et2O","Bis{η^3^-μ~3~-1,3-bis[(2-pyridyl-1κN)methyl]- 1H-imidazol-2-ylidene-2κC}bis(methanol-1κO)dicopper(I) gold(I) 2(AuCu) tris(hexafluorophosphate) methanol disolvate (diethyl ether) disolvate","","- C42 H64 Au Cu2 F18 N8 O6 P3 -","- C42 H64 Au Cu2 F18 N8 O6 P3 -","- C168 H256 Au4 Cu8 F72 N32 O24 P12 -","4","0.5","","Christoph E. Strasser; Vincent J. Catalano","""On-Off"" Au(I)...Cu(I) Interactions in a Au(NHC)2 Luminescent Vapochromic Sensor","Journal of the American Chemical Society","2010","132","","10009","10011","10.1021/ja104585q","","","0.71073","MoKα","","0.072","0.0388","","","0.082","0.0964","","","","","","1.03","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102718","11.9958","0.0002","19.8135","0.0005","12.3023","0.0002","90","","106.354","0.001","90","","2805.69","0.1","100","2","100","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","1.2AN","Tetrakis(acetonitrile-1κN)bis{η^3^-μ~3~-1,3-bis[(2-pyridyl-1κN)methyl]- 1H-imidazol-2-ylidene-2κC}dicopper(I) gold(I) tris(hexafluorophosphate) acetonitrile disolvate","","- C42 H46 Au Cu2 F18 N14 P3 -","- C42 H46 Au Cu2 F18 N14 P3 -","- C84 H92 Au2 Cu4 F36 N28 P6 -","2","0.5","","Christoph E. Strasser; Vincent J. Catalano","""On-Off"" Au(I)...Cu(I) Interactions in a Au(NHC)2 Luminescent Vapochromic Sensor","Journal of the American Chemical Society","2010","132","","10009","10011","10.1021/ja104585q","","","0.71073","MoKα","","0.0565","0.041","","","0.1023","0.1104","","","","","","1.04","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102719","11.59","0.002","11.98","0.002","15.519","0.003","68.36","0.003","70.878","0.003","73.439","0.003","1859","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","(Ar[Np]N)2(k2-CH2CMe2CH2NAr)TaH","","","- C39 H60 N3 Ta -","- C39 H60 N3 Ta -","- C78 H120 N6 Ta2 -","2","1","","Matthew A. Rankin; Christopher C. Cummins","Carbon Dioxide Reduction by Terminal Tantalum Hydrides: Formation and Isolation of Bridging Methylene Diolate Complexes","Journal of the American Chemical Society","2010","132","","10021","10023","10.1021/ja104761n","","","0.71073","MoKα","","0.0402","0.0331","","","0.0763","0.0795","","","","","","1.044","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102720","11.032","0.0008","11.1702","0.0008","17.121","0.0012","79.09","0.001","85.127","0.001","66.34","0.001","1897.4","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","(Ar[Np]N)2(eta2-tBuC(H)NAr)TaH","","","- C39 H60 N3 Ta -","- C39 H60 N3 Ta -","- C78 H120 N6 Ta2 -","2","1","","Matthew A. Rankin; Christopher C. Cummins","Carbon Dioxide Reduction by Terminal Tantalum Hydrides: Formation and Isolation of Bridging Methylene Diolate Complexes","Journal of the American Chemical Society","2010","132","","10021","10023","10.1021/ja104761n","","","0.71073","MoKα","","0.0207","0.0192","","","0.0469","0.0477","","","","","","1.068","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102721","18.7446","0.0014","38.429","0.003","12.6441","0.0009","90","","104.354","0.001","90","","8823.7","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Ar[Np]N)2(tBuC(H)NAr)TaOCH2OTi(N[tBu]Ar)3","","","- C88.5 H145 N6 O2 Ta Ti -","- C78.5 H121 N6 O2 Ta Ti -","- C314 H484 N24 O8 Ta4 Ti4 -","4","1","","Matthew A. Rankin; Christopher C. Cummins","Carbon Dioxide Reduction by Terminal Tantalum Hydrides: Formation and Isolation of Bridging Methylene Diolate Complexes","Journal of the American Chemical Society","2010","132","","10021","10023","10.1021/ja104761n","","","0.71073","MoKα","","0.0597","0.05","","","0.1097","0.1129","","","","","","1.174","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102722","11.568","0.004","11.803","0.004","16.103","0.005","70.272","0.005","69.376","0.005","73.329","0.005","1901.4","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[(Ar[Np]N)2(k2-CH2C(Me)2CH2NAr)Ta]2(OCH2O)","","","- C79 H120 N6 O2 Ta2 -","- C79 H120 N6 O2 Ta2 -","- C79 H120 N6 O2 Ta2 -","1","0.5","","Matthew A. Rankin; Christopher C. Cummins","Carbon Dioxide Reduction by Terminal Tantalum Hydrides: Formation and Isolation of Bridging Methylene Diolate Complexes","Journal of the American Chemical Society","2010","132","","10021","10023","10.1021/ja104761n","","","0.71073","MoKα","","0.0854","0.0613","","","0.1438","0.1587","","","","","","1.016","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102723","10.7775","0.0012","13.8137","0.0015","15.7172","0.0017","86.206","0.002","72.564","0.002","77.292","0.002","2177.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(Ar[CH2tBu]N)2(C(H)tBuNAr)TaOC(H)NtBu","","","- C44 H69 N4 O Ta -","- C44 H69 N4 O Ta -","- C88 H138 N8 O2 Ta2 -","2","1","","Matthew A. Rankin; Christopher C. Cummins","Carbon Dioxide Reduction by Terminal Tantalum Hydrides: Formation and Isolation of Bridging Methylene Diolate Complexes","Journal of the American Chemical Society","2010","132","","10021","10023","10.1021/ja104761n","","","0.71073","MoKα","","0.0284","0.024","","","0.0549","0.0574","","","","","","1.053","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102724","15.3854","0.001","16.3025","0.0011","19.3888","0.0013","105.013","0.001","104.938","0.001","100.622","0.001","4371","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(Ar[CH2tBu]N)2(eta2-ArNCHtBu)TaOCH2OtBu","","","- C44 H70 N3 O2 Ta -","- C44 H70 N3 O2 Ta -","- C176 H280 N12 O8 Ta4 -","4","2","","Matthew A. Rankin; Christopher C. Cummins","Carbon Dioxide Reduction by Terminal Tantalum Hydrides: Formation and Isolation of Bridging Methylene Diolate Complexes","Journal of the American Chemical Society","2010","132","","10021","10023","10.1021/ja104761n","","","0.71073","MoKα","","0.0748","0.0426","","","0.0781","0.0919","","","","","","1.031","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102725","15.6211","0.0015","16.9965","0.0016","18.8231","0.0017","98.56","0.002","108.486","0.002","95.273","0.002","4635.1","0.8","153","2","123","2","","","","","","","","8","P -1","-P 1","2","","","","- C94.5 H88 Cl8 F6 N8 O1.5 P Ru -","- C94.576 H92 Cl7.848 F6 N8 O1.576 P Ru -","- C189.152 H184 Cl15.696 F12 N16 O3.152 P2 Ru2 -","2","1","","Shigeru Yamaguchi; Hiroshi Shinokubo; Atsuhiro Osuka","η2-Porphyrin Ru(II) π Complexes","Journal of the American Chemical Society","2010","132","","9992","9993","10.1021/ja104842h","","","0.71073","MoKα","","0.0931","0.0814","","","0.232","0.2459","","","","","","1.048","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102726","16.015","0.005","16.55","0.005","20.775","0.005","66.592","0.005","71.642","0.005","75.795","0.005","4750","2","90","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C99 H108 Cl3 N7 O4 Ru -","- C99 H108 Cl3 N7 O4 Ru -","- C198 H216 Cl6 N14 O8 Ru2 -","2","1","","Shigeru Yamaguchi; Hiroshi Shinokubo; Atsuhiro Osuka","η2-Porphyrin Ru(II) π Complexes","Journal of the American Chemical Society","2010","132","","9992","9993","10.1021/ja104842h","","","0.71069","MoKα","","0.117","0.0902","","","0.2264","0.2467","","","","","","1.113","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102727","26.376","0.003","7.7075","0.0008","19.705","0.002","90","","99.155","0.002","90","","3954.9","0.7","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Fe2 S -","- C24 H22 Fe2 S -","- C192 H176 Fe16 S8 -","8","1","","Yu Li; Mira Josowicz; Laren M. Tolbert","Diferrocenyl Molecular Wires. The Role of Heteroatom Linkers","Journal of the American Chemical Society","2010","132","","10374","10382","10.1021/ja101585z","","","0.71073","MoKα","","0.044","0.0367","","","0.0881","0.0925","","","","","","1.044","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102728","7.519","0.003","23.234","0.009","28.731","0.011","90","","90","","90","","5019","3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H27 Fe2 P S -","- C30 H27 Fe2 P S -","- C240 H216 Fe16 P8 S8 -","8","2","","Yu Li; Mira Josowicz; Laren M. Tolbert","Diferrocenyl Molecular Wires. The Role of Heteroatom Linkers","Journal of the American Chemical Society","2010","132","","10374","10382","10.1021/ja101585z","","","0.71073","MoKα","","0.1073","0.0943","","","0.2066","0.2146","","","","","","1.041","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102729","4.755","0.0013","36.91","0.01","7.954","0.002","90","0.004","105.846","0.004","90","0.004","1342.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","C6-BDTEs","C6-BDTEs","","- C28 H30 N2 O4 S2 -","- C28 H30 N2 O4 S2 -","- C56 H60 N4 O8 S4 -","2","0.5","","Yuki Suzuki; Eigo Miyazaki; Kazuo Takimiya","((Alkyloxy)carbonyl)cyanomethylene-Substituted Thienoquinoidal Compounds: a New Class of Soluble n-Channel Organic Semiconductors for Air-Stable Organic Field-Effect Transistors","Journal of the American Chemical Society","2010","132","","10453","10466","10.1021/ja103171y","","","0.7107","MoKα","","0.1328","0.0816","","","0.2061","0.2409","","","","","","0.998","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102730","19.87","0.005","15.248","0.005","15.184","0.005","90","0.005","106.185","0.005","90","0.005","4418","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H50 F12 N6 P2 -","- C45 H50 F12 N6 P2 -","- C180 H200 F48 N24 P8 -","4","0.5","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71069","MoKα","","0.1223","0.0769","","","0.176","0.1976","","","","","","1.016","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102731","8.11","0.008","23.628","0.01","15.194","0.007","90","","99.38","0.05","90","","2873","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 F12 N4 P2 -","- C26 H30 F12 N4 P2 -","- C104 H120 F48 N16 P8 -","4","1","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71073","MoKα","","0.1044","0.0477","","","0.0647","0.0708","","","","","","0.82","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102732","8.6232","0.0004","11.1678","0.0007","19.3842","0.0011","92.748","0.005","93.376","0.004","90.305","0.004","1861.3","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H41 N3 O6 S2 -","- C44 H41 N3 O6 S2 -","- C88 H82 N6 O12 S4 -","2","1","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71073","MoKα","","0.0751","0.0408","","","0.0901","0.1022","","","","","","0.946","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102733","8.3822","0.0004","11.8966","0.0006","16.7255","0.0008","97.812","0.004","99.103","0.004","104.236","0.004","1569.42","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H35 F12 N3 O P2 -","- C29 H35 F12 N3 O P2 -","- C58 H70 F24 N6 O2 P4 -","2","1","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71073","MoKα","","0.0758","0.0405","","","0.093","0.1064","","","","","","0.947","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102734","7.886","0.001","8.897","0.001","25.061","0.003","84.486","0.011","86.213","0.011","65.61","0.016","1593.3","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H34 F12 N4 P2 -","- C30 H34 F12 N4 P2 -","- C60 H68 F24 N8 P4 -","2","1","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71069","MoKα","","0.151","0.049","","","0.0615","0.0782","","","","","","0.785","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102735","18.315","0.002","16.102","0.001","15.462","0.001","90","","103.33","0.01","90","","4437","0.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H48 F6 N6 O6 S2 -","- C46 H48 F6 N6 O6 S2 -","- C184 H192 F24 N24 O24 S8 -","4","0.5","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71073","MoKα","","0.1431","0.1053","","","0.2963","0.3305","","","","","","1.27","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102736","10.31","0.004","35.917","0.014","12.402","0.005","90","","90","","90","","4593","3","100","2","100","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C53 H54 N4 O8 S2 -","- C53 H54 N4 O8 S2 -","- C212 H216 N16 O32 S8 -","4","","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.71073","MoKα","","0.1239","0.0995","","","0.2342","0.2494","","","","","","1.091","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102737","10.055","0.005","12.875","0.007","37.899","0.019","90","","90","","90","","4906","4","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C57 H58 N4 O8 S2 -","- C57 H58 N4 O8 S2 -","- C228 H232 N16 O32 S8 -","4","0.5","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.6933","synchrotron","","0.137","0.1143","","","0.2491","0.2598","","","","","","1.131","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102738","33.971","0.003","8.5208","0.0009","20.299","0.002","90","","124.043","0.001","90","","4868.8","0.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H60 F12 N4 O2 P2 -","- C51 H60 F12 N4 O2 P2 -","- C204 H240 F48 N16 O8 P8 -","4","0.5","","Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna","Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability","Journal of the American Chemical Society","2010","132","","10498","10512","10.1021/ja103289a","","","0.6933","synchrotron","","0.0677","0.0447","","","0.109","0.1208","","","","","","1.027","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102739","25.1611","0.0005","12.70129","0.00013","11.60014","0.00008","90","","90","","90","","3707.15","0.09","","","","","","","","","","","","3","P m m m","-P 2 2","47","","","","- Ge0.74 O5.57 Si1.76 -","- Ge0.743167 O5.57217 Si1.75683 -","- Ge17.836 O133.732 Si42.164 -","24","3","","Mathias Dodin; Jean-Louis Paillaud; Yannnick Lorgouilloux; Philippe Caullet; Erik Elkaïm; Nicolas Bats","A Zeolitic Material with a Three-Dimensional Pore System Formed by Straight 12- and 10-Ring Channels Synthesized with an Imidazolium Derivative as Structure-Directing Agent","Journal of the American Chemical Society","2010","132","","10221","10223","10.1021/ja103648k","powder diffraction","x-ray","0.7294","","","","","","","","","0.10927","","1.03","","","","","","","has coordinates,has Fobs","178773","2020-10-21","18:00:00","" "4102740","10.9272","0.0002","18.3875","0.0004","17.9123","0.0004","90","","92.9509","0.0011","90","","3594.24","0.13","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ti(N2NMe)(NNPh2)(bipy)","","- C33 H47 N7 Si2 Ti -","- C33 H47 N7 Si2 Ti -","- C132 H188 N28 Si8 Ti4 -","4","1","","A. Daniel Schofield; Ainara Nova; Jonathan D. Selby; Catherine D. Manley; Andrew D. Schwarz; Eric Clot; Philip Mountford","M=Nα Cycloaddition and Nα-Nβ Insertion in the Reactions of Titanium Hydrazido Compounds with Alkynes: A Combined Experimental and Computational Study","Journal of the American Chemical Society","2010","132","","10484","10497","10.1021/ja1036513","","","0.71073","MoKα","","0.083","0.0596","","0.0615","0.0556","0.0551","","","","","","1.1137","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102741","14.7234","0.0002","16.5773","0.0002","20.6285","0.0003","103.846","0.0004","94.6175","0.0005","115.87","0.0005","4298.99","0.1","150","","150","","","","","","","","","6","P -1","-P 1","2","","Ti(N2Npy){N(NPh2)C(Me)C(C6F5)}","","- C36 H42 F5 N5 Si2 Ti -","- C36 H42 F5 N5 Si2 Ti -","- C144 H168 F20 N20 Si8 Ti4 -","4","2","","A. Daniel Schofield; Ainara Nova; Jonathan D. Selby; Catherine D. Manley; Andrew D. Schwarz; Eric Clot; Philip Mountford","M=Nα Cycloaddition and Nα-Nβ Insertion in the Reactions of Titanium Hydrazido Compounds with Alkynes: A Combined Experimental and Computational Study","Journal of the American Chemical Society","2010","132","","10484","10497","10.1021/ja1036513","","","0.71073","MoKα","","0.0728","0.0515","","0.0594","0.0484","0.046","","","","","","1.1066","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102742","39.2342","0.001","10.6636","0.0003","20.7574","0.0006","90","","102.084","0.0015","90","","8492","0.4","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Ti(N2Npy){NC(Ph)C(Me)NPh2}(py). 0.5(Et2O)","","- C43 H57 N6 O0.5 Si2 Ti -","- C43 H57 N6 O0.5 Si2 Ti -","- C344 H456 N48 O4 Si16 Ti8 -","8","1","","A. Daniel Schofield; Ainara Nova; Jonathan D. Selby; Catherine D. Manley; Andrew D. Schwarz; Eric Clot; Philip Mountford","M=Nα Cycloaddition and Nα-Nβ Insertion in the Reactions of Titanium Hydrazido Compounds with Alkynes: A Combined Experimental and Computational Study","Journal of the American Chemical Society","2010","132","","10484","10497","10.1021/ja1036513","","","0.71073","MoKα","","0.0847","0.0437","","0.0555","0.0431","0.0431","","","","","","1.1169","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102743","10.191","0.0001","19.6879","0.0002","38.0089","0.0004","90","","92.0565","0.0004","90","","7621.17","0.13","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ti(N2NMe){NC(Ph)C(Me)NPh2}(py)","","- C37 H52 N6 Si2 Ti -","- C37 H52 N6 Si2 Ti -","- C296 H416 N48 Si16 Ti8 -","8","2","","A. Daniel Schofield; Ainara Nova; Jonathan D. Selby; Catherine D. Manley; Andrew D. Schwarz; Eric Clot; Philip Mountford","M=Nα Cycloaddition and Nα-Nβ Insertion in the Reactions of Titanium Hydrazido Compounds with Alkynes: A Combined Experimental and Computational Study","Journal of the American Chemical Society","2010","132","","10484","10497","10.1021/ja1036513","","","0.71073","MoKα","","0.1262","0.0397","","0.1081","0.0443","0.0443","","","","","","1.14","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102744","5.0929","0.0002","7.3053","0.0003","7.6069","0.0004","108.797","0.0019","98.662","0.002","108.823","0.002","243.14","0.02","150","","150","","","","","","","","","3","P -1","-P 1","2","","MeCC(2,3,5,6-C6F4)CCMe","","- C12 H6 F4 -","- C12 H6 F4 -","- C12 H6 F4 -","1","0.5","","A. Daniel Schofield; Ainara Nova; Jonathan D. Selby; Catherine D. Manley; Andrew D. Schwarz; Eric Clot; Philip Mountford","M=Nα Cycloaddition and Nα-Nβ Insertion in the Reactions of Titanium Hydrazido Compounds with Alkynes: A Combined Experimental and Computational Study","Journal of the American Chemical Society","2010","132","","10484","10497","10.1021/ja1036513","","","0.71073","MoKα","","0.056","0.053","","0.065","0.0617","0.0609","","","","","","1.0765","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102745","10.0757","0.0001","12.3241","0.0002","16.9363","0.0002","82.9647","0.0005","73.1733","0.0005","66.2377","0.0006","1842.31","0.04","150","","150","","","","","","","","","6","P -1","-P 1","2","","[Ti(N2NMe){NCC(Me)NPh2}(py)]2(m-2,3,5,6-C6F4)","","- C68 H94 F4 N12 Si4 Ti2 -","- C68 H94 F4 N12 Si4 Ti2 -","- C68 H94 F4 N12 Si4 Ti2 -","1","0.5","","A. Daniel Schofield; Ainara Nova; Jonathan D. Selby; Catherine D. Manley; Andrew D. Schwarz; Eric Clot; Philip Mountford","M=Nα Cycloaddition and Nα-Nβ Insertion in the Reactions of Titanium Hydrazido Compounds with Alkynes: A Combined Experimental and Computational Study","Journal of the American Chemical Society","2010","132","","10484","10497","10.1021/ja1036513","","","0.71073","MoKα","","0.064","0.0475","","0.0575","0.0483","0.0475","","","","","","1.1088","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102746","8.5073","0.0011","10.3194","0.0011","19.4459","0.0017","90","","95.118","0.004","90","","1700.4","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H52 Hf2 N2 O2 -","- C38 H52 Hf2 N2 O2 -","- C76 H104 Hf4 N4 O4 -","2","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Carbon Monoxide-Induced Dinitrogen Cleavage with Group 4 Metallocenes: Reaction Scope and Coupling to N-H Bond Formation and CO Deoxygenation","Journal of the American Chemical Society","2010","132","","10553","10564","10.1021/ja104025v","","","0.71073","MoKα","","0.0427","0.0373","","","0.0803","0.0833","","","","","","0.999","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102747","32.636","0.0013","9.5086","0.0004","21.5096","0.001","90","","97.426","0.002","90","","6618.9","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H52 Hf2 N2 O -","- C37 H52 Hf2 N2 O -","- C296 H416 Hf16 N16 O8 -","8","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Carbon Monoxide-Induced Dinitrogen Cleavage with Group 4 Metallocenes: Reaction Scope and Coupling to N-H Bond Formation and CO Deoxygenation","Journal of the American Chemical Society","2010","132","","10553","10564","10.1021/ja104025v","","","0.71073","MoKα","","0.053","0.0331","","","0.0643","0.0719","","","","","","1.019","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102748","9.2673","0.0007","41.759","0.003","9.3478","0.0007","90","","110.989","0.004","90","","3377.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H54 Hf2 N2 O -","- C37 H54 Hf2 N2 O -","- C148 H216 Hf8 N8 O4 -","4","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Carbon Monoxide-Induced Dinitrogen Cleavage with Group 4 Metallocenes: Reaction Scope and Coupling to N-H Bond Formation and CO Deoxygenation","Journal of the American Chemical Society","2010","132","","10553","10564","10.1021/ja104025v","","","0.71073","MoKα","","0.0358","0.031","","","0.088","0.0908","","","","","","1.015","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102749","10.9609","0.0006","13.9203","0.0007","16.4943","0.0009","66.975","0.002","79.535","0.002","68.141","0.002","2147.8","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C89 H131 Hf4 N4 O2 Si4 -","- C89 H131 Hf4 N4 O2 Si4 -","- C89 H131 Hf4 N4 O2 Si4 -","1","0.5","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Carbon Monoxide-Induced Dinitrogen Cleavage with Group 4 Metallocenes: Reaction Scope and Coupling to N-H Bond Formation and CO Deoxygenation","Journal of the American Chemical Society","2010","132","","10553","10564","10.1021/ja104025v","","","0.71073","MoKα","","0.0562","0.0296","","","0.0502","0.0566","","","","","","1.013","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102750","10.9031","0.0012","13.796","0.0016","16.365","0.002","68.06","0.004","80.456","0.006","69.609","0.005","2138.5","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C89 H131 N4 O2 Si4 Zr4 -","- C89 H131 N4 O2 Si4 Zr4 -","- C89 H131 N4 O2 Si4 Zr4 -","1","0.5","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Carbon Monoxide-Induced Dinitrogen Cleavage with Group 4 Metallocenes: Reaction Scope and Coupling to N-H Bond Formation and CO Deoxygenation","Journal of the American Chemical Society","2010","132","","10553","10564","10.1021/ja104025v","","","0.71073","MoKα","","0.1629","0.0662","","","0.1512","0.2008","","","","","","0.989","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102751","11.1183","0.0005","13.6916","0.0006","16.4937","0.0007","65.722","0.002","84.756","0.002","71.372","0.002","2166.52","0.17","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H61 Hf2 N O2 Si2 -","- C41 H61 Hf2 N O2 Si2 -","- C82 H122 Hf4 N2 O4 Si4 -","2","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Carbon Monoxide-Induced Dinitrogen Cleavage with Group 4 Metallocenes: Reaction Scope and Coupling to N-H Bond Formation and CO Deoxygenation","Journal of the American Chemical Society","2010","132","","10553","10564","10.1021/ja104025v","","","0.71073","MoKα","","0.0369","0.028","","","0.0675","0.071","","","","","","1.073","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102752","7.5272","0.0004","15.9463","0.0008","13.2915","0.0006","90","","100.104","0.003","90","","1570.65","0.14","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 O4 -","- C18 H24 O4 -","- C72 H96 O16 -","4","1","","Yu-Jun Zhao; Bin Li; Li-Jun Serena Tan; Zhi-Liang Shen; Teck-Peng Loh","Enantioselective Cationic Polyene Cyclization vs Enantioselective Intramolecular Carbonyl-Ene Reaction","Journal of the American Chemical Society","2010","132","","10242","10244","10.1021/ja104119j","","","0.71073","MoKα","","0.1371","0.1134","","","0.3115","0.3723","","","","","","1.45","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102753","6.6693","0.0002","7.8743","0.0004","30.0251","0.0012","90","","90","","90","","1576.8","0.11","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 Cl O2 -","- C18 H25 Cl O2 -","- C72 H100 Cl4 O8 -","4","1","","Yu-Jun Zhao; Bin Li; Li-Jun Serena Tan; Zhi-Liang Shen; Teck-Peng Loh","Enantioselective Cationic Polyene Cyclization vs Enantioselective Intramolecular Carbonyl-Ene Reaction","Journal of the American Chemical Society","2010","132","","10242","10244","10.1021/ja104119j","","","0.71073","MoKα","","0.0447","0.0373","","","0.0916","0.1043","","","","","","1.087","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102754","7.7882","0.0006","10.591","0.0009","13.0638","0.0011","81.172","0.002","76.333","0.002","71.019","0.002","986.67","0.14","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H23 Br N2 O5 S -","- C17 H23 Br N2 O5 S -","- C34 H46 Br2 N4 O10 S2 -","2","1","","Ling Zhou; Chong Kiat Tan; Jing Zhou; Ying-Yeung Yeung","Facile, Efficient, and Catalyst-Free Electrophilic Aminoalkoxylation of Olefins: Scope and Application","Journal of the American Chemical Society","2010","132","","10245","10247","10.1021/ja104168q","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102755","20.8509","0.0001","17.1103","0.0001","24.2437","0.0002","90","","104.181","0.0002","90","","8385.72","0.09","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C86 H86 B F24 Ir N4 -","- C86 H86 B F24 Ir N4 -","- C344 H344 B4 F96 Ir4 N16 -","4","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0674","0.0412","","0.1007","0.0813","0.1007","","","","","","0.9577","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102756","17.416","0.0001","13.2405","0.0001","39.2632","0.0002","90","","92.2185","0.00018","90","","9047.17","0.1","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C90.18 H94.02 B F24 Ir N4 -","- C90.175 H94.02 B F24 Ir N4 -","- C360.7 H376.08 B4 F96 Ir4 N16 -","4","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.06","0.038","","0.1002","0.08","0.1002","","","","","","0.9125","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102757","22.7234","0.0003","18.7031","0.0003","19.6595","0.0002","90","","116.051","0.0007","90","","7506.39","0.18","150","","150","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C74 H62 B Cl F24 Ir N4 Na -","- C74 H62 B Cl F24 Ir N4 Na -","- C296 H248 B4 Cl4 F96 Ir4 N16 Na4 -","4","0.5","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0773","0.0629","","0.1556","0.1461","0.1556","","","","","","0.938","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102758","12.7677","0.0001","14.3005","0.0001","20.9203","0.0002","90","","95.1294","0.0004","90","","3804.43","0.05","150","","150","","","","","","","","","8","P 1 2/n 1","-P 2yac","13","","","","- C74 H60.43 B Cl0.15 F24 Ir N7.27 Na0.15 -","- C74 H60.432 B Cl0.15 F24 Ir N7.26 Na0.15 -","- C148 H120.864 B2 Cl0.3 F48 Ir2 N14.52 Na0.3 -","2","0.5","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0621","0.0481","","0.1165","0.1009","0.1165","","","","","","0.9531","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102759","12.9101","0.0001","14.4822","0.0001","20.7483","0.0002","90","","95.7575","0.0004","90","","3859.67","0.05","150","","150","","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C78 H68 B F24 Ir N6 O -","- C78 H68 B F24 Ir N6 O -","- C156 H136 B2 F48 Ir2 N12 O2 -","2","0.5","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0431","0.0375","","0.0961","0.0894","0.0961","","","","","","1.0001","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102760","12.3626","0.0001","18.0479","0.0001","18.2196","0.0002","85.7504","0.0003","89.6654","0.0003","73.4166","0.0003","3884.84","0.06","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C77 H74 B2 F24 N5 Rh -","- C77 H74 B2 F24 N5 Rh -","- C154 H148 B4 F48 N10 Rh2 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0624","0.0505","","0.1324","0.1192","0.1324","","","","","","0.9992","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102761","12.5131","0.0001","18.025","0.0002","18.3267","0.0002","92.2635","0.0004","109.9","0.0004","92.5285","0.0004","3876.41","0.07","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C77 H74 B2 F24 Ir N5 -","- C77 H74 B2 F24 Ir N5 -","- C154 H148 B4 F48 Ir2 N10 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0523","0.0393","","0.103","0.0888","0.103","","","","","","0.9988","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102762","12.1802","0.0001","18.109","0.0001","19.0903","0.0002","96.3368","0.0004","91.757","0.0004","106.176","0.0004","4011.04","0.06","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C80 H78 B2 F24 N5 Rh -","- C80 H78 B2 F24 N5 Rh -","- C160 H156 B4 F48 N10 Rh2 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0706","0.0513","","0.1201","0.1023","0.12","","","","","","0.9526","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102763","12.692","0.004","17.585","0.007","18.027","0.006","88.662","0.016","71.192","0.009","87.422","0.013","3805","2","150","","150","","","","","","","","","8","P -1","-P 1","2","","","","- C77.16 H68.33 B Cl0.21 F24 N4 O0.79 Rh -","- C77.164 H68.328 B Cl0.209 F24 N4 O0.791 Rh -","- C154.328 H136.656 B2 Cl0.418 F48 N8 O1.582 Rh2 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.6889","Synchrotron","","0.0954","0.0754","","0.0962","0.0803","0.0803","","","","","","1.066","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102764","13.0947","0.0001","36.5759","0.0001","54.0064","0.0002","90","","93.2135","0.00018","90","","25825.7","0.2","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86 H86 B2 F24 N5 Rh -","- C86 H86 B2 F24 N5 Rh -","- C1032 H1032 B24 F288 N60 Rh12 -","12","3","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.1276","0.0751","","0.2065","0.1584","0.2065","","","","","","0.9618","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102765","12.2427","0.0001","18.0382","0.0002","18.8848","0.0002","84.3098","0.0005","89.8394","0.0005","74.7171","0.0004","4001.96","0.07","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C80 H78 B2 F24 Ir N5 -","- C80 H78 B2 F24 Ir N5 -","- C160 H156 B4 F48 Ir2 N10 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0696","0.0498","","0.1088","0.0944","0.1088","","","","","","0.9199","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102766","13.0196","0.0001","16.2636","0.0001","41.958","0.003","86.1769","0.0002","89.9547","0.0002","84.5651","0.0002","8824.7","0.6","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C87.84 H90.41 B2 F24 Ir N5 -","- C87.85 H90.44 B2 F24 Ir N5 -","- C351.4 H361.76 B8 F96 Ir4 N20 -","4","2","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0963","0.0789","","0.1652","0.152","0.1648","","","","","","0.9993","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102767","12.4797","0.0001","18.0232","0.0001","18.3026","0.0001","86.9554","0.0003","71.1266","0.0004","88.1755","0.0004","3889.4","0.04","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C78 H76 B2 F24 N5 Rh -","- C78 H76 B2 F24 N5 Rh -","- C156 H152 B4 F48 N10 Rh2 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.07","0.0571","","0.1523","0.1336","0.1523","","","","","","0.9235","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102768","12.5092","0.0001","18.0131","0.0002","18.2799","0.0002","86.9894","0.0005","70.6905","0.0006","87.986","0.0006","3881.23","0.07","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C78 H74 B2 F24 N5 Rh -","- C78 H74 B2 F24 N5 Rh -","- C156 H148 B4 F48 N10 Rh2 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.082","0.0653","","0.1822","0.1604","0.1822","","","","","","0.9995","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102769","12.9838","0.0002","18.0619","0.0002","19.1755","0.0003","89.919","0.0005","72.2221","0.0006","85.1736","0.0007","4265.57","0.11","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C86 H84 B2 F24 Ir N5 -","- C86 H84 B2 F24 Ir N5 -","- C172 H168 B4 F48 Ir2 N10 -","2","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0788","0.0582","","0.1405","0.124","0.1405","","","","","","0.9999","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102770","13.4156","0.0001","16.6035","0.0002","38.5024","0.0004","90","","95.1242","0.0004","90","","8541.98","0.15","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86 H82 B2 F24 Ir N5 -","- C86 H82 B2 F24 Ir N5 -","- C344 H328 B8 F96 Ir4 N20 -","4","1","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.1103","0.0654","","0.138","0.1085","0.1374","","","","","","0.9531","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102771","12.8899","0.0001","35.5605","0.0003","13.1718","0.0001","90","","115.227","0.0003","90","","5461.77","0.08","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C53 H41 B2 F24 N3 -","- C53 H41 B2 F24 N3 -","- C212 H164 B8 F96 N12 -","4","2","","Christina Y. Tang; Amber L. Thompson; Simon Aldridge","Dehydrogenation of Saturated CC and BN Bonds at Cationic N-Heterocyclic Carbene Stabilized M(III) Centers (M = Rh, Ir)","Journal of the American Chemical Society","2010","132","","10578","10591","10.1021/ja1043787","","","0.71073","MoKα","","0.0665","0.0595","","0.1527","0.1441","0.1527","","","","","","1.0001","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102772","10.3497","0.0012","5.6898","0.0006","17.1366","0.0019","90","","90.22","0.002","90","","1009.13","0.19","125","2","125","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H30 N2 O3 -","- C22 H30 N2 O3 -","- C44 H60 N4 O6 -","2","1","","Uttam K. Tambar; Sharon K. Lee; James L. Leighton","Enantioselective (Formal) Aza-Diels-Alder Reactions with Non-Danishefsky-Type Dienes","Journal of the American Chemical Society","2010","132","","10248","10250","10.1021/ja104480g","","","0.71073","MoKα","","0.0555","0.0473","","","0.1162","0.1252","","","","","","1.038","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102773","12.6963","0.0008","5.6982","0.0004","13.9991","0.0009","90","","98.935","0.001","90","","1000.49","0.11","125","2","125","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H27 Br N2 O3 -","- C20 H27 Br N2 O3 -","- C40 H54 Br2 N4 O6 -","2","1","","Uttam K. Tambar; Sharon K. Lee; James L. Leighton","Enantioselective (Formal) Aza-Diels-Alder Reactions with Non-Danishefsky-Type Dienes","Journal of the American Chemical Society","2010","132","","10248","10250","10.1021/ja104480g","","","0.71073","MoKα","","0.0515","0.038","","","0.0816","0.0869","","","","","","1.028","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102774","13.226","0.002","14.275","0.002","18.644","0.003","82.897","0.003","84.533","0.003","77.795","0.002","3405.4","0.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C68 H52 B Cl F24 N2 Pd -","- C68 H52 B Cl F24 N2 Pd -","- C136 H104 B2 Cl2 F48 N4 Pd2 -","2","1","","Changle Chen; Richard F. Jordan","Palladium-Catalyzed Dimerization of Vinyl Ethers to Acetals","Journal of the American Chemical Society","2010","132","","10254","10255","10.1021/ja104523y","","","0.71073","MoKα","","0.0861","0.0648","","","0.1667","0.1777","","","","","","0.932","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102775","9.306","0.004","18.733","0.008","19.586","0.008","90","","98.302","0.007","90","","3379","2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H33 O2 Si2 -","- C40 H33 O2 Si2 -","- C160 H132 O8 Si8 -","4","1","","Changle Chen; Richard F. Jordan","Palladium-Catalyzed Dimerization of Vinyl Ethers to Acetals","Journal of the American Chemical Society","2010","132","","10254","10255","10.1021/ja104523y","","","0.71073","MoKα","","0.06","0.051","","","0.1381","0.1442","","","","","","1.065","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102776","11.4126","0.0013","13.1288","0.0015","18.984","0.002","109.283","0.002","91.586","0.002","100.116","0.002","2631.9","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H53 B Cl0.06 F20 N2 P -","- C56 H53 B Cl0.062 F20 N2 P -","- C112 H106 B2 Cl0.124 F40 N4 P2 -","2","1","","Olivier Back; Mehmet Ali Celik; Gernot Frenking; Mohand Melaimi; Bruno Donnadieu; Guy Bertrand","A Crystalline Phosphinyl Radical Cation","Journal of the American Chemical Society","2010","132","","10262","10263","10.1021/ja1046846","","","0.71073","MoKα","","0.1029","0.0578","","","0.128","0.1502","","","","","","1.008","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102777","15.7369","0.001","11.4071","0.0007","16.6528","0.001","90","","96.202","0.001","90","","2971.9","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H53 N2 P -","- C32 H53 N2 P -","- C128 H212 N8 P4 -","4","1","","Olivier Back; Mehmet Ali Celik; Gernot Frenking; Mohand Melaimi; Bruno Donnadieu; Guy Bertrand","A Crystalline Phosphinyl Radical Cation","Journal of the American Chemical Society","2010","132","","10262","10263","10.1021/ja1046846","","","0.71073","MoKα","","0.0647","0.0385","","","0.0764","0.0815","","","","","","0.875","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102778","13.3286","0.0013","14.7172","0.0014","17.692","0.003","110.179","0.002","92.789","0.002","116.027","0.001","2843.6","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H59 B F21 N2 P -","- C62 H59 B F21 N2 P -","- C124 H118 B2 F42 N4 P2 -","2","1","","Olivier Back; Mehmet Ali Celik; Gernot Frenking; Mohand Melaimi; Bruno Donnadieu; Guy Bertrand","A Crystalline Phosphinyl Radical Cation","Journal of the American Chemical Society","2010","132","","10262","10263","10.1021/ja1046846","","","0.71073","MoKα","","0.08","0.0469","","","0.1016","0.1124","","","","","","1.009","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102779","18.9573","0.0008","18.9573","0.0008","25.392","0.0009","90","","90","","120","","7902.8","0.5","173.1","","173.1","","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C106 H102 Cl4 Cu2 O4 P4 -","- C106 H74 Cl4 Cu2 O4 P4 -","- C318 H222 Cl12 Cu6 O12 P12 -","3","0.5","","Gaku Hattori; Ken Sakata; Hiroshi Matsuzawa; Yoshiaki Tanabe; Yoshihiro Miyake; Yoshiaki Nishibayashi","Copper-Catalyzed Enantioselective Propargylic Amination of Propargylic Esters with Amines: Copper-Allenylidene Complexes as Key Intermediates","Journal of the American Chemical Society","2010","132","","10592","10608","10.1021/ja1047494","","","0.71075","MoKα","","","0.0408","","","","0.0856","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102780","11.6476","0.0014","5.0598","0.0008","13.0466","0.0016","90","","90.442","0.003","90","","768.87","0.18","173.1","","173.1","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H16 Cl N -","- C20 H16 Cl N -","- C40 H32 Cl2 N2 -","2","1","","Gaku Hattori; Ken Sakata; Hiroshi Matsuzawa; Yoshiaki Tanabe; Yoshihiro Miyake; Yoshiaki Nishibayashi","Copper-Catalyzed Enantioselective Propargylic Amination of Propargylic Esters with Amines: Copper-Allenylidene Complexes as Key Intermediates","Journal of the American Chemical Society","2010","132","","10592","10608","10.1021/ja1047494","","","0.71075","MoKα","","","0.056","","","","0.1344","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102781","11.3495","0.0005","11.5304","0.0004","13.7315","0.0006","93.9917","0.0013","91.1022","0.0015","103.075","0.0013","1745","0.12","173.1","","173.1","","","","","","","","","6","P 1","P 1","1","","","","- C76 H60 Cl6 Cu2 O4 P4 -","- C76 H60 Cl6 Cu2 O4 P4 -","- C76 H60 Cl6 Cu2 O4 P4 -","1","1","","Gaku Hattori; Ken Sakata; Hiroshi Matsuzawa; Yoshiaki Tanabe; Yoshihiro Miyake; Yoshiaki Nishibayashi","Copper-Catalyzed Enantioselective Propargylic Amination of Propargylic Esters with Amines: Copper-Allenylidene Complexes as Key Intermediates","Journal of the American Chemical Society","2010","132","","10592","10608","10.1021/ja1047494","","","0.71075","MoKα","","","0.0314","","","","0.0706","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102782","13.8976","0.0004","13.8976","0.0004","35.5493","0.0013","90","","90","","90","","6866.1","0.4","173.1","","173.1","","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C88 H64 Cl2 Cu2 P4 -","- C88 H64 Cl2 Cu2 P4 -","- C352 H256 Cl8 Cu8 P16 -","4","0.5","","Gaku Hattori; Ken Sakata; Hiroshi Matsuzawa; Yoshiaki Tanabe; Yoshihiro Miyake; Yoshiaki Nishibayashi","Copper-Catalyzed Enantioselective Propargylic Amination of Propargylic Esters with Amines: Copper-Allenylidene Complexes as Key Intermediates","Journal of the American Chemical Society","2010","132","","10592","10608","10.1021/ja1047494","","","0.71075","MoKα","","","0.0451","","","","0.129","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102783","8.5116","0.0017","26.887","0.005","41.174","0.008","90","","90","","90","","9423","3","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C54 H66 Si5 -","- C54 H66 Si5 -","- C432 H528 Si40 -","8","1","","Dominik Nied; Ralf Köppe; Wim Klopper; Hansgeorg Schnöckel; Frank Breher","Synthesis of a Pentasilapropellane. Exploring the Nature of a Stretched Silicon-Silicon Bond in a Nonclassical Molecule","Journal of the American Chemical Society","2010","132","","10264","10265","10.1021/ja104810u","","","0.71073","MoKα","","0.1069","0.098","","","0.1776","0.1813","","","","","","1.38","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102784","17.2825","0.0003","23.4559","0.0004","18.2009","0.0013","90","","114.427","0.008","90","","6717.8","0.7","153.1","","153.1","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C140 H192 Cu O16 P3 -","- C140 H192 Cu O16 P3 -","- C280 H384 Cu2 O32 P6 -","2","1","","Ryo Yazaki; Naoya Kumagai; Masakatsu Shibasaki","Direct Catalytic Asymmetric Conjugate Addition of Terminal Alkynes to α,β-Unsaturated Thioamides","Journal of the American Chemical Society","2010","132","","10275","10277","10.1021/ja105141x","","","1.54187","CuKα","","","0.0551","","","","0.1493","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102785","4.8515","0.0002","10.4926","0.0004","15.8543","0.0007","90","","91.852","0.002","90","","806.64","0.06","93.1","","93.1","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H19 N S -","- C19 H19 N S -","- C38 H38 N2 S2 -","2","1","","Ryo Yazaki; Naoya Kumagai; Masakatsu Shibasaki","Direct Catalytic Asymmetric Conjugate Addition of Terminal Alkynes to α,β-Unsaturated Thioamides","Journal of the American Chemical Society","2010","132","","10275","10277","10.1021/ja105141x","","","1.54187","CuKα","","","0.0755","","","","0.1993","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102786","10.2051","0.0005","11.357","0.0006","13.873","0.0007","68.513","0.002","73.874","0.002","64.295","0.002","1334.45","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C62 H60 N8 O8 -","- C62 H60 N8 O8 -","- C62 H60 N8 O8 -","1","0.5","","José Berná; Mateo Alajarín; Raúl-Angel Orenes","Azodicarboxamides as Template Binding Motifs for the Building of Hydrogen-Bonded Molecular Shuttles","Journal of the American Chemical Society","2010","132","","10741","10747","10.1021/ja101151t","","","0.71073","MoKα","","0.0514","0.0422","","","0.099","0.1043","","","","","","1.033","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102787","10.8603","0.0004","18.963","0.0007","25.9552","0.001","90","","90","","90","","5345.3","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C62 H62 N8 O8 -","- C62 H62 N8 O8 -","- C248 H248 N32 O32 -","4","0.5","","José Berná; Mateo Alajarín; Raúl-Angel Orenes","Azodicarboxamides as Template Binding Motifs for the Building of Hydrogen-Bonded Molecular Shuttles","Journal of the American Chemical Society","2010","132","","10741","10747","10.1021/ja101151t","","","0.71073","MoKα","","0.1068","0.0871","","","0.1583","0.1659","","","","","","1.239","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102788","20.4472","0.0006","10.9518","0.0003","20.3069","0.0005","90","","90.7561","0.001","90","","4547","0.2","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H48 Cl9 F3 N P Pt -","- C41 H48 Cl9 F3 N P Pt -","- C164 H192 Cl36 F12 N4 P4 Pt4 -","4","1","","Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok","Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry","Journal of the American Chemical Society","2010","132","","10626","10627","10.1021/ja101436w","","","0.71073","MoKα","","0.0968","0.0547","","","0.0975","0.1114","","","","","","1.037","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102789","19.2068","0.0004","14.9867","0.0003","28.4503","0.0005","90","","90","","90","","8189.3","0.3","110","2","110","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C41 H52 N P Pt -","- C41 H52 N P Pt -","- C328 H416 N8 P8 Pt8 -","8","1","","Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok","Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry","Journal of the American Chemical Society","2010","132","","10626","10627","10.1021/ja101436w","","","0.71073","MoKα","","0.1291","0.0683","","","0.1486","0.1644","","","","","","1.023","","","","has coordinates,has disorder","178773","2020-10-21","18:00:00","" "4102790","36.0527","0.0004","36.0527","0.0004","20.744","0.0004","90","","90","","90","","26963","0.7","110","2","110","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C54 H72 Cl2 P2 Pt2 -","- C54 H72 Cl2 P2 Pt2 -","- C864 H1152 Cl32 P32 Pt32 -","16","1","","Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok","Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry","Journal of the American Chemical Society","2010","132","","10626","10627","10.1021/ja101436w","","","0.71073","MoKα","","0.0657","0.0409","","","0.0963","0.1014","","","","","","0.936","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102791","12.6717","0.0003","20.2955","0.0004","19.301","0.0005","90","","93.0782","0.001","90","","4956.6","0.2","110","2","110","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C57 H59 F4 N O3 P2 Pt S -","- C57 H59 F4 N O3 P2 Pt S -","- C228 H236 F16 N4 O12 P8 Pt4 S4 -","4","1","","Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok","Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry","Journal of the American Chemical Society","2010","132","","10626","10627","10.1021/ja101436w","","","0.71073","MoKα","","0.1063","0.072","","","0.1729","0.1925","","","","","","1.044","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102792","11.34","0.0002","15.621","0.0003","18.5266","0.0005","66.7454","0.0011","80.2447","0.001","73.5493","0.0013","2885.6","0.11","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H76 F P3 Pt -","- C72 H76 F P3 Pt -","- C144 H152 F2 P6 Pt2 -","2","1","","Ariela W. Kaspi; Israel Goldberg; Arkadi Vigalok","Reagent-Dependent Formation of C-C and C-F Bonds in Pt Complexes: An Unexpected Twist in the Electrophilic Fluorination Chemistry","Journal of the American Chemical Society","2010","132","","10626","10627","10.1021/ja101436w","","","0.71073","MoKα","","0.0771","0.0594","","","0.1007","0.1068","","","","","","1.08","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102793","23.9286","0.0002","23.9286","0.0002","42.0821","0.0005","90","","90","","90","","24095.3","0.4","150","2","150","2","","","","","","","","7","I 41/a c d :2","-I 4bd 2c","142","","catena-(tetrakis(1,1'-Methylenedipiperidinium) tritriaconta-selenido-hexadeca-gallium-di-copper-di-tin)","","- C44 H96 Cu2 Ga16 N8 Se33 Sn2 -","- Cu2 Ga16 Se33 Sn2 -","- Cu16 Ga128 Se264 Sn16 -","8","0.25","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.1196","0.0587","","","0.1873","0.272","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102794","24.1584","0.0012","24.1584","0.0012","41.931","0.004","90","","90","","90","","24472","3","150","2","150","2","","","","","","","","7","I 41/a c d :2","-I 4bd 2c","142","","catena-(octakis(2-Methylpiperidinium) tritriaconta-selenido-tetradeca-gallium-tetra-zinc-di-tin)","","- C48 H112 Ga14 N8 Se33 Sn2 Zn4 -","- C10 Ga14 Se32.98 Sn2 Zn4 -","- C80 Ga112 Se263.84 Sn16 Zn32 -","8","0.25","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.0839","0.0485","","","0.1606","0.1983","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102795","24.0693","0.0003","24.0693","0.0003","42.2601","0.001","90","","90","","90","","24482.6","0.7","150","2","150","2","","","","","","","","7","I 41/a c d :2","-I 4bd 2c","142","","catena-(octakis(3-Methylpiperidinium) tritriaconta-selenido-tetradeca-gallium-tetra-zinc-di-tin)","","- C48 H112 Ga14 N8 Se33 Sn2 Zn4 -","- Ga14 Se33 Sn2 Zn4 -","- Ga112 Se264 Sn16 Zn32 -","8","0.25","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.1441","0.0732","","","0.2213","0.3099","","","","","","1.171","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102796","18.8019","0.0001","18.8019","0.0001","18.8019","0.0001","90","","90","","90","","6646.69","0.06","150","2","150","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C60 H144 Cu2 Ga16 N12 Se35 Sn2 -","- C60 H144 Cu2 Ga16 N12 Se35 Sn2 -","- C120 H288 Cu4 Ga32 N24 Se70 Sn4 -","2","0.0416667","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.0451","0.0328","","","0.0937","0.1","","","","","","1.087","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102797","18.8951","0.0001","18.8951","0.0001","18.8951","0.0001","90","","90","","90","","6746.02","0.06","150","2","150","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C60 H144 Ga14 N12 Se35 Sn2 Zn4 -","- C60 H144 Ga14 N12 Se35 Sn2 Zn4 -","- C120 H288 Ga28 N24 Se70 Sn4 Zn8 -","2","0.0416667","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.0871","0.0408","","","0.1047","0.1367","","","","","","1.115","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102798","18.8037","0.0003","18.8037","0.0003","18.8037","0.0003","90","","90","","90","","6648.6","0.18","150","2","150","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C60 H144 Ga14 Mn4 N12 Se35 Sn2 -","- C60 H144 Ga14 Mn4 N12 Se35 Sn2 -","- C120 H288 Ga28 Mn8 N24 Se70 Sn4 -","2","0.0416667","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.0729","0.0417","","","0.1143","0.1321","","","","","","1.074","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102799","18.428","0.0003","18.428","0.0003","18.428","0.0003","90","","90","","90","","6257.99","0.18","150","2","150","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C60 H144 Cu2 Ga16 N12 S35 Sn2 -","- C60 H144 Cu2 Ga16 N12 S35 Sn2 -","- C120 H288 Cu4 Ga32 N24 S70 Sn4 -","2","0.0416667","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.0927","0.0538","","","0.1398","0.1697","","","","","","1.045","","","","has coordinates","178773","2020-10-21","18:00:00","" "4102800","18.258","0.0015","18.258","0.0015","18.258","0.0015","90","","90","","90","","6086.4","0.9","150","2","150","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C60 H144 Ga14 N12 S35 Sn2 Zn4 -","- C60 H144 Ga14 N12 S35 Sn2 Zn4 -","- C120 H288 Ga28 N24 S70 Sn4 Zn8 -","2","0.0416667","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.1411","0.0584","","","0.1579","0.2185","","","","","","1.061","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102801","18.3783","0.0011","18.3783","0.0011","18.3783","0.0011","90","","90","","90","","6207.5","0.6","150","2","150","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C60 H144 Ga14 Mn4 N12 S35 Sn2 -","- C60 H144 Ga14 Mn4 N12 S35 Sn2 -","- C120 H288 Ga28 Mn8 N24 S70 Sn4 -","2","0.0416667","","Tao Wu; Le Wang; Xianhui Bu; Victoria Chau; Pingyun Feng","Largest Molecular Clusters in the Supertetrahedral Tn Series","Journal of the American Chemical Society","2010","132","","10823","10831","10.1021/ja102688p","","","0.71073","MoKα","","0.062","0.0426","","","0.1196","0.1306","","","","","","1.146","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102802","10.122","0.003","21.299","0.006","24.651","0.006","90","","98.052","0.004","90","","5262","3","202","2","202","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H85 Br N O P2 Pd -","- C54 H85 Br N O P2 Pd -","- C216 H340 Br4 N4 O4 P8 Pd4 -","4","1","","Sophie Rousseaux; Serge I. Gorelsky; Benjamin K. W. Chung; Keith Fagnou","Investigation of the Mechanism of C(sp3)-H Bond Cleavage in Pd(0)-Catalyzed Intramolecular Alkane Arylation Adjacent to Amides and Sulfonamides","Journal of the American Chemical Society","2010","132","","10692","10705","10.1021/ja103081n","","","0.71073","MoKα","","0.1093","0.0528","","","0.1199","0.1445","","","","","","1.058","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102803","7.5448","0.0002","10.5798","0.0004","11.1164","0.0004","90","","90","","90","","887.34","0.05","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H13 N O4 -","- C8 H13 N O4 -","- C32 H52 N4 O16 -","4","1","","Matthew D. Shoulders; Frank W. Kotch; Amit Choudhary; Ilia A. Guzei; Ronald T. Raines","The Aberrance of the 4S Diastereomer of 4-Hydroxyproline","Journal of the American Chemical Society","2010","132","","10857","10865","10.1021/ja103082y","","","1.54178","Cu-Kα","","0.0411","0.0381","","","0.1003","0.1022","","","","","","1.107","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102804","6.377","0.0016","9.552","0.002","10.158","0.003","90","","90.19","0.003","90","","618.8","0.3","105","2","105","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H19 N O5 -","- C11 H19 N O5 -","- C22 H38 N2 O10 -","2","1","","Matthew D. Shoulders; Frank W. Kotch; Amit Choudhary; Ilia A. Guzei; Ronald T. Raines","The Aberrance of the 4S Diastereomer of 4-Hydroxyproline","Journal of the American Chemical Society","2010","132","","10857","10865","10.1021/ja103082y","","","0.71073","Mo-Kα","","0.0312","0.0304","","","0.0767","0.0771","","","","","","1.108","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102805","12.7699","0.0001","13.8445","0.0001","19.5705","0.0001","90","","90","","90","","3459.93","0.04","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C33 H33 Cl3 Cu2 N2 O4 P2 -","- C33 H33 Cl3 Cu2 N2 O4 P2 -","- C132 H132 Cl12 Cu8 N8 O16 P8 -","4","1","","Jesús García-López; Víctor Yañez-Rodríguez; Laura Roces; Santiago García-Granda; Ana Martínez; Alfredo Guevara-García; German R. Castro; Félix Jiménez-Villacorta; María J. Iglesias; Fernando López Ortiz","Synthesis and Characterization of a Coupled Binuclear CuI/CuIII Complex","Journal of the American Chemical Society","2010","132","","10665","10667","10.1021/ja1034667","","","1.5418","CuKα","","0.0393","0.0359","","","0.1097","0.1178","","","","","","1.077","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102806","50.7473","0.0015","50.7473","","21.4124","0.0007","90","","90","","120","","47755","2","120","2","120","2","","","","","","","synthesis as described","5","R -3 :H","-R 3","148","","","","- C85 H58 Fe N10 O8 -","- C85 H58 Fe N10 O8 -","- C1530 H1044 Fe18 N180 O144 -","18","1","","Ismail Hijazi; Thierry Roisnel; Pascale Even-Hernandez; Eric Furet; Jean-François Halet; Olivier Cador; Bernard Boitrel","Characterization of a Six-Coordinate Ferrous High-Spin Heme with Both Intramolecular Axial Carboxylic Acid and Pyridine","Journal of the American Chemical Society","2010","132","","10652","10653","10.1021/ja103825g","","x-ray","0.71073","MoKα","","0.1452","0.0588","","","0.1466","0.1668","","","","","","0.769","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102807","16.1289","0.0004","17.596","0.0005","17.6291","0.0005","69.242","0.001","69.071","0.001","73.957","0.001","4305.1","0.2","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C87 H62 Cl9 Fe N10 O6 -","- C87 H62 Cl9 Fe N10 O6 -","- C174 H124 Cl18 Fe2 N20 O12 -","2","1","","Ismail Hijazi; Thierry Roisnel; Pascale Even-Hernandez; Eric Furet; Jean-François Halet; Olivier Cador; Bernard Boitrel","Characterization of a Six-Coordinate Ferrous High-Spin Heme with Both Intramolecular Axial Carboxylic Acid and Pyridine","Journal of the American Chemical Society","2010","132","","10652","10653","10.1021/ja103825g","","x-ray","0.71073","MoKα","","0.0807","0.0708","","","0.2088","0.2193","","","","","","1.096","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102808","14.3242","0.0006","16.2707","0.0009","19.9354","0.001","90","","110.157","0.003","90","","4361.7","0.4","100","2","100","2","","","","","","","synthesis as described","7","P 1 21 1","P 2yb","4","","","","- C92 H68 Cl12 Fe N12 O4 S0 -","- C92 H68 Cl12 Fe N12 O4 -","- C184 H136 Cl24 Fe2 N24 O8 -","2","1","","Ismail Hijazi; Thierry Roisnel; Pascale Even-Hernandez; Eric Furet; Jean-François Halet; Olivier Cador; Bernard Boitrel","Characterization of a Six-Coordinate Ferrous High-Spin Heme with Both Intramolecular Axial Carboxylic Acid and Pyridine","Journal of the American Chemical Society","2010","132","","10652","10653","10.1021/ja103825g","","x-ray","0.71073","MoKα","","0.1089","0.0669","","","0.1513","0.1733","","","","","","1.031","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102809","27.612","0.007","19.743","0.004","24.692","0.006","90","","105.944","0.0016","90","","12943","5","123.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H88 Cl2 Fe P2 -","- C104.17 H88 Cl3.09 Fe1.55 P3.15 -","- C833.36 H704 Cl24.72 Fe12.4 P25.2 -","8","1","","Takuji Hatakeyama; Toru Hashimoto; Yoshiyuki Kondo; Yuichi Fujiwara; Hirofumi Seike; Hikaru Takaya; Yoshinori Tamada; Teruo Ono; Masaharu Nakamura","Iron-Catalyzed Suzuki-Miyaura Coupling of Alkyl Halides","Journal of the American Chemical Society","2010","132","","10674","10676","10.1021/ja103973a","","","0.7107","MoKα","","","0.0931","","","","0.3023","","","","","","1.093","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102810","10.7895","0.0005","10.7895","0.0005","72.85","0.007","90","","90","","120","","7344.5","0.9","173","2","173","2","","","","","","","","4","P 61","P 61","169","","","","- C52 H78 N8 O2 -","- C52 H78 N8 O2 -","- C312 H468 N48 O12 -","6","1","","Shunxi Dong; Xiaohua Liu; Xiaohong Chen; Fang Mei; Yulong Zhang; Bo Gao; Lili Lin; Xiaoming Feng","Chiral Bisguanidine-Catalyzed Inverse-Electron-Demand Hetero-Diels-Alder Reaction of Chalcones with Azlactones","Journal of the American Chemical Society","2010","132","","10650","10651","10.1021/ja1046928","","","0.71073","MoKα","","0.0858","0.083","","","0.2018","0.2034","","","","","","1.236","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102811","11.845","0.003","10.783","0.002","12.35","0.003","90","","117.8","0.03","90","","1395.3","0.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C32 H26 Cl3 N O3 -","- C32 H26 Cl3 N O3 -","- C64 H52 Cl6 N2 O6 -","2","1","","Shunxi Dong; Xiaohua Liu; Xiaohong Chen; Fang Mei; Yulong Zhang; Bo Gao; Lili Lin; Xiaoming Feng","Chiral Bisguanidine-Catalyzed Inverse-Electron-Demand Hetero-Diels-Alder Reaction of Chalcones with Azlactones","Journal of the American Chemical Society","2010","132","","10650","10651","10.1021/ja1046928","","","0.71073","MoKα","","0.0736","0.0636","","","0.1198","0.1265","","","","","","1.098","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102812","9.3195","0.0011","10.599","0.0012","24.308","0.003","90","","90","","90","","2401.1","0.5","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H25 N O3 -","- C31 H25 N O3 -","- C124 H100 N4 O12 -","4","1","","Shunxi Dong; Xiaohua Liu; Xiaohong Chen; Fang Mei; Yulong Zhang; Bo Gao; Lili Lin; Xiaoming Feng","Chiral Bisguanidine-Catalyzed Inverse-Electron-Demand Hetero-Diels-Alder Reaction of Chalcones with Azlactones","Journal of the American Chemical Society","2010","132","","10650","10651","10.1021/ja1046928","","","1.54186","CuKα","","0.0332","0.031","","","0.0729","0.0737","","","","","","1.143","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102813","6.2174","0.0003","9.1621","0.0005","10.3772","0.0006","68.885","0.002","72.909","0.001","71.408","0.002","511.84","0.05","100","2","100","2","","","","","","","syntheszed","4","P 1","P 1","1","","","","- C22 H29 B O4 -","- C22 H29 B O4 -","- C22 H29 B O4 -","1","1","","Jeannette M. O'Brien; Kang-sang Lee; Amir H. Hoveyda","Enantioselective Synthesis of Boron-Substituted Quaternary Carbons by NHC-Cu-Catalyzed Boronate Conjugate Additions to Unsaturated Carboxylic Esters, Ketones, or Thioesters","Journal of the American Chemical Society","2010","132","","10630","10633","10.1021/ja104777u","","x-ray","1.54178","CuKα","","0.0361","0.0361","","","0.0857","0.0857","","","","","","1.169","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102814","11.0774","0.0002","17.1476","0.0003","20.9494","0.0004","90","","102.081","0.001","90","","3891.22","0.12","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H26 B Br O4 -","- C18 H26 B Br O4 -","- C144 H208 B8 Br8 O32 -","8","4","","Jeannette M. O'Brien; Kang-sang Lee; Amir H. Hoveyda","Enantioselective Synthesis of Boron-Substituted Quaternary Carbons by NHC-Cu-Catalyzed Boronate Conjugate Additions to Unsaturated Carboxylic Esters, Ketones, or Thioesters","Journal of the American Chemical Society","2010","132","","10630","10633","10.1021/ja104777u","","","0.71073","MoKα","","0.0327","0.0292","","","0.0695","0.0709","","","","","","1.043","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102815","8.499","0.0017","8.572","0.0017","8.883","0.0018","117.05","0.03","97.77","0.03","107.32","0.03","521.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","ZHAO1770","","","- C12 H38 B4 N2 O6 -","- C12 H38 B4 N2 O6 -","- C12 H38 B4 N2 O6 -","1","0.5","","Xuenian Chen; Ji-Cheng Zhao; Sheldon G. Shore","Facile Synthesis of Aminodiborane and Inorganic Butane Analogue NH3BH2NH2BH3","Journal of the American Chemical Society","2010","132","","10658","10659","10.1021/ja104938v","","","0.71073","MoKα","","0.0655","0.046","","","0.116","0.1293","","","","","","1.042","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102816","8.872","0.0018","11.618","0.002","18.212","0.004","90","","90","","90","","1877.2","0.6","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","ZHAO1785","","","- C12 H34 B2 N2 O6 -","- C12 H34 B2 N2 O6 -","- C48 H136 B8 N8 O24 -","4","1","","Xuenian Chen; Ji-Cheng Zhao; Sheldon G. Shore","Facile Synthesis of Aminodiborane and Inorganic Butane Analogue NH3BH2NH2BH3","Journal of the American Chemical Society","2010","132","","10658","10659","10.1021/ja104938v","","","0.71073","MoKα","","0.0373","0.0317","","","0.0805","0.0838","","","","","","1.04","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102817","11.8006","0.0003","12.2935","0.0003","18.6776","0.0003","104.238","0.0013","106.01","0.0014","95.319","0.0012","2486.72","0.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H28 B2 F30 N O2 -","- C46 H21 B2 F30 N O2 -","- C92 H42 B4 F60 N2 O4 -","2","1","","Andreas Berkefeld; Warren E. Piers; Masood Parvez","Tandem Frustrated Lewis Pair/Tris(pentafluorophenyl)borane-Catalyzed Deoxygenative Hydrosilylation of Carbon Dioxide","Journal of the American Chemical Society","2010","132","","10660","10661","10.1021/ja105320c","","","0.71073","MoKα","","0.0634","0.0514","","","0.1374","0.1468","","","","","","1.039","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102818","11.2808","0.0002","11.2845","0.0002","17.7672","0.0004","74.0704","0.0012","83.6967","0.0009","63.4121","0.0011","1944.66","0.07","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C37.5 H38.5 B Cl1.5 F15 N2 O2 -","- C37.5 H38.5 B Cl1.5 F15 N2 O2 -","- C75 H77 B2 Cl3 F30 N4 O4 -","2","1","","Andreas Berkefeld; Warren E. Piers; Masood Parvez","Tandem Frustrated Lewis Pair/Tris(pentafluorophenyl)borane-Catalyzed Deoxygenative Hydrosilylation of Carbon Dioxide","Journal of the American Chemical Society","2010","132","","10660","10661","10.1021/ja105320c","","","0.71073","MoKα","","0.058","0.05","","","0.128","0.136","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102819","13.5551","0.0011","14.9735","0.0012","16.5943","0.0014","84.728","0.002","70.008","0.001","75.54","0.001","3064.8","0.4","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H50 Cl14 N2 O8 Pt2 -","- C50 H50 Cl14 N2 O8 Pt2 -","- C100 H100 Cl28 N4 O16 Pt4 -","2","1","","Amedeo Santoro; Marcin Wegrzyn; Adrian C. Whitwood; Bertrand Donnio; Duncan W. Bruce","Oxidation of Organoplatinum(II) by Coordinated Dimethylsulfoxide: Metal-Metal Bonded, Dinuclear, Liquid-Crystalline Complexes of Platinum(III)","Journal of the American Chemical Society","2010","132","","10689","10691","10.1021/ja105469a","","","0.71073","MoKα","","0.0582","0.0399","","","0.1027","0.1138","","","","","","1.047","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102820","8.6644","0.0005","14.861","0.0009","16.4746","0.001","90","","97.4774","0.0007","90","","2103.3","0.2","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 Cl O Sc -","- C22 H34 Cl O Sc -","- C88 H136 Cl4 O4 Sc4 -","4","1","","Selvan Demir; Sara E. Lorenz; Ming Fang; Filipp Furche; Gerd Meyer; Joseph W. Ziller; William J. Evans","Synthesis, Structure, and Density Functional Theory Analysis of a Scandium Dinitrogen Complex, [(C5Me4H)2Sc]2(μ-η2:η2-N2)","Journal of the American Chemical Society","2010","132","","11151","11158","10.1021/ja102681w","","","0.71073","MoKα","","0.0382","0.0333","","","0.0875","0.0913","","","","","","1.034","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102821","8.7813","0.0008","14.7244","0.0013","14.1177","0.0013","90","","92.186","0.002","90","","1824.1","0.3","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H31 Sc -","- C21 H31 Sc -","- C84 H124 Sc4 -","4","1","","Selvan Demir; Sara E. Lorenz; Ming Fang; Filipp Furche; Gerd Meyer; Joseph W. Ziller; William J. Evans","Synthesis, Structure, and Density Functional Theory Analysis of a Scandium Dinitrogen Complex, [(C5Me4H)2Sc]2(μ-η2:η2-N2)","Journal of the American Chemical Society","2010","132","","11151","11158","10.1021/ja102681w","","","0.71073","MoKα","","0.0324","0.0282","","","0.0767","0.0798","","","","","","1.037","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102822","11.8363","0.0013","11.9868","0.0013","12.408","0.0013","100.45","0.002","98.128","0.002","100.555","0.002","1674","0.3","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H46 B Sc -","- C42 H46 B Sc -","- C84 H92 B2 Sc2 -","2","1","","Selvan Demir; Sara E. Lorenz; Ming Fang; Filipp Furche; Gerd Meyer; Joseph W. Ziller; William J. Evans","Synthesis, Structure, and Density Functional Theory Analysis of a Scandium Dinitrogen Complex, [(C5Me4H)2Sc]2(μ-η2:η2-N2)","Journal of the American Chemical Society","2010","132","","11151","11158","10.1021/ja102681w","","","0.71073","MoKα","","0.107","0.0517","","","0.1023","0.1239","","","","","","1.01","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102823","8.4928","0.0009","10.101","0.001","18.458","0.0018","90","","90.339","0.001","90","","1583.4","0.3","98","2","98","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H52 N2 Sc2 -","- C36 H52 N2 Sc2 -","- C72 H104 N4 Sc4 -","2","0.5","","Selvan Demir; Sara E. Lorenz; Ming Fang; Filipp Furche; Gerd Meyer; Joseph W. Ziller; William J. Evans","Synthesis, Structure, and Density Functional Theory Analysis of a Scandium Dinitrogen Complex, [(C5Me4H)2Sc]2(μ-η2:η2-N2)","Journal of the American Chemical Society","2010","132","","11151","11158","10.1021/ja102681w","","","0.71073","MoKα","","0.0406","0.0327","","","0.0838","0.0885","","","","","","1.024","","","","has coordinates","211332","2020-10-21","18:00:00","" "4102824","8.837","0.0014","21.042","0.003","17.909","0.003","90","","91.485","0.002","90","","3329","0.9","148","2","148","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C72 H104 N2 O Sc4 -","- C72 H104 N2 O Sc4 -","- C144 H208 N4 O2 Sc8 -","2","1","","Selvan Demir; Sara E. Lorenz; Ming Fang; Filipp Furche; Gerd Meyer; Joseph W. Ziller; William J. Evans","Synthesis, Structure, and Density Functional Theory Analysis of a Scandium Dinitrogen Complex, [(C5Me4H)2Sc]2(μ-η2:η2-N2)","Journal of the American Chemical Society","2010","132","","11151","11158","10.1021/ja102681w","","","0.71073","MoKα","","0.1125","0.0675","","","0.1437","0.1647","","","","","","1.012","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102825","9.7378","0.0012","16.16","0.002","19.357","0.002","74.762","0.004","78.464","0.004","87.099","0.004","2879.6","0.6","100","2","100","2","","","","","","","","7","P 1","P 1","1","","","","- C101 H180 F12 Mn2 N4 O12 Sb2 -","- C101 H180 F12 Mn2 N4 O12 Sb2 -","- C101 H180 F12 Mn2 N4 O12 Sb2 -","1","1","","M. Kevin Brown; Megan M. Blewett; James R. Colombe; E. J. Corey","Mechanism of the Enantioselective Oxidation of Racemic Secondary Alcohols Catalyzed by Chiral Mn(III)-Salen Complexes","Journal of the American Chemical Society","2010","132","","11165","11170","10.1021/ja103103d","","","0.71073","MoKα","","0.0374","0.0335","","","0.0701","0.0719","","","","","","1.097","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102826","15.596","0.001","15.596","0.001","12.165","0.001","90","","90","","90","","2959","0.4","150","0.1","150","0.1","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C60 H60 Cu4 I4 P4 -","- C60 H60 Cu4 I4 P4 -","- C120 H120 Cu8 I8 P8 -","2","0.25","","Sandrine Perruchas; Xavier F. Le Goff; Sébastien Maron; Isabelle Maurin; François Guillen; Alain Garcia; Thierry Gacoin; Jean-Pierre Boilot","Mechanochromic and Thermochromic Luminescence of a Copper Iodide Cluster","Journal of the American Chemical Society","2010","132","","10967","10969","10.1021/ja103431d","","","0.71069","MoKα","","0.0281","0.0234","","","0.0468","0.0482","","","","","","1.02","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102827","11.9884","0.0003","10.6312","0.0003","11.4497","0.0003","90","","110.779","0.003","90","","1364.36","0.07","123","","123","","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H19 N3 O -","- C14 H19 N3 O -","- C56 H76 N12 O4 -","4","1","","Roland Kleinmaier; Max Keller; Patrick Igel; Armin Buschauer; Ruth M. Gschwind","Conformations, Conformational Preferences, and Conformational Exchange of N'-Substituted N-Acylguanidines: Intermolecular Interactions Hold the Key","Journal of the American Chemical Society","2010","132","","11223","11233","10.1021/ja103756y","","x-ray","1.54184","CuKα","","0.0467","0.0377","","","0.0982","0.1024","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102828","7.4161","0.0005","8.3883","0.0006","12.2595","0.0009","89.462","0.006","85.558","0.006","75.247","0.006","735.24","0.09","123","","123","","","","","","","","see text","5","P -1","-P 1","2","","","","- C13 H20 Cl N3 O2 -","- C13 H20 Cl N3 O2 -","- C26 H40 Cl2 N6 O4 -","2","1","","Roland Kleinmaier; Max Keller; Patrick Igel; Armin Buschauer; Ruth M. Gschwind","Conformations, Conformational Preferences, and Conformational Exchange of N'-Substituted N-Acylguanidines: Intermolecular Interactions Hold the Key","Journal of the American Chemical Society","2010","132","","11223","11233","10.1021/ja103756y","","x-ray","1.54184","CuKα","","0.0351","0.0322","","","0.0867","0.0889","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102829","9.0041","0.0004","11.0498","0.0005","12.8215","0.0006","80.593","0.001","89.867","0.001","82.296","0.001","1246.89","0.1","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","krace01","","","- C24 H20 P2 Pb Se4 -","- C24 H20 P2 Pb Se4 -","- C48 H40 P4 Pb2 Se8 -","2","1","","Christopher M. Evans; Meagan E. Evans; Todd D. Krauss","Mysteries of TOPSe Revealed: Insights into Quantum Dot Nucleation","Journal of the American Chemical Society","2010","132","","10973","10975","10.1021/ja103805s","","","0.71073","MoKα","","0.0649","0.0393","","","0.0697","0.0778","","","","","","0.968","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102830","10.727","0.001","9.2844","0.0007","14.794","0.001","90","","90","","90","","1473.4","0.2","295","2","295","","","","","","","","By decomposition of Ba~8~Ge~43~ at 400 \%C","2","P m n a","-P 2ac 2","53","","","","- Ba Ge5 -","- Ba Ge5 -","- Ba10 Ge50 -","10","1.25","","Umut Aydemir; Lev Akselrud; Wilder Carrillo-Cabrera; Christophe Candolfi; Niels Oeschler; Michael Baitinger; Frank Steglich; Yuri Grin","BaGe5: A New Type of Intermetallic Clathrate","Journal of the American Chemical Society","2010","132","","10984","10985","10.1021/ja104197c","powder diffraction","","0.35415","synchrotron","","","","","","","","","0.066","1.7","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102831","9.4996","0.0007","20.2853","0.0015","12.898","0.001","90","","109.21","0.001","90","","2347.1","0.3","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C51 H62 Cl3 N O P2 Pd -","- C51 H62 Cl3 N O P2 Pd -","- C102 H124 Cl6 N2 O2 P4 Pd2 -","2","1","","Xiaoqiang Shen; Gavin O. Jones; Donald A. Watson; Brijesh Bhayana; Stephen L. Buchwald","Enantioselective Synthesis of Axially Chiral Biaryls by the Pd-Catalyzed Suzuki-Miyaura Reaction: Substrate Scope and Quantum Mechanical Investigations","Journal of the American Chemical Society","2010","132","","11278","11287","10.1021/ja104297g","","","0.71073","MoKα","","0.0429","0.0366","","","0.0572","0.0587","","","","","","1.509","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102832","9.2517","0.0008","10.7629","0.001","19.7165","0.0017","90","","90","","90","","1963.3","0.3","101","2","101","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H27 O P -","- C23 H27 O P -","- C92 H108 O4 P4 -","4","1","","Xiaoqiang Shen; Gavin O. Jones; Donald A. Watson; Brijesh Bhayana; Stephen L. Buchwald","Enantioselective Synthesis of Axially Chiral Biaryls by the Pd-Catalyzed Suzuki-Miyaura Reaction: Substrate Scope and Quantum Mechanical Investigations","Journal of the American Chemical Society","2010","132","","11278","11287","10.1021/ja104297g","","","0.71073","MoKα","","0.0447","0.0395","","","0.1024","0.1067","","","","","","1.034","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102833","7.721","0.0002","16.4788","0.0004","17.0606","0.0004","90","","99.512","0.001","90","","2140.82","0.09","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H27 N O -","- C28 H27 N O -","- C112 H108 N4 O4 -","4","2","","Xiaoqiang Shen; Gavin O. Jones; Donald A. Watson; Brijesh Bhayana; Stephen L. Buchwald","Enantioselective Synthesis of Axially Chiral Biaryls by the Pd-Catalyzed Suzuki-Miyaura Reaction: Substrate Scope and Quantum Mechanical Investigations","Journal of the American Chemical Society","2010","132","","11278","11287","10.1021/ja104297g","","","1.54178","CuKα","","0.0281","0.0278","","","0.0735","0.0737","","","","","","1.034","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102834","8.0348","0.0016","8.7388","0.0017","14.579","0.003","87.51","0.03","77.91","0.03","89.79","0.03","1000","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H24 O8 -","- C24 H24 O8 -","- C48 H48 O16 -","2","1","","K. C. Nicolaou; Jianhua Wang; Yefeng Tang; Lorenzo Botta","Total Synthesis of Sporolide B and 9-epi-Sporolide B","Journal of the American Chemical Society","2010","132","","11350","11363","10.1021/ja1048994","","","0.71073","MoKα","","0.1205","0.0549","","","0.1329","0.1625","","","","","","0.985","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102835","8.0648","0.0016","10.074","0.002","18.524","0.004","105.62","0.03","91.61","0.03","108.26","0.03","1366","0.6","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H32 O8 -","- C32 H32 O8 -","- C64 H64 O16 -","2","1","","K. C. Nicolaou; Jianhua Wang; Yefeng Tang; Lorenzo Botta","Total Synthesis of Sporolide B and 9-epi-Sporolide B","Journal of the American Chemical Society","2010","132","","11350","11363","10.1021/ja1048994","","","0.71073","MoKα","","0.0746","0.0562","","","0.1315","0.1417","","","","","","1.07","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102836","8.8015","0.0018","9.3256","0.0019","12.532","0.003","80.73","0.03","83.4","0.03","81.91","0.03","1000.6","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H24 O6 -","- C24 H24 O6 -","- C48 H48 O12 -","2","1","","K. C. Nicolaou; Jianhua Wang; Yefeng Tang; Lorenzo Botta","Total Synthesis of Sporolide B and 9-epi-Sporolide B","Journal of the American Chemical Society","2010","132","","11350","11363","10.1021/ja1048994","","","0.71073","MoKα","","0.0701","0.0575","","","0.1457","0.1554","","","","","","1.06","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102837","18.1","0.006","18.1","0.006","15.019","0.008","90","","90","","90","","4920","3","174","2","174","2","","","","","","","","6","P 42 21 2","P 4n 2n","94","","","","- C38 H80 Mo P4 Pt2 Si2 -","- C38 H80 Mo P4 Pt2 Si2 -","- C152 H320 Mo4 P16 Pt8 Si8 -","4","0.5","","Holger Braunschweig; Peter Brenner; Manuela Gross; Krzysztof Radacki","Reactivity of [1],[1]Disilamolybdenocenophane toward Zerovalent Platinum Complexes","Journal of the American Chemical Society","2010","132","","11343","11349","10.1021/ja1049548","","","0.71073","MoKα","","0.0354","0.0288","","","0.0659","0.0702","","","","","","1.148","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102838","38.232","0.002","13.6822","0.0007","20.0104","0.0011","90","","96.374","0.003","90","","10402.7","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C103.5 H176 Mo2 P4 Pt4 Si4 -","- C103.5 H176 Mo2 P4 Pt4 Si4 -","- C414 H704 Mo8 P16 Pt16 Si16 -","4","1","","Holger Braunschweig; Peter Brenner; Manuela Gross; Krzysztof Radacki","Reactivity of [1],[1]Disilamolybdenocenophane toward Zerovalent Platinum Complexes","Journal of the American Chemical Society","2010","132","","11343","11349","10.1021/ja1049548","","","0.71073","MoKα","","0.0737","0.0441","","","0.0806","0.0896","","","","","","1.093","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102839","9.4347","0.0011","11.0663","0.0012","16.4581","0.0019","72.678","0.003","85.306","0.004","78.765","0.003","1608.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H53 Mo P Pt Si2 -","- C32 H53 Mo P Pt Si2 -","- C64 H106 Mo2 P2 Pt2 Si4 -","2","1","","Holger Braunschweig; Peter Brenner; Manuela Gross; Krzysztof Radacki","Reactivity of [1],[1]Disilamolybdenocenophane toward Zerovalent Platinum Complexes","Journal of the American Chemical Society","2010","132","","11343","11349","10.1021/ja1049548","","","0.71073","MoKα","","0.0221","0.0215","","","0.0526","0.0531","","","","","","1.047","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102840","9.1633","0.0012","11.3828","0.0016","16.167","0.002","93.76","0.006","99.869","0.005","104.304","0.006","1599.5","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H53 Mo P Pt Si2 -","- C32 H53 Mo P Pt Si2 -","- C64 H106 Mo2 P2 Pt2 Si4 -","2","1","","Holger Braunschweig; Peter Brenner; Manuela Gross; Krzysztof Radacki","Reactivity of [1],[1]Disilamolybdenocenophane toward Zerovalent Platinum Complexes","Journal of the American Chemical Society","2010","132","","11343","11349","10.1021/ja1049548","","","0.71073","MoKα","","0.0229","0.0206","","","0.0514","0.0525","","","","","","1.056","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102841","7.542","0.003","12.024","0.005","19.024","0.009","86.392","0.014","81.246","0.015","86.001","0.015","1698.5","1.3","200","2","200","2","","","","","","","","2","P -1","-P 1","2","","","","- C88 H98 -","- C88 H98 -","- C88 H98 -","1","0.5","","Akihito Konishi; Yasukazu Hirao; Masayoshi Nakano; Akihiro Shimizu; Edith Botek; Benoît Champagne; Daisuke Shiomi; Kazunobu Sato; Takeji Takui; Kouzou Matsumoto; Hiroyuki Kurata; Takashi Kubo","Synthesis and Characterization of Teranthene: A Singlet Biradical Polycyclic Aromatic Hydrocarbon Having Kekulé Structures","Journal of the American Chemical Society","2010","132","","11021","11023","10.1021/ja1049737","","","0.71075","MoKα","","0.0917","0.0567","","","0.1734","0.1969","","","","","","1.086","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102842","10.8506","0.0018","13.267","0.002","17.997","0.003","90","","90","","90","","2590.8","0.7","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H29 N O4 -","- C32 H29 N O4 -","- C128 H116 N4 O16 -","4","1","","Yvette S. Mimieux Vaske; Maximillian E. Mahoney; Joseph P. Konopelski; David L. Rogow; William J. McDonald","Enantiomerically Puretrans-β-Lactams from α-Amino Acids via Compact Fluorescent Light (CFL) Continuous-Flow Photolysis","Journal of the American Chemical Society","2010","132","","11379","11385","10.1021/ja1050023","","","0.71073","MoKα","","0.0434","0.0341","","","0.071","0.0753","","","","","","1.021","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102843","9.51","0.003","11.941","0.006","23.992","0.008","90","","92.13","0.03","90","","2722.6","1.9","133","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H31 N2 O4 -","- C33 H31 N2 O4 -","- C132 H124 N8 O16 -","4","2","","Yvette S. Mimieux Vaske; Maximillian E. Mahoney; Joseph P. Konopelski; David L. Rogow; William J. McDonald","Enantiomerically Puretrans-β-Lactams from α-Amino Acids via Compact Fluorescent Light (CFL) Continuous-Flow Photolysis","Journal of the American Chemical Society","2010","132","","11379","11385","10.1021/ja1050023","","","0.71073","MoKα","","0.0698","0.0447","","","0.0892","0.1004","","","","","","1.009","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102844","7.76","0.013","10.958","0.019","15.61","0.03","90","","99.559","0.016","90","","1309","4","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H33 N2 O4 -","- C33 H33 N2 O4 -","- C66 H66 N4 O8 -","2","1","","Yvette S. Mimieux Vaske; Maximillian E. Mahoney; Joseph P. Konopelski; David L. Rogow; William J. McDonald","Enantiomerically Puretrans-β-Lactams from α-Amino Acids via Compact Fluorescent Light (CFL) Continuous-Flow Photolysis","Journal of the American Chemical Society","2010","132","","11379","11385","10.1021/ja1050023","","","0.71073","MoKα","","0.0306","0.0285","","","0.0685","0.07","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102845","9.3264","0.0014","14.781","0.002","18.711","0.003","90","","90","","90","","2579.4","0.7","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H29 N4 O5 -","- C28 H29 N4 O5 -","- C112 H116 N16 O20 -","4","1","","Yvette S. Mimieux Vaske; Maximillian E. Mahoney; Joseph P. Konopelski; David L. Rogow; William J. McDonald","Enantiomerically Puretrans-β-Lactams from α-Amino Acids via Compact Fluorescent Light (CFL) Continuous-Flow Photolysis","Journal of the American Chemical Society","2010","132","","11379","11385","10.1021/ja1050023","","","0.71073","MoKα","","0.0431","0.0385","","","0.0986","0.1024","","","","","","1.066","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102846","24.534","0.006","9.96","0.003","12.424","0.003","90","","90","","90","","3035.9","1.4","150","2","150","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C38 H36 N2 O4 -","- C38 H36 N2 O4 -","- C152 H144 N8 O16 -","4","1","","Yvette S. Mimieux Vaske; Maximillian E. Mahoney; Joseph P. Konopelski; David L. Rogow; William J. McDonald","Enantiomerically Puretrans-β-Lactams from α-Amino Acids via Compact Fluorescent Light (CFL) Continuous-Flow Photolysis","Journal of the American Chemical Society","2010","132","","11379","11385","10.1021/ja1050023","","","0.71073","MoKα","","0.0443","0.0364","","","0.0845","0.0886","","","","","","1.136","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102847","13.602","0.003","14.663","0.003","14.029","0.003","90","","95.01","0.03","90","","2787.3","1","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 B N2 O2 S -","- C29 H41 B N2 O2 S -","- C116 H164 B4 N8 O8 S4 -","4","1","","Hao Wang; Jianying Zhang; Hongfan Hu; Chunming Cui","Access to B=S and B=Se Double Bonds via Sulfur and Selenium Insertion into a B-H Bond and Hydrogen Migration","Journal of the American Chemical Society","2010","132","","10998","10999","10.1021/ja105021d","","","0.71073","MoKα","","0.1043","0.096","","","0.2611","0.2708","","","","","","1.152","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102848","13.375","0.007","14.196","0.008","14.971","0.008","90","","90.145","0.007","90","","2843","3","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H41 B N2 O2 Se -","- C29 H41 B N2 O2 Se -","- C116 H164 B4 N8 O8 Se4 -","4","1","","Hao Wang; Jianying Zhang; Hongfan Hu; Chunming Cui","Access to B=S and B=Se Double Bonds via Sulfur and Selenium Insertion into a B-H Bond and Hydrogen Migration","Journal of the American Chemical Society","2010","132","","10998","10999","10.1021/ja105021d","","","0.71073","MoKα","","0.0633","0.0566","","","0.1434","0.1498","","","","","","1.045","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102849","10.096","0.008","11.064","0.01","11.9103","0.0014","89.107","0.008","78.26","0.008","75.326","0.007","1259.2","1.5","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H14 Fe -","- C16 H14 Fe -","- C64 H56 Fe4 -","4","2","","Joseph M. O'Connor; Kim K. Baldridge; Betsy L. Rodgers; Marissa Aubrey; Ryan L. Holland; W. Scott Kassel; Arnold L. Rheingold","A Photochemical Metallocene Route to Anionic Enediynes: Synthesis, Solid-State Structures, and ab Initio Computations on Cyclopentadienidoenediynes","Journal of the American Chemical Society","2010","132","","11030","11032","10.1021/ja105149k","","","0.71073","MoKα","","0.0546","0.0427","","","0.1055","0.1129","","","","","","1.033","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102850","12.3912","0.0008","18.543","0.0012","19.2709","0.0012","91.317","0.001","105.934","0.001","95.163","0.001","4235.2","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H18 Fe O2 -","- C28 H18 Fe O2 -","- C224 H144 Fe8 O16 -","8","4","","Joseph M. O'Connor; Kim K. Baldridge; Betsy L. Rodgers; Marissa Aubrey; Ryan L. Holland; W. Scott Kassel; Arnold L. Rheingold","A Photochemical Metallocene Route to Anionic Enediynes: Synthesis, Solid-State Structures, and ab Initio Computations on Cyclopentadienidoenediynes","Journal of the American Chemical Society","2010","132","","11030","11032","10.1021/ja105149k","","","0.71073","MoKα","","0.0377","0.0334","","","0.0872","0.0895","","","","","","1.079","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102851","10.2259","0.0006","11.7586","0.0007","13.5232","0.0008","100.77","0.001","103.04","0.001","94.48","0.001","1543.89","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H14 Fe O4 -","- C18 H14 Fe O4 -","- C72 H56 Fe4 O16 -","4","2","","Joseph M. O'Connor; Kim K. Baldridge; Betsy L. Rodgers; Marissa Aubrey; Ryan L. Holland; W. Scott Kassel; Arnold L. Rheingold","A Photochemical Metallocene Route to Anionic Enediynes: Synthesis, Solid-State Structures, and ab Initio Computations on Cyclopentadienidoenediynes","Journal of the American Chemical Society","2010","132","","11030","11032","10.1021/ja105149k","","","0.71073","MoKα","","0.0349","0.0306","","","0.0759","0.0786","","","","","","1.028","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102852","13.2416","0.001","17.3908","0.0013","23.0341","0.0017","90","","90.8","0.001","90","","5303.8","0.7","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C69 H57 Fe O2 P3 -","- C69 H57 Fe O2 P3 -","- C276 H228 Fe4 O8 P12 -","4","2","","Joseph M. O'Connor; Kim K. Baldridge; Betsy L. Rodgers; Marissa Aubrey; Ryan L. Holland; W. Scott Kassel; Arnold L. Rheingold","A Photochemical Metallocene Route to Anionic Enediynes: Synthesis, Solid-State Structures, and ab Initio Computations on Cyclopentadienidoenediynes","Journal of the American Chemical Society","2010","132","","11030","11032","10.1021/ja105149k","","","0.71073","MoKα","","0.0483","0.0407","","","0.0951","0.0988","","","","","","1.019","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102853","9.9968","0.0005","25.255","0.0012","22.4254","0.0011","90","","96.173","0.001","90","","5628.9","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C59 H53 Fe O4 P3 -","- C59 H53 Fe O4 P3 -","- C236 H212 Fe4 O16 P12 -","4","1","","Joseph M. O'Connor; Kim K. Baldridge; Betsy L. Rodgers; Marissa Aubrey; Ryan L. Holland; W. Scott Kassel; Arnold L. Rheingold","A Photochemical Metallocene Route to Anionic Enediynes: Synthesis, Solid-State Structures, and ab Initio Computations on Cyclopentadienidoenediynes","Journal of the American Chemical Society","2010","132","","11030","11032","10.1021/ja105149k","","","0.71073","MoKα","","0.0713","0.0587","","","0.1575","0.1633","","","","","","1.088","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102854","8.487","0.009","11.047","0.012","15.467","0.017","102.312","0.015","97.659","0.015","90.56","0.016","1403","3","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H30 Cl2 N4 O6 S2 -","- C24 H30 Cl2 N4 O6 S2 -","- C48 H60 Cl4 N8 O12 S4 -","2","1","","Xiaohua Li; Samuel J. Danishefsky","Cyclobutenone as a Highly Reactive Dienophile: Expanding Upon Diels-Alder Paradigms","Journal of the American Chemical Society","2010","132","","11004","11005","10.1021/ja1056888","","","0.71073","MoKα","","0.5785","0.1455","","","0.2807","0.4383","","","","","","0.867","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102855","6.946","0.0006","8.9632","0.0008","10.3522","0.0009","90","","90","","90","","644.51","0.1","125","2","125","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C8 H8 O2 -","- C8 H8 O2 -","- C32 H32 O8 -","4","1","","Xiaohua Li; Samuel J. Danishefsky","Cyclobutenone as a Highly Reactive Dienophile: Expanding Upon Diels-Alder Paradigms","Journal of the American Chemical Society","2010","132","","11004","11005","10.1021/ja1056888","","","0.71073","MoKα","","0.0368","0.0347","","","0.0911","0.0933","","","","","","1.069","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102856","16.6571","0.0015","10.4157","0.0009","19.8332","0.0018","90","","90","","90","","3441","0.5","125","2","125","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H18 O2 -","- C24 H18 O2 -","- C192 H144 O16 -","8","1","","Xiaohua Li; Samuel J. Danishefsky","Cyclobutenone as a Highly Reactive Dienophile: Expanding Upon Diels-Alder Paradigms","Journal of the American Chemical Society","2010","132","","11004","11005","10.1021/ja1056888","","","0.71073","MoKα","","0.0635","0.0482","","","0.1174","0.1254","","","","","","1.111","","","","has coordinates,has disorder","178774","2020-10-21","18:00:00","" "4102857","18.042","0.003","9.7546","0.0014","18.24","0.003","90","","113.561","0.003","90","","2942.5","0.8","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 N2 -","- C19 H18 N2 -","- C152 H144 N16 -","8","2","","Hao Shen; Zuowei Xie","Atom-Economical Synthesis of N-Heterocycles via Cascade Inter-/Intramolecular C-N Bond-Forming Reactions Catalyzed by Ti Amides","Journal of the American Chemical Society","2010","132","","11473","11480","10.1021/ja101796k","","","0.71073","MoKα","","0.1131","0.0539","","","0.1326","0.1746","","","","","","1.006","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102858","10.187","0.005","15.423","0.008","9.57","0.005","90","","90","","90","","1503.6","1.3","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H18 N2 O -","- C19 H18 N2 O -","- C76 H72 N8 O4 -","4","1","","Hao Shen; Zuowei Xie","Atom-Economical Synthesis of N-Heterocycles via Cascade Inter-/Intramolecular C-N Bond-Forming Reactions Catalyzed by Ti Amides","Journal of the American Chemical Society","2010","132","","11473","11480","10.1021/ja101796k","","","0.71073","MoKα","","0.0555","0.0395","","","0.1007","0.1134","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102859","20.1718","0.0006","5.8933","0.0002","27.0472","0.0008","90","","100.746","0.001","90","","3158.94","0.17","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 N2 -","- C20 H20 N2 -","- C160 H160 N16 -","8","1","","Hao Shen; Zuowei Xie","Atom-Economical Synthesis of N-Heterocycles via Cascade Inter-/Intramolecular C-N Bond-Forming Reactions Catalyzed by Ti Amides","Journal of the American Chemical Society","2010","132","","11473","11480","10.1021/ja101796k","","","0.71073","MoKα","","0.1032","0.0583","","","0.1733","0.217","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102860","19.3","0.03","51.31","0.07","5.903","0.008","90","","90","","90","","5846","14","296","2","296","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C17 H16 N2 -","- C17 H16 N2 -","- C272 H256 N32 -","16","1","","Hao Shen; Zuowei Xie","Atom-Economical Synthesis of N-Heterocycles via Cascade Inter-/Intramolecular C-N Bond-Forming Reactions Catalyzed by Ti Amides","Journal of the American Chemical Society","2010","132","","11473","11480","10.1021/ja101796k","","","0.71073","MoKα","","0.1357","0.0511","","","0.1022","0.1318","","","","","","0.996","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102861","19.342","0.001","17.36","0.001","12.514","0.001","90","","90","","90","","4201.9","0.5","50","","50","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C36 H52 B2 Cu2 F8 N8 O4 -","- C36 H52 B2 Cu2 F8 N8 O4 -","- C144 H208 B8 Cu8 F32 N32 O16 -","4","0.5","","Atsushi Okazawa; Daisuke Hashizume; Takayuki Ishida","Ferro- and Antiferromagnetic Coupling Switch Accompanied by Twist Deformation around the Copper(II) and Nitroxide Coordination Bond","Journal of the American Chemical Society","2010","132","","11516","11524","10.1021/ja102163d","","","0.61792","synchrotron","","0.0667","0.0411","","","0.0937","0.114","","","","","","1.026","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102862","20.012","0.001","17.27","0.001","12.711","0.001","90","","90","","90","","4393","0.5","300","","300","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C36 H52 B2 Cu2 F8 N8 O4 -","- C36 H52 B2 Cu2 F8 N8 O4 -","- C144 H208 B8 Cu8 F32 N32 O16 -","4","0.5","","Atsushi Okazawa; Daisuke Hashizume; Takayuki Ishida","Ferro- and Antiferromagnetic Coupling Switch Accompanied by Twist Deformation around the Copper(II) and Nitroxide Coordination Bond","Journal of the American Chemical Society","2010","132","","11516","11524","10.1021/ja102163d","","","0.6869","synchrotron","","0.0716","0.0565","","","0.1527","0.1696","","","","","","1.087","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102863","19.771","0.015","17.178","0.015","12.672","0.011","90","","90","","90","","4304","6","90","","90","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H52 Cl2 Cu2 N8 O12 -","- C36 H52 Cl2 Cu2 N8 O12 -","- C144 H208 Cl8 Cu8 N32 O48 -","4","0.5","","Atsushi Okazawa; Daisuke Hashizume; Takayuki Ishida","Ferro- and Antiferromagnetic Coupling Switch Accompanied by Twist Deformation around the Copper(II) and Nitroxide Coordination Bond","Journal of the American Chemical Society","2010","132","","11516","11524","10.1021/ja102163d","","","0.71073","MoKα","","","0.0308","","","","0.0388","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102864","18.193","0.004","3.8471","0.0008","14.112","0.003","90","","91.958","0.014","90","","987.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","6'-dehydroxyoxyluciferin","","","- C10 H6 N2 O S2 -","- C10 H6 N2 O S2 -","- C40 H24 N8 O4 S8 -","4","1","","Panče Naumov; Manoj Kochunnoonny","Spectral-Structural Effects of the Keto-Enol-Enolate and Phenol-Phenolate Equilibria of Oxyluciferin","Journal of the American Chemical Society","2010","132","","11566","11579","10.1021/ja102885g","","","0.71073","MoKα","","0.1083","0.0647","","","0.1608","0.1965","","","","","","1.08","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102865","5.3039","0.0002","9.4806","0.0005","23.0485","0.0011","90","","90","","90","","1158.97","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","D(-)-luciferin","","","- C11 H8 N2 O3 S2 -","- C11 H8 N2 O3 S2 -","- C44 H32 N8 O12 S8 -","4","1","","Panče Naumov; Manoj Kochunnoonny","Spectral-Structural Effects of the Keto-Enol-Enolate and Phenol-Phenolate Equilibria of Oxyluciferin","Journal of the American Chemical Society","2010","132","","11566","11579","10.1021/ja102885g","","","0.71073","MoKα","","0.0538","0.0381","","","0.0843","0.0907","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102866","11.3882","0.0003","10.7673","0.0004","20.474","0.0008","90","","90","","90","","2510.53","0.15","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","4-dehydroxy-5,5-dimethyloxyluciferin","","","- C12 H12 N2 O S2 -","- C12 H12 N2 O S2 -","- C96 H96 N16 O8 S16 -","8","1","","Panče Naumov; Manoj Kochunnoonny","Spectral-Structural Effects of the Keto-Enol-Enolate and Phenol-Phenolate Equilibria of Oxyluciferin","Journal of the American Chemical Society","2010","132","","11566","11579","10.1021/ja102885g","","","0.71073","MoKα","","0.0908","0.0447","","","0.0949","0.1089","","","","","","0.972","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102867","6.0196","0.0007","10.3193","0.0012","23.441","0.003","90","","90","","90","","1456.1","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","D(-)-5,5-dimethylluciferin","","","- C13 H14 N2 O4 S2 -","- C13 H14 N2 O4 S2 -","- C52 H56 N8 O16 S8 -","4","1","","Panče Naumov; Manoj Kochunnoonny","Spectral-Structural Effects of the Keto-Enol-Enolate and Phenol-Phenolate Equilibria of Oxyluciferin","Journal of the American Chemical Society","2010","132","","11566","11579","10.1021/ja102885g","","","0.71073","MoKα","","0.03","0.025","","","0.054","0.0561","","","","","","1.075","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102868","9.3204","0.0002","13.5483","0.0002","6.5794","0.0001","90","","106.479","0.001","90","","796.69","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0376","0.036","","","0.0901","0.0915","","","","","","1.109","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102869","9.3198","0.0002","13.548","0.0002","6.579","0.0001","90","","106.475","0.001","90","","796.59","0.02","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0355","0.0338","","","0.0827","0.0842","","","","","","1.129","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102870","9.3198","0.0002","13.5479","0.0002","6.5789","0.0001","90","","106.472","0.001","90","","796.58","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0355","0.0339","","","0.0823","0.0835","","","","","","1.116","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102871","9.3199","0.0002","13.548","0.0002","6.5788","0.0001","90","","106.468","0.001","90","","796.6","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.098","0.0947","","","0.2385","0.2424","","","","","","1.081","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102872","9.3203","0.0002","13.5485","0.0002","6.5792","0.0001","90","","106.466","0.001","90","","796.72","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0968","0.094","","","0.2355","0.2401","","","","","","1.08","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102873","9.3201","0.0002","13.548","0.0002","6.5789","0.0001","90","","106.464","0.001","90","","796.65","0.02","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0971","0.0944","","","0.2376","0.2412","","","","","","1.078","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102874","9.3204","0.0002","13.548","0.0003","6.5788","0.0001","90","","106.46","0.001","90","","796.68","0.03","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0966","0.0939","","","0.2352","0.2395","","","","","","1.08","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102875","9.3208","0.0002","13.5481","0.0002","6.5791","0.0001","90","","106.456","0.001","90","","796.77","0.02","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0343","0.0329","","","0.0806","0.0817","","","","","","1.104","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102876","9.3211","0.0002","13.5484","0.0003","6.579","0.0001","90","","106.45","0.001","90","","796.83","0.03","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0959","0.0931","","","0.2332","0.2369","","","","","","1.08","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102877","9.3214","0.0002","13.5483","0.0003","6.5792","0.0001","90","","106.446","0.001","90","","796.89","0.03","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0963","0.093","","","0.2294","0.2334","","","","","","1.078","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102878","9.3218","0.0002","13.549","0.0002","6.5793","0.0001","90","","106.44","0.001","90","","797","0.02","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0949","0.0923","","","0.2324","0.2359","","","","","","1.082","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102879","9.3218","0.0002","13.5491","0.0002","6.5792","0.0001","90","","106.437","0.001","90","","797.01","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0945","0.0913","","","0.2299","0.234","","","","","","1.078","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102880","9.3222","0.0002","13.549","0.0002","6.5794","0.0001","90","","106.433","0.001","90","","797.07","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0951","0.0916","","","0.2294","0.2341","","","","","","1.082","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102881","9.3226","0.0002","13.5496","0.0002","6.5794","0.0001","90","","106.427","0.001","90","","797.17","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.094","0.0911","","","0.2277","0.2318","","","","","","1.082","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102882","9.3231","0.0002","13.5498","0.0002","6.5795","0.0001","90","","106.42","0.001","90","","797.26","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0934","0.0907","","","0.2256","0.2291","","","","","","1.092","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102883","9.3232","0.0002","13.5499","0.0002","6.5795","0.0001","90","","106.417","0.001","90","","797.29","0.02","296","2","296","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0932","0.0902","","","0.2258","0.2297","","","","","","1.095","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102884","9.3231","0.0002","13.5497","0.0003","6.5793","0.0001","90","","106.414","0.001","90","","797.26","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0932","0.0904","","","0.2252","0.2289","","","","","","1.085","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102885","9.3237","0.0002","13.55","0.0002","6.5797","0.0001","90","","106.408","0.001","90","","797.4","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0933","0.0903","","","0.2244","0.2283","","","","","","1.092","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102886","9.324","0.0002","13.5505","0.0002","6.5797","0.0001","90","","106.404","0.001","90","","797.47","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0925","0.0894","","","0.2256","0.2299","","","","","","1.071","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102887","9.3222","0.0001","13.5569","0.0001","6.5852","0.0001","90","","106.507","0.001","90","","797.938","0.016","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0512","0.0455","","","0.1149","0.1221","","","","","","1.03","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102888","9.3252","0.0002","13.5608","0.0002","6.5854","0.0001","90","","106.442","0.001","90","","798.72","0.02","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0482","0.0414","","","0.1119","0.1183","","","","","","1.03","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102889","9.3297","0.0002","13.5636","0.0003","6.5887","0.0002","90","","106.349","0.001","90","","800.05","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0556","0.0465","","","0.1263","0.1343","","","","","","1.035","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102890","9.3348","0.0003","13.5692","0.0005","6.5881","0.0003","90","","106.298","0.002","90","","800.95","0.05","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0626","0.0503","","","0.1314","0.1405","","","","","","1.033","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102891","9.3356","0.0003","13.5689","0.0005","6.5929","0.0003","90","","106.24","0.002","90","","801.82","0.05","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.088","0.0658","","","0.1645","0.1786","","","","","","1.04","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102892","9.3409","0.0006","13.5708","0.0009","6.5947","0.0004","90","","106.193","0.004","90","","802.8","0.09","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1062","0.0605","","","0.1592","0.1856","","","","","","1.025","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102893","9.3362","0.0008","13.5746","0.0012","6.6014","0.0006","90","","106.262","0.006","90","","803.16","0.13","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1157","0.0628","","","0.1655","0.1927","","","","","","1.042","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102894","9.3425","0.0008","13.5732","0.0012","6.6003","0.0006","90","","106.186","0.006","90","","803.79","0.13","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1419","0.0878","","","0.2169","0.2556","","","","","","0.977","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102895","9.346","0.0007","13.5777","0.0012","6.5936","0.0005","90","","106.204","0.006","90","","803.47","0.11","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1549","0.0895","","","0.2082","0.2509","","","","","","0.967","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102896","9.3485","0.0006","13.583","0.001","6.5934","0.0005","90","","106.167","0.005","90","","804.13","0.1","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1505","0.0781","","","0.1766","0.214","","","","","","0.946","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102897","9.3479","0.0006","13.5823","0.001","6.5943","0.0005","90","","106.151","0.005","90","","804.21","0.1","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1568","0.073","","","0.1689","0.2054","","","","","","0.954","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102898","9.3502","0.0006","13.5844","0.001","6.5948","0.0005","90","","106.122","0.005","90","","804.71","0.1","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1652","0.0719","","","0.16","0.1933","","","","","","0.958","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102899","9.3316","0.0011","13.5678","0.0016","6.5866","0.0007","90","","106.178","0.007","90","","800.9","0.16","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.1942","0.0828","","","0.2118","0.2882","","","","","","1.894","","","","has coordinates","178774","2020-10-21","18:00:00","" "4102900","9.3235","0.0006","13.5573","0.0009","6.5865","0.0005","90","","106.533","0.001","90","","798.12","0.1","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0252","0.024","","","0.0602","0.0607","","","","","","1.121","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102901","9.3242","0.0002","13.5575","0.0003","6.5875","0.0001","90","","106.517","0.001","90","","798.38","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0913","0.0576","","","0.1464","0.1665","","","","","","1.02","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102902","9.3244","0.0002","13.5579","0.0003","6.5877","0.0001","90","","106.512","0.001","90","","798.47","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0902","0.0569","","","0.1463","0.1671","","","","","","1.015","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102903","9.3245","0.0002","13.5582","0.0003","6.5876","0.0001","90","","106.504","0.001","90","","798.51","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0913","0.0575","","","0.1519","0.1743","","","","","","1.009","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102904","9.3249","0.0002","13.5583","0.0003","6.5875","0.0001","90","","106.5","0.001","90","","798.56","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0923","0.0595","","","0.1518","0.1721","","","","","","1.018","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102905","9.3257","0.0002","13.5589","0.0003","6.5879","0.0001","90","","106.496","0.001","90","","798.73","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0905","0.0585","","","0.1509","0.1708","","","","","","1.013","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102906","9.3253","0.0002","13.5586","0.0003","6.5877","0.0001","90","","106.492","0.001","90","","798.67","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0935","0.0595","","","0.1551","0.1776","","","","","","1.011","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102907","9.3257","0.0002","13.5587","0.0003","6.5876","0.0001","90","","106.487","0.001","90","","798.72","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0932","0.0589","","","0.1494","0.171","","","","","","1.013","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102908","9.3265","0.0002","13.5596","0.0003","6.5879","0.0001","90","","106.484","0.001","90","","798.89","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0946","0.0602","","","0.1551","0.1772","","","","","","1.022","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102909","9.3267","0.0002","13.5596","0.0003","6.588","0.0001","90","","106.48","0.001","90","","798.93","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0925","0.0594","","","0.155","0.1765","","","","","","1.017","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102910","9.3261","0.0002","13.5597","0.0003","6.5877","0.0001","90","","106.475","0.001","90","","798.87","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0931","0.0596","","","0.153","0.1747","","","","","","1.015","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102911","9.3268","0.0002","13.56","0.0003","6.5878","0.0001","90","","106.472","0.001","90","","798.97","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0936","0.06","","","0.1586","0.1816","","","","","","1.006","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102912","9.3264","0.0002","13.559","0.0003","6.5876","0.0001","90","","106.471","0.001","90","","798.86","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0932","0.0591","","","0.1508","0.1718","","","","","","1.014","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102913","9.3266","0.0002","13.5579","0.0003","6.5869","0.0001","90","","106.462","0.001","90","","798.77","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0961","0.0618","","","0.1582","0.1802","","","","","","1.015","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102914","9.3286","0.0002","13.5614","0.0003","6.5881","0.0001","90","","106.447","0.001","90","","799.35","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0948","0.0617","","","0.1597","0.1819","","","","","","1.007","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102915","9.3294","0.0002","13.5627","0.0003","6.5886","0.0001","90","","106.44","0.001","90","","799.58","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0962","0.0626","","","0.1617","0.1839","","","","","","1.012","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102916","9.3299","0.0002","13.5634","0.0003","6.5888","0.0001","90","","106.436","0.001","90","","799.71","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0973","0.0634","","","0.1657","0.1884","","","","","","1.011","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102917","9.3301","0.0002","13.5634","0.0003","6.5888","0.0001","90","","106.43","0.001","90","","799.75","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0973","0.0635","","","0.1654","0.1875","","","","","","1.013","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102918","9.3308","0.0002","13.5643","0.0003","6.589","0.0001","90","","106.428","0.001","90","","799.9","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0949","0.0622","","","0.1644","0.1878","","","","","","1.008","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102919","9.3303","0.0002","13.5634","0.0003","6.5888","0.0001","90","","106.422","0.001","90","","799.8","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0925","0.0603","","","0.1586","0.1799","","","","","","1.007","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102920","9.3298","0.0002","13.5627","0.0003","6.5882","0.0001","90","","106.421","0.001","90","","799.65","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0982","0.0622","","","0.1591","0.1814","","","","","","1.007","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102921","9.3303","0.0002","13.5624","0.0003","6.5879","0.0001","90","","106.411","0.001","90","","799.68","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0958","0.0601","","","0.1547","0.1765","","","","","","1.012","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102922","9.3313","0.0002","13.5636","0.0003","6.5884","0.0002","90","","106.402","0.001","90","","799.93","0.03","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Panče Naumov; Petre Makreski; Gjorgji Petruševski; Tomče Runčevski; Gligor Jovanovski","Visualization of a Discrete Solid-State Process with Steady-State X-ray Diffraction: Observation of Hopping of Sulfur Atoms in Single Crystals of Realgar","Journal of the American Chemical Society","2010","132","","11398","11401","10.1021/ja1030672","","","0.71073","MoKα","","0.0954","0.0605","","","0.1551","0.1759","","","","","","1.017","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102923","64.04","0.06","64.19","0.06","64.25","0.06","90","","90","","90","","264114","4","293","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C83 H115 Br N19 O23 -","- C338 Br2.65 N75.9 O182 -","- C4056 Br31.8 N910.8 O2184 -","12","3","","Omid Khakshoor; Aaron J. Lin; Tyler P. Korman; Michael R. Sawaya; Shiou-Chuan Tsai; David Eisenberg; James S. Nowick","X-ray Crystallographic Structure of an Artificial β-Sheet Dimer","Journal of the American Chemical Society","2010","132","","11622","11628","10.1021/ja103438w","","","0.97853","","","0.1504","","","","","","","","","","","","","","","has coordinates,has disorder","189821","2020-10-21","18:00:00","" "4102924","8.2451","0.0014","19.209","0.003","8.738","0.0015","90","","103.634","0.002","90","","1344.9","0.4","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H38 Cl6 In2 N2 O4 -","- C14 H38 Cl6 In2 N2 O4 -","- C28 H76 Cl12 In4 N4 O8 -","2","0.5","","Agostino Pietrangelo; Spencer C. Knight; Aalo K. Gupta; Letitia J. Yao; Marc A. Hillmyer; William B. Tolman","Mechanistic Study of the Stereoselective Polymerization of d,l-Lactide Using Indium(III) Halides","Journal of the American Chemical Society","2010","132","","11649","11657","10.1021/ja103841h","","","0.71073","MoKα","","0.0604","0.0343","","","0.0655","0.074","","","","","","1.105","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102925","24.8548","0.0003","33.1678","0.0004","40.1311","0.0004","94.99","0.002","94.485","0.002","109.091","0.002","30944.7","0.7","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- Fe2 H474 K44 Na10 O640 Se8 W119 -","- Fe2 K28.95 Na5.35 O463.05 Se8 W119 -","- Fe4 K57.9 Na10.7 O926.1 Se16 W238 -","2","1","","Jun Yan; Jing Gao; De-Liang Long; Haralampos N. Miras; Leroy Cronin","Self-Assembly of a Nanosized, Saddle-Shaped, Solution-Stable Polyoxometalate Anion Built from Pentagonal Building Blocks: [H34W119Se8Fe2O420]54-","Journal of the American Chemical Society","2010","132","","11410","11411","10.1021/ja104043s","","","1.54184","CuKα","","0.0915","0.0669","","","0.1775","0.1998","","","","","","0.98","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102926","9.0552","0.0004","12.8869","0.0006","12.0073","0.0005","90","","103.344","0.002","90","","1363.34","0.1","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","EMS-VIII-007D","bertozzi01","","- C36 H30 F6 -","- C36 H30 F6 -","- C72 H60 F12 -","2","1","","Ellen M. Sletten; Hitomi Nakamura; John C. Jewett; Carolyn R. Bertozzi","Difluorobenzocyclooctyne: Synthesis, Reactivity, and Stabilization by β-Cyclodextrin","Journal of the American Chemical Society","2010","132","","11799","11805","10.1021/ja105005t","","","1.54178","CuKα","","0.0282","0.0274","","","0.0735","0.0744","","","","","","1.038","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102927","10.961","0.0004","11.2443","0.0004","24.9515","0.0009","90.207","0.002","100.731","0.002","115.162","0.002","2722.88","0.18","100","2","100","2","","","","","","","","3","P -1","-P 1","2","EMS-VIII-007E","bertozzi02","","- C36 H30 F6 -","- C36 H30 F6 -","- C144 H120 F24 -","4","2","","Ellen M. Sletten; Hitomi Nakamura; John C. Jewett; Carolyn R. Bertozzi","Difluorobenzocyclooctyne: Synthesis, Reactivity, and Stabilization by β-Cyclodextrin","Journal of the American Chemical Society","2010","132","","11799","11805","10.1021/ja105005t","","","1.54178","CuKα","","0.0464","0.0428","","","0.107","0.11","","","","","","1.028","","","","has coordinates,has disorder","204147","2020-10-21","18:00:00","" "4102928","10.9513","0.0005","14.9709","0.0007","15.4572","0.0007","63.01","0.002","75.207","0.002","80.666","0.002","2180.2","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","EMS-VIII-007B","bertozzi03","","- C51 H52 F8 O8 -","- C51 H52 F8 O8 -","- C102 H104 F16 O16 -","2","1","","Ellen M. Sletten; Hitomi Nakamura; John C. Jewett; Carolyn R. Bertozzi","Difluorobenzocyclooctyne: Synthesis, Reactivity, and Stabilization by β-Cyclodextrin","Journal of the American Chemical Society","2010","132","","11799","11805","10.1021/ja105005t","","","1.54178","CuKα","","0.0358","0.0336","","","0.0839","0.086","","","","","","1.025","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102929","7.5863","0.0004","8.9598","0.0005","14.6268","0.0008","91.07","0.003","96.218","0.002","104.754","0.003","954.66","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","EMS-VIII-007C","bertozzi04","","- C24 H20 F4 O2 -","- C24 H20 F4 O2 -","- C48 H40 F8 O4 -","2","1","","Ellen M. Sletten; Hitomi Nakamura; John C. Jewett; Carolyn R. Bertozzi","Difluorobenzocyclooctyne: Synthesis, Reactivity, and Stabilization by β-Cyclodextrin","Journal of the American Chemical Society","2010","132","","11799","11805","10.1021/ja105005t","","","1.54178","CuKα","","0.0351","0.0322","","","0.0853","0.0883","","","","","","1.036","","","","has coordinates","204147","2020-10-21","18:00:00","" "4102930","5.057","0.004","6.437","0.006","43.83","0.04","90","","90","","90","","1427","2","93.1","","93.1","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 Br N O3 -","- C15 H18 Br N O3 -","- C60 H72 Br4 N4 O12 -","4","1","","Masato Ito; Chika Kobayashi; Akio Himizu; Takao Ikariya","Highly Enantioselective Hydrogenative Desymmetrization of Bicyclic Imides Leading to Multiply Functionalized Chiral Cyclic Compounds","Journal of the American Chemical Society","2010","132","","11414","11415","10.1021/ja105048c","","","0.7107","MoKα","","","0.0222","","","","0.0767","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102931","6.264","0.005","8.121","0.006","23.197","0.019","90","","98.044","0.014","90","","1168.4","1.6","193.1","","193.1","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N O4 -","- C14 H13 N O4 -","- C56 H52 N4 O16 -","4","1","","Masato Ito; Chika Kobayashi; Akio Himizu; Takao Ikariya","Highly Enantioselective Hydrogenative Desymmetrization of Bicyclic Imides Leading to Multiply Functionalized Chiral Cyclic Compounds","Journal of the American Chemical Society","2010","132","","11414","11415","10.1021/ja105048c","","","0.7107","MoKα","","","0.0387","","","","0.1412","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102932","11.161","0.005","9.014","0.004","13.808","0.006","90","","96.384","0.006","90","","1380.5","1.1","193.1","","193.1","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C18 H13 N O4 -","- C18 H13 N O4 -","- C72 H52 N4 O16 -","4","1","","Masato Ito; Chika Kobayashi; Akio Himizu; Takao Ikariya","Highly Enantioselective Hydrogenative Desymmetrization of Bicyclic Imides Leading to Multiply Functionalized Chiral Cyclic Compounds","Journal of the American Chemical Society","2010","132","","11414","11415","10.1021/ja105048c","","","0.7107","MoKα","","","0.038","","","","0.1121","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102933","6.071","0.003","11.108","0.006","19.141","0.011","90","","99.076","0.009","90","","1274.6","1.2","193.1","","193.1","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C60 H60 N4 O16 -","4","1","","Masato Ito; Chika Kobayashi; Akio Himizu; Takao Ikariya","Highly Enantioselective Hydrogenative Desymmetrization of Bicyclic Imides Leading to Multiply Functionalized Chiral Cyclic Compounds","Journal of the American Chemical Society","2010","132","","11414","11415","10.1021/ja105048c","","","0.7107","MoKα","","","0.0279","","","","0.1358","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102934","6.172","0.005","8.622","0.006","12.85","0.009","90","","101.54","0.009","90","","670","0.9","93.1","","93.1","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H17 N O4 -","- C16 H17 N O4 -","- C32 H34 N2 O8 -","2","1","","Masato Ito; Chika Kobayashi; Akio Himizu; Takao Ikariya","Highly Enantioselective Hydrogenative Desymmetrization of Bicyclic Imides Leading to Multiply Functionalized Chiral Cyclic Compounds","Journal of the American Chemical Society","2010","132","","11414","11415","10.1021/ja105048c","","","0.7107","MoKα","","","0.0443","","","","0.1296","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102935","9.1093","0.0003","10.1239","0.0003","17.6114","0.0005","90","","90","","90","","1624.15","0.09","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 I N O -","- C17 H18 I N O -","- C68 H72 I4 N4 O4 -","4","1","","Achim Bruch; Andrea Ambrosius; Roland Fröhlich; Armido Studer; David B. Guthrie; Hanmo Zhang; Dennis P. Curran","Memory of Axial Chirality in Aryl Radical Phosphanylations","Journal of the American Chemical Society","2010","132","","11452","11454","10.1021/ja105070k","","","0.71073","MoKα","","0.046","0.0326","","","0.0681","0.0743","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102936","9.0213","0.0004","15.8242","0.0006","18.3522","0.0008","76.991","0.002","77.126","0.002","89.725","0.002","2485.62","0.18","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H30 N O P S -","- C28 H30 N O P S -","- C112 H120 N4 O4 P4 S4 -","4","2","","Achim Bruch; Andrea Ambrosius; Roland Fröhlich; Armido Studer; David B. Guthrie; Hanmo Zhang; Dennis P. Curran","Memory of Axial Chirality in Aryl Radical Phosphanylations","Journal of the American Chemical Society","2010","132","","11452","11454","10.1021/ja105070k","","","1.54178","CuKα","","0.0612","0.0519","","","0.1358","0.1437","","","","","","1.038","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102937","15.0114","0.0019","26.305","0.003","24.52","0.003","90","","90","","90","","9682","2","293","2","293","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C44 H60.5 Br2 Cl4 N4 O2.5 -","- C44 H61 Br2 Cl3.7 N4 O1.7 -","- C352 H488 Br16 Cl29.6 N32 O13.6 -","8","1","","Qing-Feng Wu; Hu He; Wen-Bo Liu; Shu-Li You","Enantioselective Construction of Spiroindolenines by Ir-Catalyzed Allylic Alkylation Reactions","Journal of the American Chemical Society","2010","132","","11418","11419","10.1021/ja105111n","","","0.71073","MoKα","","0.263","0.0758","","","0.1846","0.2279","","","","","","0.659","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102938","9.171","0.004","10.99","0.005","23.442","0.011","90","","90","","90","","2362.7","1.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H29 Br Cl2 N2 O -","- C22 H29 Br Cl2 N2 O -","- C88 H116 Br4 Cl8 N8 O4 -","4","1","","Qing-Feng Wu; Hu He; Wen-Bo Liu; Shu-Li You","Enantioselective Construction of Spiroindolenines by Ir-Catalyzed Allylic Alkylation Reactions","Journal of the American Chemical Society","2010","132","","11418","11419","10.1021/ja105111n","","","0.71073","MoKα","","0.1358","0.0694","","","0.1689","0.1852","","","","","","0.874","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102939","12.713","0.003","14.02","0.003","20.454","0.004","103.03","0.04","94.58","0.03","93.89","0.03","3526.6","1.5","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H109 Mo24 N3 O98 P2 S10 V3 -","- C46 H109 Mo24 N3 O98 P2 S10 V3 -","- C46 H109 Mo24 N3 O98 P2 S10 V3 -","1","0.5","","Alexander M. Khenkin; Gregory Leitus; Ronny Neumann","Electron Transfer-Oxygen Transfer Oxygenation of Sulfides Catalyzed by the H5PV2Mo10O40 Polyoxometalate","Journal of the American Chemical Society","2010","132","","11446","11448","10.1021/ja105183w","","","0.71073","MoKα","","0.0975","0.0776","","","0.1656","0.1793","","","","","","1.139","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102940","12.813","0.007","19.418","0.011","13.857","0.007","90","","94.996","0.002","90","","3435","3","103.15","","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H110 B4 Li2 N4 O4 -","- C68 H110 B4 Li2 N4 O4 -","- C136 H220 B8 Li4 N8 O8 -","2","0.5","","Kyoko Nozaki; Yoshitaka Aramaki; Makoto Yamashita; Shau-Hua Ueng; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Boryltrihydroborate: Synthesis, Structure, and Reactivity as a Reductant in Ionic, Organometallic, and Radical Reactions","Journal of the American Chemical Society","2010","132","","11449","11451","10.1021/ja105277u","","","0.7107","MoKα","","0.0878","0.076","","","0.2006","0.2123","","","","","","1.06","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102941","39.937","0.006","11.3904","0.0015","16.069","0.002","90","","94.863","0.008","90","","7283.4","1.7","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C141 H240 Ir4 N8 P8 -","- C141 H240 Ir4 N8 P8 -","- C282 H480 Ir8 N16 P16 -","2","0.5","","Zheng Huang; Jianrong (Steve) Zhou; John F. Hartwig","N-H Activation of Hydrazines by Iridium(I). Double N-H Activation To Form Iridium Aminonitrene Complexes","Journal of the American Chemical Society","2010","132","","11458","11460","10.1021/ja1053835","","","0.71073","MoKα","","0.15","0.0569","","","0.0746","0.0933","","","","","","0.922","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102942","10.7017","0.0004","16.239","0.0007","20.6097","0.0009","90","","90","","90","","3581.7","0.3","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H55 Ir N2 P2 -","- C37 H55 Ir N2 P2 -","- C148 H220 Ir4 N8 P8 -","4","1","","Zheng Huang; Jianrong (Steve) Zhou; John F. Hartwig","N-H Activation of Hydrazines by Iridium(I). Double N-H Activation To Form Iridium Aminonitrene Complexes","Journal of the American Chemical Society","2010","132","","11458","11460","10.1021/ja1053835","","","0.71073","MoKα","","0.0267","0.0221","","","0.0393","0.0405","","","","","","0.99","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102943","11.8165","0.0003","11.9552","0.0003","14.4984","0.0003","110.418","0.002","112.256","0.002","90.657","0.002","1751.97","0.08","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H67 Ir N2 P2 -","- C31 H67 Ir N2 P2 -","- C62 H134 Ir2 N4 P4 -","2","1","","Zheng Huang; Jianrong (Steve) Zhou; John F. Hartwig","N-H Activation of Hydrazines by Iridium(I). Double N-H Activation To Form Iridium Aminonitrene Complexes","Journal of the American Chemical Society","2010","132","","11458","11460","10.1021/ja1053835","","","0.71073","MoKα","","0.0238","0.0192","","","0.0451","0.0467","","","","","","1.039","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102944","17.5546","0.0006","16.563","0.0007","21.3249","0.0008","90","","90","","90","","6200.4","0.4","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C29 H53 Ir N2 P2 -","- C29 H53 Ir N2 P2 -","- C232 H424 Ir8 N16 P16 -","8","1","","Zheng Huang; Jianrong (Steve) Zhou; John F. Hartwig","N-H Activation of Hydrazines by Iridium(I). Double N-H Activation To Form Iridium Aminonitrene Complexes","Journal of the American Chemical Society","2010","132","","11458","11460","10.1021/ja1053835","","","0.71073","MoKα","","0.1408","0.0484","","","0.0647","0.0847","","","","","","0.926","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4102945","20.6955","0.001","20.6955","0.001","14.3009","0.001","90","","90","","90","","6125.1","0.6","193","2","193","2","","","","","","","","5","P 42 b c","P 4c -2ab","106","","","","- C31 H50 Ir N P2 -","- C31 H50 Ir N P2 -","- C248 H400 Ir8 N8 P16 -","8","1","","Zheng Huang; Jianrong (Steve) Zhou; John F. Hartwig","N-H Activation of Hydrazines by Iridium(I). Double N-H Activation To Form Iridium Aminonitrene Complexes","Journal of the American Chemical Society","2010","132","","11458","11460","10.1021/ja1053835","","","0.71073","MoKα","","0.0238","0.0192","","","0.0411","0.0429","","","","","","1.041","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102946","10.4919","0.0009","10.692","0.0008","15.0748","0.0012","101.466","0.005","98.835","0.005","103.297","0.005","1577.3","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H51 Ir N2 P2 -","- C31 H51 Ir N2 P2 -","- C62 H102 Ir2 N4 P4 -","2","1","","Zheng Huang; Jianrong (Steve) Zhou; John F. Hartwig","N-H Activation of Hydrazines by Iridium(I). Double N-H Activation To Form Iridium Aminonitrene Complexes","Journal of the American Chemical Society","2010","132","","11458","11460","10.1021/ja1053835","","","0.71073","MoKα","","0.0567","0.035","","","0.0651","0.0709","","","","","","1.017","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102947","9.349","0.005","8.209","0.005","17.192","0.01","90","","90","","90","","1319.4","1.3","120","1","120","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- B H5 K N -","- B H5 K N -","- B16 H80 K16 N16 -","16","2","","Himashinie V. K. Diyabalanage; Tessui Nakagawa; Roshan P. Shrestha; Troy A. Semelsberger; Benjamin L. Davis; Brian L. Scott; Anthony K. Burrell; William I. F. David; Kate R. Ryan; Martin Owen Jones; Peter P. Edwards","Potassium(I) Amidotrihydroborate: Structure and Hydrogen Release","Journal of the American Chemical Society","2010","132","","11836","11837","10.1021/ja100167z","","","0.71073","MoKα","","0.0764","0.0439","","","0.1405","0.1845","","","","","","0.697","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102948","10.1897","0.0001","11.8946","0.0002","15.8515","0.0003","83.299","0.003","86.941","0.003","80.846","0.003","1882.63","0.05","103.1","","103.1","","","","","","","","","6","P -1","-P 1","2","","","","- C71 H42 Cl10 N4 O18 Ru4 -","- C71 H38 Cl10 N4 O18 Ru4 -","- C71 H38 Cl10 N4 O18 Ru4 -","1","0.5","","Natsuko Motokawa; Satoshi Matsunaga; Shinya Takaishi; Hitoshi Miyasaka; Masahiro Yamashita; Kim R. Dunbar","Reversible Magnetism between an Antiferromagnet and a Ferromagnet Related to Solvation/Desolvation in a Robust Layered [Ru2]2TCNQ Charge-Transfer System","Journal of the American Chemical Society","2010","132","","11943","11951","10.1021/ja102412g","","","0.71075","MoKα","","","0.0467","","","","0.1333","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102949","10.024","0.003","12.034","0.004","15.707","0.005","84.078","0.01","85.712","0.011","79.834","0.009","1851.9","1","103.1","","103.1","","","","","","","","","6","P -1","-P 1","2","","","","- C70 H40 Cl8 N4 O18 Ru4 -","- C70 H36 Cl8 N4 O18 Ru4 -","- C70 H36 Cl8 N4 O18 Ru4 -","1","0.5","","Natsuko Motokawa; Satoshi Matsunaga; Shinya Takaishi; Hitoshi Miyasaka; Masahiro Yamashita; Kim R. Dunbar","Reversible Magnetism between an Antiferromagnet and a Ferromagnet Related to Solvation/Desolvation in a Robust Layered [Ru2]2TCNQ Charge-Transfer System","Journal of the American Chemical Society","2010","132","","11943","11951","10.1021/ja102412g","","","0.71075","MoKα","","","0.0485","","","","0.1417","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102950","10.1872","0.0015","11.8862","0.0017","15.811","0.002","83.433","0.003","86.957","0.003","80.85","0.003","1876.6","0.5","103.1","","103.1","","","","","","","","","6","P -1","-P 1","2","","","","- C71 H42 Cl10 N4 O18 Ru4 -","- C71 H38 Cl10 N4 O18 Ru4 -","- C71 H38 Cl10 N4 O18 Ru4 -","1","0.5","","Natsuko Motokawa; Satoshi Matsunaga; Shinya Takaishi; Hitoshi Miyasaka; Masahiro Yamashita; Kim R. Dunbar","Reversible Magnetism between an Antiferromagnet and a Ferromagnet Related to Solvation/Desolvation in a Robust Layered [Ru2]2TCNQ Charge-Transfer System","Journal of the American Chemical Society","2010","132","","11943","11951","10.1021/ja102412g","","","0.71075","MoKα","","","0.0518","","","","0.1573","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102951","9.151","0.004","20.914","0.01","23.367","0.018","90","","90","","90","","4472","5","93.1","","93.1","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C44 H48 Cl4 O12 Ru2 -","- C44 H48 Cl4 O12 Ru2 -","- C176 H192 Cl16 O48 Ru8 -","4","0.5","","Natsuko Motokawa; Satoshi Matsunaga; Shinya Takaishi; Hitoshi Miyasaka; Masahiro Yamashita; Kim R. Dunbar","Reversible Magnetism between an Antiferromagnet and a Ferromagnet Related to Solvation/Desolvation in a Robust Layered [Ru2]2TCNQ Charge-Transfer System","Journal of the American Chemical Society","2010","132","","11943","11951","10.1021/ja102412g","","","0.7107","MoKα","","","0.04","","","","0.0938","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102952","14.8115","0.0019","15.9646","0.0019","18.929","0.002","90","","106.665","0.0016","90","","4288","0.9","93.1","","93.1","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H40 B Cl4 F4 O11 Ru2 -","- C40 H20 B Cl4 F4 O11 Ru2 -","- C160 H80 B4 Cl16 F16 O44 Ru8 -","4","1","","Natsuko Motokawa; Satoshi Matsunaga; Shinya Takaishi; Hitoshi Miyasaka; Masahiro Yamashita; Kim R. Dunbar","Reversible Magnetism between an Antiferromagnet and a Ferromagnet Related to Solvation/Desolvation in a Robust Layered [Ru2]2TCNQ Charge-Transfer System","Journal of the American Chemical Society","2010","132","","11943","11951","10.1021/ja102412g","","","0.7107","MoKα","","","0.0518","","","","0.122","","","","","","1.142","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102953","5.0151","0.0018","16.013","0.006","22.861","0.008","90","","90","","90","","1835.9","1.1","203","2","203","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N O2 -","- C21 H25 N O2 -","- C84 H100 N4 O8 -","4","1","","Maryll E. Geherty; Robert D. Dura; Scott G. Nelson","Catalytic Asymmetric Claisen Rearrangement of Unactivated Allyl Vinyl Ethers","Journal of the American Chemical Society","2010","132","","11875","11877","10.1021/ja1039314","","","0.71073","MoKα","","0.1151","0.0739","","","0.1629","0.1812","","","","","","1.046","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102954","5.0268","0.0012","15.831","0.004","22.862","0.006","90","","90","","90","","1819.3","0.8","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 Br N O -","- C20 H22 Br N O -","- C80 H88 Br4 N4 O4 -","4","1","","Maryll E. Geherty; Robert D. Dura; Scott G. Nelson","Catalytic Asymmetric Claisen Rearrangement of Unactivated Allyl Vinyl Ethers","Journal of the American Chemical Society","2010","132","","11875","11877","10.1021/ja1039314","","","0.71073","MoKα","","0.114","0.0618","","","0.1292","0.1474","","","","","","0.922","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102955","19.358","0.003","12.646","0.002","18.038","0.003","90","","90","","90","","4415.7","1.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C54 H45 Cl Ir P3 -","- C54 H45 Cl Ir P3 -","- C216 H180 Cl4 Ir4 P12 -","4","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3M(X)] (M = Rh, Ir). The Red and Orange Forms of [(Ph3P)3Ir(Cl)]. Which Phosphine Dissociates Faster from Wilkinson's Catalyst?","Journal of the American Chemical Society","2010","132","","12013","12026","10.1021/ja1039693","","","0.71073","MoKα","","0.0898","0.0436","","","0.0673","0.0811","","","","","","0.961","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102956","32.705","0.009","12.187","0.003","10.985","0.003","90","","90","","90","","4378","2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C54 H45 Cl Ir P3 -","- C54 H45 Cl Ir P3 -","- C216 H180 Cl4 Ir4 P12 -","4","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3M(X)] (M = Rh, Ir). The Red and Orange Forms of [(Ph3P)3Ir(Cl)]. Which Phosphine Dissociates Faster from Wilkinson's Catalyst?","Journal of the American Chemical Society","2010","132","","12013","12026","10.1021/ja1039693","","","0.71073","MoKα","","0.043","0.0303","","","0.06","0.0635","","","","","","1.01","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102957","32.86","0.005","12.2247","0.0018","10.9774","0.0015","90","","90","","90","","4409.7","1.1","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C55 H48 O0 P3 Rh -","- C55 H48 P3 Rh -","- C220 H192 P12 Rh4 -","4","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3M(X)] (M = Rh, Ir). The Red and Orange Forms of [(Ph3P)3Ir(Cl)]. Which Phosphine Dissociates Faster from Wilkinson's Catalyst?","Journal of the American Chemical Society","2010","132","","12013","12026","10.1021/ja1039693","","","0.71073","MoKα","","0.1659","0.1166","","","0.2596","0.28","","","","","","1.404","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102958","13.773","0.002","24.303","0.004","24.367","0.004","90","","90","","90","","8156","2","150","2","150","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C35 H35 B2 Cl3 Co N6 O6 S4 -","- C35 H35 B2 Cl3 Co N6 O6 S4 -","- C280 H280 B16 Cl24 Co8 N48 O48 S32 -","8","2","","Wenjun Liu; Weijie Huang; Maren Pink; Dongwhan Lee","Layer-by-Layer Synthesis of Metal-Containing Conducting Polymers: Caged Metal Centers for Interlayer Charge Transport","Journal of the American Chemical Society","2010","132","","11844","11846","10.1021/ja104038s","","","0.71073","MoKα","","0.1098","0.0649","","","0.152","0.1766","","","","","","1.025","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102959","28.888","0.004","9.1516","0.0013","16.023","0.003","90","","121.953","0.008","90","","3594.2","1","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H34 B2 Fe N6 O6 S4 -","- C34 H34 B2 Fe N6 O6 S4 -","- C136 H136 B8 Fe4 N24 O24 S16 -","4","0.5","","Wenjun Liu; Weijie Huang; Maren Pink; Dongwhan Lee","Layer-by-Layer Synthesis of Metal-Containing Conducting Polymers: Caged Metal Centers for Interlayer Charge Transport","Journal of the American Chemical Society","2010","132","","11844","11846","10.1021/ja104038s","","","0.71073","MoKα","","0.0525","0.0366","","","0.0888","0.0974","","","","","","1.023","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00","" "4102960","9.372","0.001","15.564","0.001","48.161","0.004","95.861","0.002","93.037","0.002","95.182","0.002","6946","1","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C316.74 H356.19 N20 Ni4 O6.75 -","- C316.74 H356.186 N20 Ni4 O6.752 -","- C316.74 H356.186 N20 Ni4 O6.752 -","1","0.5","","Jianxin Song; Naoki Aratani; Ji Haeng Heo; Dongho Kim; Hiroshi Shinokubo; Atsuhiro Osuka","Directly Pd(II)-Bridged Porphyrin Belts with Remarkable Curvatures","Journal of the American Chemical Society","2010","132","","11868","11869","10.1021/ja1046654","","","0.71069","MoKα","","0.1167","0.0735","","","0.1745","0.1973","","","","","","1.033","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102961","15.633","0.002","19.14","0.002","26.565","0.003","76.928","0.002","89.395","0.002","72.777","0.002","7381.9","1.5","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C146 H153 Cl2 N10 Ni2 Pd -","- C146 H153 Cl2 N10 Ni2 Pd -","- C292 H306 Cl4 N20 Ni4 Pd2 -","2","1","","Jianxin Song; Naoki Aratani; Ji Haeng Heo; Dongho Kim; Hiroshi Shinokubo; Atsuhiro Osuka","Directly Pd(II)-Bridged Porphyrin Belts with Remarkable Curvatures","Journal of the American Chemical Society","2010","132","","11868","11869","10.1021/ja1046654","","","0.71069","MoKα","","0.0891","0.0744","","","0.2143","0.2279","","","","","","1.095","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102962","17.66","0.004","22.964","0.005","28.213","0.006","81.593","0.004","88.742","0.004","80.885","0.004","11176","4","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C198 H205 Cl N16 Ni3 -","- C198 H205 Cl N16 Ni3 -","- C396 H410 Cl2 N32 Ni6 -","2","1","","Jianxin Song; Naoki Aratani; Ji Haeng Heo; Dongho Kim; Hiroshi Shinokubo; Atsuhiro Osuka","Directly Pd(II)-Bridged Porphyrin Belts with Remarkable Curvatures","Journal of the American Chemical Society","2010","132","","11868","11869","10.1021/ja1046654","","","0.71069","MoKα","","0.1325","0.0741","","","0.1859","0.2065","","","","","","0.868","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102963","25.3421","0.0006","14.7875","0.0004","20.3492","0.0005","90","","96.447","0.002","90","","7577.6","0.3","100","2","100","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","Sc2O@Cs(6)-C82.Ni[OEP].1.4(toluene).0.6(benzene)","","","- C131.4 H58.8 N4 Ni O Sc2 -","- C129.55 H55.8 N4 Ni O Sc1.75 -","- C518.202 H223.2 N16 Ni4 O4 Sc7 -","4","0.5","","Brandon Q. Mercado; Melissa A. Stuart; Mary A. Mackey; Jane E. Pickens; Bridget S. Confait; Steven Stevenson; Michael L. Easterling; Ramón Valencia; Antonio Rodríguez-Fortea; Josep M. Poblet; Marilyn M. Olmstead; Alan L. Balch","Sc2(μ2-O) Trapped in a Fullerene Cage: The Isolation and Structural Characterization of Sc2(μ2-O)@Cs(6)-C82 and the Relevance of the Thermal and Entropic Effects in Fullerene Isomer Selection","Journal of the American Chemical Society","2010","132","","12098","12105","10.1021/ja104902e","","","0.7749","","","0.0852","0.0748","","","0.2054","0.2147","","","","","","1.017","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102964","12.777","0.003","23.903","0.005","18.151","0.004","90","","106.495","0.004","90","","5315","2","100.1","","100.1","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C92 H42 Si -","- C92 H42 Si -","- C368 H168 Si4 -","4","1","","Junko Nagatsuka; Sachie Sugitani; Masahiro Kako; Tsukasa Nakahodo; Naomi Mizorogi; Midori O. Ishitsuka; Yutaka Maeda; Takahiro Tsuchiya; Takeshi Akasaka; Xingfa Gao; Shigeru Nagase","Photochemical Addition of C60 with Siliranes: Synthesis and Characterization of Carbosilylated and Hydrosilylated C60 Derivatives","Journal of the American Chemical Society","2010","132","","12106","12120","10.1021/ja1049719","","","0.71075","MoKα","","","0.0869","","","","0.2675","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102965","12.7665","0.0005","23.9369","0.001","18.2436","0.0006","90","","106.826","0.001","90","","5336.4","0.4","120.1","","120.1","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C92 H42 Si -","- C92 H42 Si -","- C368 H168 Si4 -","4","1","","Junko Nagatsuka; Sachie Sugitani; Masahiro Kako; Tsukasa Nakahodo; Naomi Mizorogi; Midori O. Ishitsuka; Yutaka Maeda; Takahiro Tsuchiya; Takeshi Akasaka; Xingfa Gao; Shigeru Nagase","Photochemical Addition of C60 with Siliranes: Synthesis and Characterization of Carbosilylated and Hydrosilylated C60 Derivatives","Journal of the American Chemical Society","2010","132","","12106","12120","10.1021/ja1049719","","","0.71075","MoKα","","","0.063","","","","0.1784","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102966","19.694","0.004","13.366","0.002","24.195","0.004","90","","90.091","0.008","90","","6368.8","1.9","100.1","","100.1","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C106 H58 Si -","- C106 H58 Si -","- C424 H232 Si4 -","4","1","","Junko Nagatsuka; Sachie Sugitani; Masahiro Kako; Tsukasa Nakahodo; Naomi Mizorogi; Midori O. Ishitsuka; Yutaka Maeda; Takahiro Tsuchiya; Takeshi Akasaka; Xingfa Gao; Shigeru Nagase","Photochemical Addition of C60 with Siliranes: Synthesis and Characterization of Carbosilylated and Hydrosilylated C60 Derivatives","Journal of the American Chemical Society","2010","132","","12106","12120","10.1021/ja1049719","","","0.71075","MoKα","","","0.0665","","","","0.1833","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00","" "4102967","14.287","0.002","23.441","0.005","19.533","0.003","90","","104.27","0.005","90","","6339.8","1.9","90.1","","90.1","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C105 H54 Si -","- C105 H54 Si -","- C420 H216 Si4 -","4","1","","Junko Nagatsuka; Sachie Sugitani; Masahiro Kako; Tsukasa Nakahodo; Naomi Mizorogi; Midori O. Ishitsuka; Yutaka Maeda; Takahiro Tsuchiya; Takeshi Akasaka; Xingfa Gao; Shigeru Nagase","Photochemical Addition of C60 with Siliranes: Synthesis and Characterization of Carbosilylated and Hydrosilylated C60 Derivatives","Journal of the American Chemical Society","2010","132","","12106","12120","10.1021/ja1049719","","","0.71075","MoKα","","","0.0778","","","","0.2284","","","","","","1.047","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102968","14.8322","0.0005","15.7438","0.0006","16.037","0.001","100.665","0.001","105.054","0.001","111.784","0.001","3188.4","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C68 H81 N7 O9 -","- C68 H81 N7 O9 -","- C136 H162 N14 O18 -","2","1","","Ho Yong Lee; Xinli Song; Hyunsoo Park; Mu-Hyun Baik; Dongwhan Lee","Torsionally Responsive C3-Symmetric Azo Dyes: Azo-Hydrazone Tautomerism, Conformational Switching, and Application for Chemical Sensing","Journal of the American Chemical Society","2010","132","","12133","12144","10.1021/ja105121z","","x-ray","0.41328","synchrotron","","0.1084","0.0697","","","0.1903","0.2192","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00","" "4102969","14.5285","0.0009","16.1699","0.001","18.5044","0.0011","94.488","0.001","108.717","0.001","106.896","0.001","3868.3","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C148 H170 B2 F48 Ni2 O3 P4 Si2 -","- C148 H170 B2 F48 Ni2 O3 P4 Si2 -","- C148 H170 B2 F48 Ni2 O3 P4 Si2 -","1","0.5","","Vlad M. Iluc; Gregory L. Hillhouse","Arrested 1,2-Hydrogen Migration from Silicon to Nickel upon Oxidation of a Three-Coordinate Ni(I) Silyl Complex","Journal of the American Chemical Society","2010","132","","11890","11892","10.1021/ja1052329","","","0.71073","MoKα","","0.0969","0.0857","","","0.212","0.2227","","","","","","1.107","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102970","8.6888","0.0008","18.7901","0.0017","22.348","0.002","90","","96.061","0.002","90","","3628.2","0.6","100","2","100","2","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H63 Ni P2 Si -","- C36 H63 Ni P2 Si -","- C144 H252 Ni4 P8 Si4 -","4","1","","Vlad M. Iluc; Gregory L. Hillhouse","Arrested 1,2-Hydrogen Migration from Silicon to Nickel upon Oxidation of a Three-Coordinate Ni(I) Silyl Complex","Journal of the American Chemical Society","2010","132","","11890","11892","10.1021/ja1052329","","x-ray","0.71073","MoKα","","0.0935","0.071","","","0.1335","0.1413","","","","","","1.174","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102971","32.4278","0.0012","11.0563","0.0005","14.1912","0.0005","90","","109.461","0.002","90","","4797.3","0.3","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-(tert-butyl)phenyl)-5-iodo-3-methyl-1- n-octyl-1H-1,2,3-triazol-3-ium bromide","","- C21 H33 Br I N3 -","- C21 H33 Br I N3 -","- C168 H264 Br8 I8 N24 -","8","1","","Nathan L. Kilah; Matthew D. Wise; Christopher J. Serpell; Amber L. Thompson; Nicholas G. White; Kirsten E. Christensen; Paul D. Beer","Enhancement of Anion Recognition Exhibited by a Halogen-Bonding Rotaxane Host System","Journal of the American Chemical Society","2010","132","","11893","11895","10.1021/ja105263q","","","0.71073","MoKα","","0.0525","0.037","","0.054","0.0425","0.0425","","","","","","1.0289","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102972","14.038","0.0017","10.9503","0.0017","15.929","0.003","90","","101.329","0.011","90","","2400.9","0.7","150","","150","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","4-(4-(tert-butyl)phenyl)-5-iodo-3-methyl-1- n-octyl-1H-1,2,3-triazol-3-ium chloride","","- C21 H33 Cl I N3 -","- C21 H33 Cl I N3 -","- C84 H132 Cl4 I4 N12 -","4","1","","Nathan L. Kilah; Matthew D. Wise; Christopher J. Serpell; Amber L. Thompson; Nicholas G. White; Kirsten E. Christensen; Paul D. Beer","Enhancement of Anion Recognition Exhibited by a Halogen-Bonding Rotaxane Host System","Journal of the American Chemical Society","2010","132","","11893","11895","10.1021/ja105263q","","","0.71073","MoKα","","0.1773","0.1482","","0.2109","0.1734","0.1734","","","","","","1.1198","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102973","11.1796","0.0004","14.7396","0.0005","15.5956","0.0006","81.4488","0.0012","80.4591","0.0012","89.9085","0.0016","2505.47","0.16","150","","150","","","","","","","","","4","P -1","-P 1","2","","4-(4-(tert-butyl)phenyl)-5-iodo-3-methyl-1- n-octyl-1H-1,2,3-triazol-3-ium iodide","","- C21 H33 I2 N3 -","- C21 H33 I2 N3 -","- C84 H132 I8 N12 -","4","2","","Nathan L. Kilah; Matthew D. Wise; Christopher J. Serpell; Amber L. Thompson; Nicholas G. White; Kirsten E. Christensen; Paul D. Beer","Enhancement of Anion Recognition Exhibited by a Halogen-Bonding Rotaxane Host System","Journal of the American Chemical Society","2010","132","","11893","11895","10.1021/ja105263q","","","0.71073","MoKα","","0.1062","0.072","","0.109","0.0805","0.0805","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00","" "4102974","14.684","0.004","14.875","0.003","30.286","0.01","76.35","0.05","77.67","0.05","62.34","0.04","5652","4","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C113 H132 Br I N6 O12 -","- C113 H132 Br I N6 O12 -","- C226 H264 Br2 I2 N12 O24 -","2","1","","Nathan L. Kilah; Matthew D. Wise; Christopher J. Serpell; Amber L. Thompson; Nicholas G. White; Kirsten E. Christensen; Paul D. Beer","Enhancement of Anion Recognition Exhibited by a Halogen-Bonding Rotaxane Host System","Journal of the American Chemical Society","2010","132","","11893","11895","10.1021/ja105263q","","","0.6889","MoKα","","0.213","0.1501","","0.4124","0.3494","0.4124","","","","","","1.0063","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102975","23.0412","0.0005","13.5764","0.0003","17.4038","0.0004","90","","110.892","0.0012","90","","5086.3","0.2","223","","","","","","","","","","LOC ETH Zurich","8","C 1 2/c 1","-C 2yc","15","","","","- C54 H38 Cl6 I Ir N2 O4 P2 -","- C54 H38 Cl6 I Ir N2 O4 P2 -","- C216 H152 Cl24 I4 Ir4 N8 O16 P8 -","4","0.5","","Markus Roggen; Erick M. Carreira","Stereospecific Substitution of Allylic Alcohols To Give Optically Active Primary Allylic Amines: Unique Reactivity of a (P,alkene)Ir Complex Modulated by Iodide","Journal of the American Chemical Society","2010","132","","11917","11919","10.1021/ja105271z","","","0.71073","MoKα","","0.0578","0.0482","","","0.1445","0.1545","","","","","","1.148","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4102976","5.25","0.004","17.886","0.01","6.314","0.004","90","","112.536","0.01","90","","547.6","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H4 N5 O3 -","- C2 H4 N5 O3 -","- C8 H16 N20 O12 -","4","1","","Ruihu Wang; Hongyan Xu; Yong Guo; Rongjian Sa; Jean'ne M. Shreeve","Bis[3-(5-nitroimino-1,2,4-triazolate)]-Based Energetic Salts: Synthesis and Promising Properties of a New Family of High-Density Insensitive Materials","Journal of the American Chemical Society","2010","132","","11904","11905","10.1021/ja1055033","","","0.71073","MoKα","","0.0724","0.0527","","","0.145","0.1781","","","","","","1.109","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102977","19.7429","0.0005","13.5697","0.0004","18.3723","0.0005","90","","96.805","0.002","90","","4887.4","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H76 Al N7 Ni O -","- C48 H76 Al N7 Ni O -","- C192 H304 Al4 N28 Ni4 O4 -","4","1","","Chung-Chih Tsai; Wei-Chih Shih; Cyong-Hui Fang; Chia-Yi Li; Tiow-Gan Ong; Glenn P. A. Yap","Bimetallic Nickel Aluminun Mediated Para-Selective Alkenylation of Pyridine: Direct Observation of η2,η1-Pyridine Ni(0)-Al(III) Intermediates Prior to C-H Bond Activation","Journal of the American Chemical Society","2010","132","","11887","11889","10.1021/ja1061246","","","0.71073","MoKα","","0.059","0.0389","","","0.0913","0.1018","","","","","","1.011","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102978","14.981","0.003","25.995","0.005","6.9486","0.0014","90","","90","","90","","2706","0.9","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H39 Al2 Cl2 N3 -","- C22 H39 Al2 Cl2 N3 -","- C88 H156 Al8 Cl8 N12 -","4","1","","Chung-Chih Tsai; Wei-Chih Shih; Cyong-Hui Fang; Chia-Yi Li; Tiow-Gan Ong; Glenn P. A. Yap","Bimetallic Nickel Aluminun Mediated Para-Selective Alkenylation of Pyridine: Direct Observation of η2,η1-Pyridine Ni(0)-Al(III) Intermediates Prior to C-H Bond Activation","Journal of the American Chemical Society","2010","132","","11887","11889","10.1021/ja1061246","","","0.71073","MoKα","","0.2269","0.0932","","","0.1643","0.2139","","","","","","1.007","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102979","7.329","0.0017","16.483","0.004","8.629","0.002","90","","102.646","0.003","90","","1017.1","0.4","220","2","220","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H32 Cl2 Mo N2 -","- C18 H32 Cl2 Mo N2 -","- C36 H64 Cl4 Mo2 N4 -","2","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0449","0.0325","","","0.0666","0.0699","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102980","9.3437","0.0002","14.8268","0.0003","14.6366","0.0003","90","","96.2349","0.0003","90","","2015.72","0.07","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H32 Cl2 N2 W -","- C18 H32 Cl2 N2 W -","- C72 H128 Cl8 N8 W4 -","4","1","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0139","0.0133","","","0.0293","0.0295","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102981","12.7891","0.0003","10.0138","0.0002","16.7916","0.0004","90","","104.019","0.0003","90","","2086.41","0.08","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H70 Mo2 N8 -","- C38 H70 Mo2 N8 -","- C76 H140 Mo4 N16 -","2","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0226","0.0205","","","0.0447","0.0454","","","","","","0.999","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102982","9.6229","0.0018","10.344","0.002","11.664","0.002","105.2","0.0018","99.511","0.0019","114.24","0.0017","971.3","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H64 N6 W2 -","- C36 H64 N6 W2 -","- C36 H64 N6 W2 -","1","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0331","0.0275","","","0.0645","0.0671","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102983","12.993","0.0014","18.5117","0.0019","16.9536","0.0018","90","","107.973","0.002","90","","3878.7","0.7","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H64 N6 Ti2 -","- C36 H64 N6 Ti2 -","- C144 H256 N24 Ti8 -","4","1","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0585","0.038","","","0.0821","0.0898","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102984","9.6215","0.0005","15.9429","0.0008","13.061","0.0006","90","","104.501","0.001","90","","1939.66","0.17","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cmpd4","","","- C36 H66 Mo2 N6 -","- C36 H66 Mo2 N6 -","- C72 H132 Mo4 N12 -","2","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0327","0.0258","","","0.0551","0.058","","","","","","0.999","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102985","9.0568","0.0003","10.9451","0.0004","19.97","0.0007","90","","92.153","0.001","90","","1978.18","0.12","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","W-complex","","- C36 H64 Cl2 N6 W2 -","- C36 H64 Cl2 N6 W2 -","- C72 H128 Cl4 N12 W4 -","2","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0182","0.0152","","","0.0366","0.0374","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102986","20.2729","0.0011","16.968","0.001","18.6155","0.0011","90","","112.493","0.0007","90","","5916.4","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H192 Cl4 N18 W6 -","- C108 H192 Cl4 N18 W6 -","- C216 H384 Cl8 N36 W12 -","2","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0778","0.0428","","","0.0823","0.0899","","","","","","1","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102987","9.4556","0.0007","11.328","0.0008","16.6763","0.0012","77.4608","0.0009","78.9713","0.001","72.9418","0.0009","1651.3","0.2","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H50 Mo N4 -","- C36 H50 Mo N4 -","- C72 H100 Mo2 N8 -","2","1","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0406","0.0325","","","0.0627","0.0648","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102988","9.4665","0.0005","11.3904","0.0006","16.7481","0.0009","77.4871","0.0005","79.3452","0.0005","72.7116","0.0005","1669.23","0.15","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H50 N4 W -","- C36 H50 N4 W -","- C72 H100 N8 W2 -","2","1","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0214","0.0198","","","0.0466","0.0471","","","","","","1.001","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102989","8.8808","0.0003","16.4776","0.0005","14.277","0.0005","90","","90","","90","","2089.21","0.12","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C20 H32 Mo N2 O2 -","- C20 H32 Mo N2 O2 -","- C80 H128 Mo4 N8 O8 -","4","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0178","0.0167","","","0.0363","0.0366","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102990","14.0017","0.0009","15.7393","0.001","9.1904","0.0006","90","","90","","90","","2025.4","0.2","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C20 H32 N2 O2 W -","- C20 H32 N2 O2 W -","- C80 H128 N8 O8 W4 -","4","0.5","","Philip P. Fontaine; Brendan L. Yonke; Peter Y. Zavalij; Lawrence R. Sita","Dinitrogen Complexation and Extent of N\τbN Activation within the Group 6 ""End-On-Bridged"" Dinuclear Complexes, {(η5-C5Me5)M[N(i-Pr)C(Me)N(i-Pr)]}2(μ-η1:η1-N2) (M = Mo and W)","Journal of the American Chemical Society","2010","132","","12273","12285","10.1021/ja100469f","","","0.71073","MoKα","","0.0133","0.0111","","","0.0248","0.0254","","","","","","1","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102991","8.2012","0.0002","10.4016","0.0002","17.8398","0.0004","90","","95.877","0.001","90","","1513.84","0.06","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18.67 H29.33 N5.33 Ni1.33 O4 -","- C18.6667 H29.3333 N5.33333 Ni1.33333 O4 -","- C56 H88 N16 Ni4 O12 -","3","0.75","","Xavi Ribas; Carlos Calle; Albert Poater; Alicia Casitas; Laura Gómez; Raül Xifra; Teodor Parella; Jordi Benet-Buchholz; Arthur Schweiger; George Mitrikas; Miquel Solà; Antoni Llobet; T. Daniel P. Stack","Facile C-H Bond Cleavage via a Proton-Coupled Electron Transfer Involving a C-H...CuII Interaction","Journal of the American Chemical Society","2010","132","","12299","12306","10.1021/ja101599e","","","0.71073","MoKα","","0.036","0.033","","","0.0887","0.0909","","","","","","1.048","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102992","18.595","0.002","22.072","0.002","15.8951","0.0017","90","","106.429","0.002","90","","6257.4","1.1","100","0.1","100","0.1","","","","","","","","6","C 1 2 1","C 2y","5","1","","","- C78 H84 Au N O4 P2 -","- C78 H84 Au N O4 P2 -","- C312 H336 Au4 N4 O16 P8 -","4","1","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.0467","0.0354","","","0.0738","0.0837","","","","","","1.043","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102993","17.8938","0.0009","15.1515","0.0008","15.3494","0.0008","90","","103.356","0.001","90","","4048.9","0.4","100","0.1","100","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","2","","","- C50 H48 Au N O2 P2 -","- C50 H48 Au N O2 P2 -","- C200 H192 Au4 N4 O8 P8 -","4","0.5","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.0372","0.029","","","0.0625","0.0655","","","","","","1.03","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102994","17.9902","0.0017","16.2836","0.0016","15.1191","0.0015","90","","103.233","0.002","90","","4311.5","0.7","100","0.1","100","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","3","","","- C52 H52 Au N O2 P2 -","- C52 H52 Au N O2 P2 -","- C208 H208 Au4 N4 O8 P8 -","4","0.5","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.0975","0.0487","","","0.0843","0.0993","","","","","","0.986","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102995","17.815","0.002","17.815","0.002","55.126","0.007","90","","90","","90","","17496","4","100","0.1","100","0.1","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","4","","","- C168 H216 Au4 Cu4 O16 -","- C168 H216 Au4 Cu4 O16 -","- C672 H864 Au16 Cu16 O64 -","4","0.5","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.1235","0.0758","","","0.1809","0.2011","","","","","","0.98","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102996","17.1668","0.0012","16.0171","0.0011","26.2354","0.0018","90","","103.724","0.001","90","","7007.8","0.8","100","0.1","100","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","6a","","","- C78 H84 Au3 Cu2 N O6 P2 -","- C78 H84 Au3 Cu2 N O6 P2 -","- C312 H336 Au12 Cu8 N4 O24 P8 -","4","1","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.089","0.0444","","","0.0829","0.0977","","","","","","0.99","","","","has coordinates","178775","2020-10-21","18:00:00","" "4102997","18.0506","0.0013","20.7398","0.0015","22.5954","0.0016","90","","90","","90","","8458.9","1.1","100","0.1","100","0.1","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","6b","","","- C82 H92 Au3 Cl8 Cu2 N O6 P2 -","- C82 H92 Au3 Cl8 Cu2 N O6 P2 -","- C328 H368 Au12 Cl32 Cu8 N4 O24 P8 -","4","1","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.093","0.0496","","","0.1084","0.126","","","","","","1.026","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102998","11.7932","0.001","26.194","0.002","13.0147","0.0011","90","","97.469","0.002","90","","3986.3","0.6","100","0.1","100","0.1","","","","","","","","7","P 1 21/m 1","-P 2yb","11","7a","","","- C88 H106 Au3 Cu2 N O7 P2 -","- C88 H106 Au3 Cu2 N O7 P2 -","- C176 H212 Au6 Cu4 N2 O14 P4 -","2","0.5","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.1106","0.0544","","","0.1026","0.1219","","","","","","1.028","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4102999","22.7061","0.0017","14.5944","0.0011","26.198","0.002","90","","91.06","0.002","90","","8680.1","1.1","100","0.1","100","0.1","","","","","","","","8","C 1 c 1","C -2yc","9","7b","","","- C90.39 H111.35 Au3 Cl2.53 Cu2 N O7.28 P2 -","- C90.391 H111.346 Au3 Cl2.526 Cu2 N O7.282 P2 -","- C361.564 H445.384 Au12 Cl10.104 Cu8 N4 O29.128 P8 -","4","1","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.0656","0.048","","","0.0968","0.1034","","","","","","0.995","","","","has coordinates,has disorder","178775","2020-10-21","18:00:00","" "4103000","18.3693","0.0013","18.5923","0.0013","23.6603","0.0017","90","","94.312","0.001","90","","8057.8","1","100","0.1","100","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","7c","","","- C84 H96 Au3 Cu2 N O6 P2 -","- C84 H96 Au3 Cu2 N O6 P2 -","- C336 H384 Au12 Cu8 N4 O24 P8 -","4","1","","Gerald F. Manbeck; William W. Brennessel; Robert A. Stockland; Richard Eisenberg","Luminescent Au(I)/Cu(I) Alkynyl Clusters with an Ethynyl Steroid and Related Aliphatic Ligands: An Octanuclear Au4Cu4 Cluster and Luminescence Polymorphism in Au3Cu2 Clusters","Journal of the American Chemical Society","2010","132","","12307","12318","10.1021/ja103400e","","","0.71073","MoKα","","0.0922","0.0514","","","0.1084","0.1198","","","","","","0.983","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103001","7.488","0.005","5.266","0.002","9.131","0.006","90","","112.604","0.008","90","","332.4","0.3","93","2","93","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C4 H4 N8 -","- C4 H4 N8 -","- C8 H8 N16 -","2","0.5","","Yu-Chuan Li; Cai Qi; Sheng-Hua Li; Hui-Juan Zhang; Cheng-Hui Sun; Yong-Zhong Yu; Si-Ping Pang","1,1'-Azobis-1,2,3-triazole: A High-Nitrogen Compound with Stable N8Structure and Photochromism","Journal of the American Chemical Society","2010","132","","12172","12173","10.1021/ja103525v","","","0.71073","MoKα","","0.0365","0.0304","","","0.0814","0.0847","","","","","","1.006","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103002","6.0927","0.0002","7.3057","0.0003","21.0808","0.0008","80.027","0.002","86.454","0.002","67.354","0.002","852.89","0.06","173","2","173","2","","","","","","","","3","P 1","P 1","1","","","","- C20 H34 O -","- C20 H34 O -","- C40 H68 O2 -","2","2","","Yajing Lian; Laura C. Miller; Stephen Born; Richmond Sarpong; Huw M. L. Davies","Catalyst-Controlled Formal [4 + 3] Cycloaddition Applied to the Total Synthesis of (+)-Barekoxide and (-)-Barekol","Journal of the American Chemical Society","2010","132","","12422","12425","10.1021/ja103916t","","","1.54178","CuKα","","0.039","0.0389","","","0.1081","0.1082","","","","","","1.04","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103003","10.4699","0.001","14.4005","0.0014","14.6794","0.0015","90","","105.735","0.002","90","","2130.3","0.4","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","jonmg11","","","- C19 H35 N Ni P2 S -","- C19 H35 N Ni P2 S -","- C76 H140 N4 Ni4 P8 S4 -","4","1","","Matthew R. Grochowski; Ting Li; William W. Brennessel; William D. Jones","Competitive Carbon-Sulfur vs Carbon-Carbon Bond Activation of 2-Cyanothiophene with [Ni(dippe)H]2","Journal of the American Chemical Society","2010","132","","12412","12421","10.1021/ja104158h","","","0.71073","MoKα","","0.083","0.0508","","","0.1264","0.1413","","","","","","1.051","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103004","10.4435","0.0014","15.405","0.002","14.9862","0.0019","90","","110.245","0.002","90","","2262.1","0.5","100","0.1","100","0.1","","","","","","","","6","P 1 c 1","P -2yc","7","jonmg19","","","- C20 H34 N2 Ni P2 S -","- C20 H34 N2 Ni P2 S -","- C80 H136 N8 Ni4 P8 S4 -","4","2","","Matthew R. Grochowski; Ting Li; William W. Brennessel; William D. Jones","Competitive Carbon-Sulfur vs Carbon-Carbon Bond Activation of 2-Cyanothiophene with [Ni(dippe)H]2","Journal of the American Chemical Society","2010","132","","12412","12421","10.1021/ja104158h","","","0.71073","MoKα","","0.1083","0.0639","","","0.119","0.1374","","","","","","0.977","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103005","15.893","0.003","13.864","0.002","19.718","0.003","90","","90","","90","","4344.7","1.2","100","0.1","100","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","jonmg15","","","- C19 H35 N Ni P2 S -","- C19 H35 N Ni P2 S -","- C152 H280 N8 Ni8 P16 S8 -","8","1","","Matthew R. Grochowski; Ting Li; William W. Brennessel; William D. Jones","Competitive Carbon-Sulfur vs Carbon-Carbon Bond Activation of 2-Cyanothiophene with [Ni(dippe)H]2","Journal of the American Chemical Society","2010","132","","12412","12421","10.1021/ja104158h","","","0.71073","MoKα","","0.1014","0.0483","","","0.0875","0.1056","","","","","","1.015","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103006","8.3149","0.0004","15.7589","0.0008","17.7572","0.0009","81.337","0.001","88.804","0.001","78.284","0.001","2252.21","0.19","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","jonmg17","","","- C20.5 H36.5 N Ni P2 S -","- C20.5 H36.5 N Ni P2 S -","- C82 H146 N4 Ni4 P8 S4 -","4","2","","Matthew R. Grochowski; Ting Li; William W. Brennessel; William D. Jones","Competitive Carbon-Sulfur vs Carbon-Carbon Bond Activation of 2-Cyanothiophene with [Ni(dippe)H]2","Journal of the American Chemical Society","2010","132","","12412","12421","10.1021/ja104158h","","","0.71073","MoKα","","0.0965","0.0517","","","0.0933","0.1117","","","","","","0.989","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103007","6.709","0.002","11.712","0.004","23.352","0.007","90","","90","","90","","1834.9","1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 O4 S -","- C20 H26 O4 S -","- C80 H104 O16 S4 -","4","1","","Jimmie D. Weaver; Being J. Ka; David K. Morris; Ward Thompson; Jon A. Tunge","Stereospecific Decarboxylative Allylation of Sulfones","Journal of the American Chemical Society","2010","132","","12179","12181","10.1021/ja104196x","","","0.71073","MoKα","","0.0599","0.0496","","","0.0879","0.0913","","","","","","0.987","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103008","9.11919","0.00008","9.11919","0.00008","9.11919","0.00008","90","","90","","90","","758.348","0.012","","","","","","","","","","","","3","P n -3 :2","-P 2ab 2bc 3","201","","","","- Bi3 Mn3 O10.5 -","- Bi2.9998 Mn3 O10.5 -","- Bi11.9992 Mn12 O42 -","4","0.166667","","Alexei A. Belik; Eiji Takayama-Muromachi","Effects of Oxygen Content on Bi3Mn3O11+δ: From 45 K Antiferromagnetism to Room-Temperature True Ferromagnetism","Journal of the American Chemical Society","2010","132","","12426","12432","10.1021/ja1043598","powder diffraction","","0.41916","CuK\α~1~","","","","","","","","","","3.03","","","","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103009","9.11151","0.00006","9.11151","0.00006","9.11151","0.00006","90","","90","","90","","756.434","0.009","","","","","","","","","","","","3","P n -3 :2","-P 2ab 2bc 3","201","","","","- Bi3 Mn3 O11.6 -","- Bi2.9998 Mn3 O11 -","- Bi11.9992 Mn12 O44 -","4","0.166667","","Alexei A. Belik; Eiji Takayama-Muromachi","Effects of Oxygen Content on Bi3Mn3O11+δ: From 45 K Antiferromagnetism to Room-Temperature True Ferromagnetism","Journal of the American Chemical Society","2010","132","","12426","12432","10.1021/ja1043598","powder diffraction","","0.41916","CuK\α~1~","","","","","","","","","","2.42","","","","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103010","32.562","0.008","10.769","0.003","10.969","0.003","90","","102.276","0.005","90","","3758.4","1.7","240","2","240","","","","","","","","Synthesized by the authors. See text","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H25 N3 O3 Si -","- C14 H25 N3 O3 Si -","- C112 H200 N24 O24 Si8 -","8","1","","Michel Prévost; Olivier St-Jean; Yvan Guindon","Synthesis of 1',2'-cis-Nucleoside Analogues: Evidence of Stereoelectronic Control for SN2 Reactions at the Anomeric Center of Furanosides","Journal of the American Chemical Society","2010","132","","12433","12439","10.1021/ja104429y","","","0.71073","MoKα","","0.1383","0.086","","","0.2967","0.3362","","","","","","1.127","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103011","13.9007","0.0005","13.6243","0.0005","20.236","0.0008","90","","104.66","0.0004","90","","3707.7","0.2","93","2","93","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H56 Fe K N9 O6 -","- C27 H56 Fe K N9 O6 -","- C108 H224 Fe4 K4 N36 O24 -","4","1","","David C. Lacy; Rupal Gupta; Kari L. Stone; John Greaves; Joseph W. Ziller; Michael P. Hendrich; A. S. Borovik","Formation, Structure, and EPR Detection of a High Spin FeIV-Oxo Species Derived from Either an FeIII-Oxo or FeIII-OH Complex","Journal of the American Chemical Society","2010","132","","12188","12190","10.1021/ja1047818","","","0.71073","MoKα","","0.0289","0.025","","","0.0658","0.0681","","","","","","1.016","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103012","13.3724","0.0003","13.3724","0.0003","13.3724","0.0003","90","","90","","90","","2391.27","0.09","298","2","298","2","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Cs18 O6 Tl8 -","- Cs18 O6 Tl8 -","- Cs36 O12 Tl16 -","2","0.0833333","","Ulrich Wedig; Vyacheslav Saltykov; Jürgen Nuss; Martin Jansen","Homoatomic Stella Quadrangula [Tl8]6- in Cs18Tl8O6, Interplay of Spin-Orbit Coupling, and Jahn-Teller Distortion","Journal of the American Chemical Society","2010","132","","12458","12463","10.1021/ja1051022","","x-ray","0.71073","MoKα","","0.0299","0.0248","","","0.0519","0.0536","","","","","","1.098","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103013","31.782","0.005","31.782","0.005","12.388","0.003","90","","90","","120","","10837","4","90","2","90","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C39.72 H36 N24 O19.44 -","- C39.72 H36 N24 O19.44 -","- C357.48 H324 N216 O174.96 -","9","0.5","","Hyunuk Kim; Yonghwi Kim; Minyoung Yoon; Soyoung Lim; Se Min Park; Gon Seo; Kimoon Kim","Highly Selective Carbon Dioxide Sorption in an Organic Molecular Porous Material","Journal of the American Chemical Society","2010","132","","12200","12202","10.1021/ja105211w","","","0.75","synchrotron","","0.0957","0.0821","","","0.2335","0.2466","","","","","","1.094","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103014","9.752","0.002","11.925","0.003","12.577","0.003","102.896","0.002","107.463","0.004","95.645","0.002","1338.3","0.5","113","2","113.15","","","","","","","","","4","P -1","-P 1","2","","","","- C36 H25 N O4 -","- C36 H25 N O4 -","- C72 H50 N2 O8 -","2","1","","Koya Prabhakara Rao; Tetsuro Kusamoto; Fumiyuki Toshimitsu; Kiyotaka Inayoshi; Shoko Kume; Ryota Sakamoto; Hiroshi Nishihara","Double Protonation of 1,5-Bis(triarylaminoethynyl)anthraquinone To Form a Paramagnetic Pentacyclic Dipyrylium Salt","Journal of the American Chemical Society","2010","132","","12472","12479","10.1021/ja105250f","","","0.71073","MoKα","","","0.0475","","","","0.1386","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103015","15.703","0.008","10.301","0.004","15.738","0.008","90","","119.718","0.006","90","","2210.9","1.8","113.15","","113.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C58 H42 N2 O6 -","- C58 H42 N2 O6 -","- C116 H84 N4 O12 -","2","0.5","","Koya Prabhakara Rao; Tetsuro Kusamoto; Fumiyuki Toshimitsu; Kiyotaka Inayoshi; Shoko Kume; Ryota Sakamoto; Hiroshi Nishihara","Double Protonation of 1,5-Bis(triarylaminoethynyl)anthraquinone To Form a Paramagnetic Pentacyclic Dipyrylium Salt","Journal of the American Chemical Society","2010","132","","12472","12479","10.1021/ja105250f","","","0.71073","MoKα","","0.1363","0.0823","","","0.1698","0.2045","","","","","","1.101","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103016","19.183","0.004","12.104","0.002","21.435","0.004","90","","111.302","0.002","90","","4637","1.5","113.15","","113.115","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C59 H46 Cl2 N2 O6 -","- C59 H46 Cl2 N2 O6 -","- C236 H184 Cl8 N8 O24 -","4","1","","Koya Prabhakara Rao; Tetsuro Kusamoto; Fumiyuki Toshimitsu; Kiyotaka Inayoshi; Shoko Kume; Ryota Sakamoto; Hiroshi Nishihara","Double Protonation of 1,5-Bis(triarylaminoethynyl)anthraquinone To Form a Paramagnetic Pentacyclic Dipyrylium Salt","Journal of the American Chemical Society","2010","132","","12472","12479","10.1021/ja105250f","","","0.71073","MoKα","","0.1117","0.0912","","","0.2544","0.2767","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103017","13.6756","0.0006","18.0856","0.0004","16.844","0.0006","90","","93.29","0.002","90","","4159.2","0.3","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C74 H98 Ca2 I2 O12 -","- C74 H98 Ca2 I2 O12 -","- C148 H196 Ca4 I4 O24 -","2","0.5","","Sven Krieck; Helmar Görls; Matthias Westerhausen","Mechanistic Elucidation of the Formation of the Inverse Ca(I) Sandwich Complex [(thf)~3~Ca(μ-C~6~H~3~-1,3,5-Ph~3~)Ca(thf)~3~]and Stability of Aryl-Substituted Phenylcalcium Complexes","Journal of the American Chemical Society","2010","132","","12492","12501","10.1021/ja105534w","","","0.71073","MoKα","","0.1182","0.0611","","","0.166","0.1957","","","","","","1.025","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103018","24.6771","0.0005","14.9476","0.0004","22.7395","0.0005","90","","92.546","0.001","90","","8379.5","0.3","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C88 H113 Ca2 O10.5 -","- C88 H113 Ca2 O10.5 -","- C352 H452 Ca8 O42 -","4","1","","Sven Krieck; Helmar Görls; Matthias Westerhausen","Mechanistic Elucidation of the Formation of the Inverse Ca(I) Sandwich Complex [(thf)~3~Ca(μ-C~6~H~3~-1,3,5-Ph~3~)Ca(thf)~3~]and Stability of Aryl-Substituted Phenylcalcium Complexes","Journal of the American Chemical Society","2010","132","","12492","12501","10.1021/ja105534w","","","0.71073","MoKα","","0.1591","0.0847","","","0.2304","0.2772","","","","","","1.037","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103019","16.2058","0.0003","8.3923","0.0002","20.4013","0.0007","90","","90","","90","","2774.66","0.13","133","2","133","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C26 H38 Ca N6 -","- C26 H38 Ca N6 -","- C104 H152 Ca4 N24 -","4","1","","Sven Krieck; Helmar Görls; Matthias Westerhausen","Mechanistic Elucidation of the Formation of the Inverse Ca(I) Sandwich Complex [(thf)~3~Ca(μ-C~6~H~3~-1,3,5-Ph~3~)Ca(thf)~3~]and Stability of Aryl-Substituted Phenylcalcium Complexes","Journal of the American Chemical Society","2010","132","","12492","12501","10.1021/ja105534w","","","0.71073","MoKα","","0.0675","0.0491","","","0.1253","0.1346","","","","","","1.043","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103020","10.3305","0.0002","39.9525","0.0009","8.7003","0.0003","90","","121.825","0.002","90","","3051.03","0.15","183","2","183","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C32 H41 Ca I O3 -","- C32 H41 Ca I O3 -","- C128 H164 Ca4 I4 O12 -","4","1","","Sven Krieck; Helmar Görls; Matthias Westerhausen","Mechanistic Elucidation of the Formation of the Inverse Ca(I) Sandwich Complex [(thf)~3~Ca(μ-C~6~H~3~-1,3,5-Ph~3~)Ca(thf)~3~]and Stability of Aryl-Substituted Phenylcalcium Complexes","Journal of the American Chemical Society","2010","132","","12492","12501","10.1021/ja105534w","","","0.71073","MoKα","","0.0527","0.0354","","","0.071","0.0771","","","","","","0.994","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103021","8.50004","0.00012","15.59226","0.00017","11.79506","0.00017","90","","107.735","0.0015","90","","1488.97","0.04","110","2","110","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C28 H32 Cl3 Fe N3 O3 S -","- C28 H32 Cl3 Fe N3 O3 S -","- C56 H64 Cl6 Fe2 N6 O6 S2 -","2","1","","Yunbo Jiang; Leland R. Widger; Gary D. Kasper; Maxime A. Siegler; David P. Goldberg","Iron(II)-Thiolate S-Oxygenation by O2: Synthetic Models of Cysteine Dioxygenase","Journal of the American Chemical Society","2010","132","","12214","12215","10.1021/ja105591q","","","0.71073","MoKα","","0.0419","0.0399","","","0.1134","0.1148","","","","","","1.12","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103022","18.8432","0.0004","19.1963","0.0003","8.27657","0.00018","90","","101.465","0.002","90","","2934.06","0.1","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 F3 Fe N3 O3 S2 -","- C28 H30 F3 Fe N3 O3 S2 -","- C112 H120 F12 Fe4 N12 O12 S8 -","4","1","","Yunbo Jiang; Leland R. Widger; Gary D. Kasper; Maxime A. Siegler; David P. Goldberg","Iron(II)-Thiolate S-Oxygenation by O2: Synthetic Models of Cysteine Dioxygenase","Journal of the American Chemical Society","2010","132","","12214","12215","10.1021/ja105591q","","","0.71073","MoKα","","0.061","0.0413","","","0.0936","0.0996","","","","","","1.052","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103023","8.19913","0.00015","18.9654","0.0003","29.7683","0.0004","84.8769","0.0012","82.5395","0.0014","79.5386","0.0014","4503.22","0.13","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C85 H93 F9 N10 O11 S6 Zn3 -","- C85 H93 F9 N10 O11 S6 Zn3 -","- C170 H186 F18 N20 O22 S12 Zn6 -","2","1","","Yunbo Jiang; Leland R. Widger; Gary D. Kasper; Maxime A. Siegler; David P. Goldberg","Iron(II)-Thiolate S-Oxygenation by O2: Synthetic Models of Cysteine Dioxygenase","Journal of the American Chemical Society","2010","132","","12214","12215","10.1021/ja105591q","","","0.71073","MoKα","","0.0646","0.04","","","0.0895","0.0947","","","","","","0.958","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103024","15.8965","0.0005","18.4656","0.0007","19.6998","0.0007","103.979","0.003","104.433","0.003","111.394","0.003","4846.8","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C139.2 H252.8 Cu24 N8 O24 Si16 -","- C139.2 H252.8 Cu24 N8 O24 Si16 -","- C139.2 H252.8 Cu24 N8 O24 Si16 -","1","0.5","","Gengwen Tan; Ying Yang; Chenhui Chu; Hongping Zhu; Herbert W. Roesky","Cu24O24Si8R8: Organic Soluble 56-Membered Copper(I) Siloxane Cage and Its Use in Homogeneous Catalysis","Journal of the American Chemical Society","2010","132","","12231","12233","10.1021/ja1056104","","","0.71073","MoKα","","0.0929","0.0399","","","0.0619","0.0672","","","","","","0.727","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103025","34.7585","0.0006","17.8536","0.0004","25.6731","0.0005","90","","129.476","0.001","90","","12297.6","0.5","123","2","123","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C101 H34 Cl O S2 -","- C101.5 H34 Cl2 O S -","- C812 H272 Cl16 O8 S8 -","8","1","","Zuo Xiao; Yutaka Matsuo; Eiichi Nakamura","Copper-Catalyzed Formal [4 + 2] Annulation between Alkyne and Fullerene Bromide","Journal of the American Chemical Society","2010","132","","12234","12236","10.1021/ja1056399","","x-ray","1.5418","CuKα","","0.1087","0.0799","","","0.2424","0.2643","","","","","","1.08","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103026","34.6322","0.0006","17.6805","0.0003","25.6132","0.0005","90","","129.525","0.001","90","","12097.3","0.4","123","2","123","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","C60Ph4CHCC6H4BrC6H3","","- C99.5 H29 Br S3 -","- C99.5 H29 Br S3 -","- C796 H232 Br8 S24 -","8","1","","Zuo Xiao; Yutaka Matsuo; Eiichi Nakamura","Copper-Catalyzed Formal [4 + 2] Annulation between Alkyne and Fullerene Bromide","Journal of the American Chemical Society","2010","132","","12234","12236","10.1021/ja1056399","","x-ray","1.54187","CuKα","","0.0904","0.0839","","","0.2623","0.269","","","","","","1.083","","","","has coordinates","269108","2021-09-13","08:22:43","" "4103027","14.134","","17.167","","27.418","","90","","105.99","","90","","6395.27","","153","2","153","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","","","- C104 H34 Cl6 -","- C103.5 H33.5 Cl6 -","- C414 H134 Cl24 -","4","1","","Zuo Xiao; Yutaka Matsuo; Eiichi Nakamura","Copper-Catalyzed Formal [4 + 2] Annulation between Alkyne and Fullerene Bromide","Journal of the American Chemical Society","2010","132","","12234","12236","10.1021/ja1056399","","x-ray","1.54187","CuKα","","0.2169","0.128","","","0.3543","0.3937","","","","","","1.068","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103028","15.478","0.003","14.753","0.003","16.184","0.003","90","","95.025","0.004","90","","3681.4","1.2","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C84 H57 Cl9 N4 O5 P2 -","- C84 H57 Cl9 N4 O5 P2 -","- C168 H114 Cl18 N8 O10 P4 -","2","1","","Daisuke Uraguchi; Natsuko Kinoshita; Takashi Ooi","Catalytic Asymmetric Protonation of α-Amino Acid-Derived Ketene Disilyl Acetals Using P-Spiro Diaminodioxaphosphonium Barfates as Chiral Proton","Journal of the American Chemical Society","2010","132","","12240","12242","10.1021/ja105945z","","","0.71073","MoKα","","0.073","0.0618","","","0.1501","0.1591","","","","","","1.052","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103029","27.528","0.005","12.447","0.002","13.383","0.002","90","","90","","90","","4585.6","1.3","153","2","153","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C58 H45 N2 O4 P -","- C58 H45 N2 O4 P -","- C232 H180 N8 O16 P4 -","4","1","","Daisuke Uraguchi; Natsuko Kinoshita; Takashi Ooi","Catalytic Asymmetric Protonation of α-Amino Acid-Derived Ketene Disilyl Acetals Using P-Spiro Diaminodioxaphosphonium Barfates as Chiral Proton","Journal of the American Chemical Society","2010","132","","12240","12242","10.1021/ja105945z","","","0.71073","MoKα","","0.1117","0.0835","","","0.1446","0.1557","","","","","","1.113","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103030","10.5548","0.0016","6.4174","0.001","15.7227","0.0019","90","","98.09","0.011","90","","1054.4","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H23 N O3 -","- C26 H23 N O3 -","- C52 H46 N2 O6 -","2","1","","Manuel Weber; Sascha Jautze; Wolfgang Frey; René Peters","Bispalladacycle-Catalyzed Brønsted Acid/Base-Promoted Asymmetric Tandem Azlactone Formation-Michael Addition","Journal of the American Chemical Society","2010","132","","12222","12225","10.1021/ja106088v","","","0.71073","MoKα","","0.0798","0.0522","","","0.1033","0.1139","","","","","","1.051","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103031","9.4054","0.0013","10.0178","0.0018","13.724","0.002","90","","93.009","0.012","90","","1291.3","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H34 N2 O5 -","- C27 H34 N2 O5 -","- C54 H68 N4 O10 -","2","1","","Manuel Weber; Sascha Jautze; Wolfgang Frey; René Peters","Bispalladacycle-Catalyzed Brønsted Acid/Base-Promoted Asymmetric Tandem Azlactone Formation-Michael Addition","Journal of the American Chemical Society","2010","132","","12222","12225","10.1021/ja106088v","","","0.71073","MoKα","","0.1144","0.0633","","","0.1065","0.1209","","","","","","1.046","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103032","26.6125","0.0009","12.1901","0.0004","21.7234","0.0007","90","","105.191","0.002","90","","6801","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ru2(D(3,5-Cl2)PhF)3N(C13H6N2Cl4)(Hexane)","","","- C58 H42 Cl16 N9 Ru2 -","- C58 H42 Cl16 N9 Ru2 -","- C232 H168 Cl64 N36 Ru8 -","4","0.5","","Amanda Kae Musch Long; Renyuan Pony Yu; George H. Timmer; John F. Berry","Aryl C-H Bond Amination by an Electrophilic Diruthenium Nitride","Journal of the American Chemical Society","2010","132","","12228","12230","10.1021/ja1062955","","","0.71073","MoKα","","0.0515","0.0455","","","0.1277","0.1331","","","","","","1.079","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103033","18.753","0.0018","8.7476","0.0008","24.797","0.003","90","","108.605","0.005","90","","3855.2","0.7","110","2","110","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","mp_apso","mp_apso","","- C24 H24 N4 O -","- C24 H24 N4 O -","- C192 H192 N32 O8 -","8","1","","Dinesh G. Patel; Michelle M. Paquette; Roni A. Kopelman; Werner Kaminsky; Michael J. Ferguson; Natia L. Frank","A Solution- and Solid-State Investigation of Medium Effects on Charge Separation in Metastable Photomerocyanines","Journal of the American Chemical Society","2010","132","","12568","12586","10.1021/ja100238h","","","0.71073","MoKα","","0.0702","0.0469","","","0.1174","0.1352","","","","","","1.005","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103034","11.0123","0.0006","11.1746","0.0006","14.6641","0.0008","72.493","0.003","89.767","0.003","83.308","0.003","1708.31","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","IIQSO_triclinic","IIQSO_triclinic","","- C21 H19 N3 O -","- C21 H19 N3 O -","- C84 H76 N12 O4 -","4","2","","Dinesh G. Patel; Michelle M. Paquette; Roni A. Kopelman; Werner Kaminsky; Michael J. Ferguson; Natia L. Frank","A Solution- and Solid-State Investigation of Medium Effects on Charge Separation in Metastable Photomerocyanines","Journal of the American Chemical Society","2010","132","","12568","12586","10.1021/ja100238h","","","0.71073","MoKα","","0.0597","0.0507","","","0.1273","0.1362","","","","","","1.081","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103035","14.5008","0.0005","8.9511","0.0003","14.8771","0.0006","90","","107.092","0.002","90","","1845.73","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","IPSO","IPSO","","- C24 H20 N4 O -","- C24 H20 N4 O -","- C96 H80 N16 O4 -","4","1","","Dinesh G. Patel; Michelle M. Paquette; Roni A. Kopelman; Werner Kaminsky; Michael J. Ferguson; Natia L. Frank","A Solution- and Solid-State Investigation of Medium Effects on Charge Separation in Metastable Photomerocyanines","Journal of the American Chemical Society","2010","132","","12568","12586","10.1021/ja100238h","","","0.71073","MoKα","","0.0608","0.045","","","0.1236","0.1368","","","","","","1.022","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103036","6.6536","0.0012","16.165","0.003","20.809","0.004","90","","93.277","0.002","90","","2234.5","0.7","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N4 O4 -","- C24 H30 N4 O4 -","- C96 H120 N16 O16 -","4","1","","Dinesh G. Patel; Michelle M. Paquette; Roni A. Kopelman; Werner Kaminsky; Michael J. Ferguson; Natia L. Frank","A Solution- and Solid-State Investigation of Medium Effects on Charge Separation in Metastable Photomerocyanines","Journal of the American Chemical Society","2010","132","","12568","12586","10.1021/ja100238h","","","0.71073","MoKα","","0.1056","0.0906","","","0.2458","0.2565","","","","","","1.149","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103037","18.7213","0.0009","28.552","0.0013","15.053","0.0007","90","","110.596","0.0011","90","","7532","0.6","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C84 H114 N4 O4 Sn -","- C84 H114 N4 O4 Sn -","- C336 H456 N16 O16 Sn4 -","4","0.5","","Yohsuke Yamamoto; Yusuke Hirata; Megumi Kodama; Torahiko Yamaguchi; Shiro Matsukawa; Kin-ya Akiba; Daisuke Hashizume; Fujiko Iwasaki; Atsuya Muranaka; Masanobu Uchiyama; Ping Chen; Karl M. Kadish; Nagao Kobayashi","Synthesis, Reactions, and Electronic Properties of 16 π-Electron Octaisobutyltetraphenylporphyrin","Journal of the American Chemical Society","2010","132","","12627","12638","10.1021/ja102817a","","","0.71075","MoKα","","0.042","0.0374","","","0.0927","0.0951","","","","","","1.096","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103038","17.2189","0.0016","26.742","0.002","18.455","0.0013","90","","117.39","0.006","90","","7545.3","1.1","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C82 H114 N4 O5 Zn -","- C82 H109 N4 O5 Zn -","- C328 H436 N16 O20 Zn4 -","4","1","","Yohsuke Yamamoto; Yusuke Hirata; Megumi Kodama; Torahiko Yamaguchi; Shiro Matsukawa; Kin-ya Akiba; Daisuke Hashizume; Fujiko Iwasaki; Atsuya Muranaka; Masanobu Uchiyama; Ping Chen; Karl M. Kadish; Nagao Kobayashi","Synthesis, Reactions, and Electronic Properties of 16 π-Electron Octaisobutyltetraphenylporphyrin","Journal of the American Chemical Society","2010","132","","12627","12638","10.1021/ja102817a","","","0.71075","MoKα","","0.1542","0.0885","","","0.2168","0.2582","","","","","","1.038","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103039","17.5658","0.0004","27.0237","0.0007","18.013","0.0004","90","","117.338","0.0007","90","","7595.6","0.3","173","","173","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C79 H98 Cl6 Cu N4 -","- C79 H98 Cl6 Cu N4 -","- C316 H392 Cl24 Cu4 N16 -","4","1","","Yohsuke Yamamoto; Yusuke Hirata; Megumi Kodama; Torahiko Yamaguchi; Shiro Matsukawa; Kin-ya Akiba; Daisuke Hashizume; Fujiko Iwasaki; Atsuya Muranaka; Masanobu Uchiyama; Ping Chen; Karl M. Kadish; Nagao Kobayashi","Synthesis, Reactions, and Electronic Properties of 16 π-Electron Octaisobutyltetraphenylporphyrin","Journal of the American Chemical Society","2010","132","","12627","12638","10.1021/ja102817a","","","0.71075","MoKα","","0.102","0.0713","","","0.1704","0.1857","","","","","","1.06","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103040","17.56","0.02","27.034","0.014","18.17","0.03","90","","117.05","0.17","90","","7682","2","173","","173","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C79 H98 Cl6 N4 Pd -","- C79 H98 Cl6 N4 Pd -","- C316 H392 Cl24 N16 Pd4 -","4","1","","Yohsuke Yamamoto; Yusuke Hirata; Megumi Kodama; Torahiko Yamaguchi; Shiro Matsukawa; Kin-ya Akiba; Daisuke Hashizume; Fujiko Iwasaki; Atsuya Muranaka; Masanobu Uchiyama; Ping Chen; Karl M. Kadish; Nagao Kobayashi","Synthesis, Reactions, and Electronic Properties of 16 π-Electron Octaisobutyltetraphenylporphyrin","Journal of the American Chemical Society","2010","132","","12627","12638","10.1021/ja102817a","","","0.71075","MoKα","","0.0868","0.056","","","0.1611","0.1703","","","","","","1.03","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103041","19.1765","0.0009","19.4319","0.0009","41.7319","0.0019","90","","90","","90","","15550.8","1.2","173","","173","","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C76 H106 Cu F6 N4 O7 Sb -","- C76 H92 Cu F6 N4 O7 Sb -","- C608 H736 Cu8 F48 N32 O56 Sb8 -","8","0.5","","Yohsuke Yamamoto; Yusuke Hirata; Megumi Kodama; Torahiko Yamaguchi; Shiro Matsukawa; Kin-ya Akiba; Daisuke Hashizume; Fujiko Iwasaki; Atsuya Muranaka; Masanobu Uchiyama; Ping Chen; Karl M. Kadish; Nagao Kobayashi","Synthesis, Reactions, and Electronic Properties of 16 π-Electron Octaisobutyltetraphenylporphyrin","Journal of the American Chemical Society","2010","132","","12627","12638","10.1021/ja102817a","","","0.71075","MoKα","","0.0647","0.0627","","","0.179","0.1811","","","","","","1.096","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103042","14.2691","0.001","14.3504","0.001","20.8703","0.0014","99.7682","0.0019","97.5856","0.0019","108.675","0.0018","3909.6","0.5","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C78.5 H97 Cl6.5 N4 Zn2 -","- C78.5 H97 Cl6.5 N4 Zn2 -","- C157 H194 Cl13 N8 Zn4 -","2","1","","Yohsuke Yamamoto; Yusuke Hirata; Megumi Kodama; Torahiko Yamaguchi; Shiro Matsukawa; Kin-ya Akiba; Daisuke Hashizume; Fujiko Iwasaki; Atsuya Muranaka; Masanobu Uchiyama; Ping Chen; Karl M. Kadish; Nagao Kobayashi","Synthesis, Reactions, and Electronic Properties of 16 π-Electron Octaisobutyltetraphenylporphyrin","Journal of the American Chemical Society","2010","132","","12627","12638","10.1021/ja102817a","","","0.71075","MoKα","","0.1712","0.0845","","","0.2012","0.2569","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103043","10.2451","0.0004","18.7518","0.0007","29.8201","0.0013","90","","91.639","0.003","90","","5726.5","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C1-#23863-C78(C6H5CH2OO)Cl7","","","- C85 H7 Cl7 O2 -","- C85 H7 Cl7 O2 -","- C340 H28 Cl28 O8 -","4","1","","Yuan-Zhi Tan; Jia Li; Ting Zhou; Yu-Qi Feng; Shui-Chao Lin; Xin Lu; Zhuang-Ping Zhan; Su-Yuan Xie; Rong-Bin Huang; Lan-Sun Zheng","Pentagon-Fused Hollow Fullerene in C78 Family Retrieved by Chlorination","Journal of the American Chemical Society","2010","132","","12648","12652","10.1021/ja102887t","","","0.71073","MoKα","","0.1275","0.0624","","","0.1132","0.1278","","","","","","0.926","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103044","9.952","0.002","15.876","0.003","15.877","0.003","77.41","0.03","83.69","0.03","88.42","0.03","2433.4","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C80 H26 Cl3 N3 O3 -","- C80 H26 Cl3 N3 O3 -","- C160 H52 Cl6 N6 O6 -","2","1","","Cheng-Che Chu; Guillaume Raffy; Debdas Ray; André Del Guerzo; Brice Kauffmann; Guillaume Wantz; Lionel Hirsch; Dario M. Bassani","Self-Assembly of Supramolecular Fullerene Ribbons via Hydrogen-Bonding Interactions and Their Impact on Fullerene Electronic Interactions and Charge Carrier Mobility","Journal of the American Chemical Society","2010","132","","12717","12723","10.1021/ja104750f","","","0.855","synchrotronradiation","","0.125","0.1122","","","0.3345","0.349","","","","","","1.657","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103045","23.8726","0.0016","5.0504","0.0003","21.1244","0.0014","90","","107.107","0.002","90","","2434.2","0.3","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 O3 -","- C14 H16 O3 -","- C112 H128 O24 -","8","1","","Tse-Min Teng; Arindam Das; Deepak B. Huple; Rai-Shung Liu","Gold-Catalyzed Stereoselective Synthesis of 9-Oxabicyclo[3.3.1]nona-4,7-dienes from Diverse 1-Oxo-4-oxy-5-ynes: A Viable Formal [4 + 2] Cycloaddition on an s-trans-Heterodiene Framework","Journal of the American Chemical Society","2010","132","","12565","12567","10.1021/ja106493h","","","0.71073","MoKα","","0.0851","0.0445","","","0.1189","0.153","","","","","","1.043","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103046","39.583","0.007","39.583","0.007","9.3091","0.0015","90","","90","","90","","14586","4","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C40 H44 O8 -","- C40 H44 O8 -","- C640 H704 O128 -","16","1","","Tse-Min Teng; Arindam Das; Deepak B. Huple; Rai-Shung Liu","Gold-Catalyzed Stereoselective Synthesis of 9-Oxabicyclo[3.3.1]nona-4,7-dienes from Diverse 1-Oxo-4-oxy-5-ynes: A Viable Formal [4 + 2] Cycloaddition on an s-trans-Heterodiene Framework","Journal of the American Chemical Society","2010","132","","12565","12567","10.1021/ja106493h","","","0.71073","MoKα","","0.1624","0.0745","","","0.1663","0.1991","","","","","","0.929","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103047","14.5979","0.001","13.6986","0.0011","21.6725","0.0016","90","","103.25","0.006","90","","4218.5","0.6","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H20 N8 O14 Ru Zn -","- C40 H20 N8 O14 Ru Zn -","- C160 H80 N32 O56 Ru4 Zn4 -","4","1","","Caleb A. Kent; Brian P. Mehl; Liqing Ma; John M. Papanikolas; Thomas J. Meyer; Wenbin Lin","Energy Transfer Dynamics in Metal-Organic Frameworks","Journal of the American Chemical Society","2010","132","","12767","12769","10.1021/ja102804s","","","1.54178","CuKα","","0.1074","0.0802","","","0.2164","0.2401","","","","","","1.083","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103048","14.5979","0.001","13.6986","0.0011","21.6725","0.0016","90","","103.25","0.006","90","","4218.5","0.6","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H20 N6 O8 Ru Zn -","- C34 H20 N6 O8 Ru Zn -","- C136 H80 N24 O32 Ru4 Zn4 -","4","1","","Caleb A. Kent; Brian P. Mehl; Liqing Ma; John M. Papanikolas; Thomas J. Meyer; Wenbin Lin","Energy Transfer Dynamics in Metal-Organic Frameworks","Journal of the American Chemical Society","2010","132","","12767","12769","10.1021/ja102804s","","","1.54178","CuKα","","0.0813","0.0624","","","0.1558","0.1634","","","","","","1.085","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103049","13.2807","0.0004","13.2807","0.0004","52.5695","0.0017","90","","90","","120","","8029.8","0.4","123","2","123","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C57.5 H62 N2 O2 Zn2 -","- C57.5 H62 N2 O2 Zn2 -","- C345 H372 N12 O12 Zn12 -","6","1","","Sefer Ay; R. E. Ziegert; H. Zhang; Martin Nieger; Kari Rissanen; K. Fink; A. Kubas; Ruth M. Gschwind; Stefan Bräse","NMR-Spectroscopic and Solid-State Investigations of Cometal-Free Asymmetric Conjugate Addition: A Dinuclear Paracyclophaneimine Zinc Methyl Complex","Journal of the American Chemical Society","2010","132","","12899","12905","10.1021/ja1032502","","","0.71073","MoKα","","0.0534","0.046","","","0.1149","0.12","","","","","","1.092","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103050","14.362","0.0017","17.989","0.003","15.7391","0.0017","90","","94.13","0.009","90","","4055.8","0.9","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H19 B Cu F20 N3 O -","- C44 H19 B Cu F20 N3 O -","- C176 H76 B4 Cu4 F80 N12 O4 -","4","1","","Heather R. Lucas; Gerald J. Meyer; Kenneth D. Karlin","CO and O2 Binding to Pseudo-tetradentate Ligand-Copper(I) Complexes with a Variable N-Donor Moiety: Kinetic/Thermodynamic Investigation Reveals Ligand-Induced Changes in Reaction Mechanism","Journal of the American Chemical Society","2010","132","","12927","12940","10.1021/ja104107q","","","0.71073","MoKα","","0.0496","0.0309","","","0.0764","0.0797","","","","","","1.064","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103051","20.1276","0.0002","20.3135","0.0002","20.7405","0.0002","90","","90","","90","","8480","0.14","110","","110","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C46 H20 B Cu F20 N4 -","- C46 H20 B Cu F20 N4 -","- C368 H160 B8 Cu8 F160 N32 -","8","1","","Heather R. Lucas; Gerald J. Meyer; Kenneth D. Karlin","CO and O2 Binding to Pseudo-tetradentate Ligand-Copper(I) Complexes with a Variable N-Donor Moiety: Kinetic/Thermodynamic Investigation Reveals Ligand-Induced Changes in Reaction Mechanism","Journal of the American Chemical Society","2010","132","","12927","12940","10.1021/ja104107q","","","0.71073","MoKα","","0.066","0.04","","","0.0859","0.106","","","","","","1.135","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103052","16.5778","0.0008","16.6516","0.0005","17.8893","0.0007","90","","100.426","0.004","90","","4856.8","0.3","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H30 B Cu F20 N4 O -","- C53 H30 B Cu F20 N4 O -","- C212 H120 B4 Cu4 F80 N16 O4 -","4","1","","Heather R. Lucas; Gerald J. Meyer; Kenneth D. Karlin","CO and O2 Binding to Pseudo-tetradentate Ligand-Copper(I) Complexes with a Variable N-Donor Moiety: Kinetic/Thermodynamic Investigation Reveals Ligand-Induced Changes in Reaction Mechanism","Journal of the American Chemical Society","2010","132","","12927","12940","10.1021/ja104107q","","","0.71073","MoKα","","0.1079","0.0544","","","0.1119","0.1384","","","","","","1.033","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103053","17.87","0.05","19.62","0.05","23.8","0.07","102.46","0.04","104.83","0.04","96.28","0.04","7756","4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Tb4Mn4","","","- C135 H155 Mn4 N9 O43 Tb4 -","- C135 H137 Mn4 N9 O43 Tb4 -","- C270 H274 Mn8 N18 O86 Tb8 -","2","1","","Georgios Karotsis; Stuart Kennedy; Simon J. Teat; Christine M. Beavers; Drew A. Fowler; Juan J. Morales; Marco Evangelisti; Scott J. Dalgarno; Euan K. Brechin","[MnIII4LnIII4] Calix[4]arene Clusters as Enhanced Magnetic Coolers and Molecular Magnets","Journal of the American Chemical Society","2010","132","","12983","12990","10.1021/ja104848m","","","0.71073","MoKα","","0.0822","0.0507","","","0.129","0.1413","","","","","","0.977","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103054","17.805","0.002","19.781","0.002","23.563","0.003","102.752","0.002","104.586","0.002","96.203","0.002","7714.7","1.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","GK2748","","","- C130 H140 Dy4 Mn4 N8 O40 -","- C130 H122 Dy4 Mn4 N8 O40 -","- C260 H244 Dy8 Mn8 N16 O80 -","2","1","","Georgios Karotsis; Stuart Kennedy; Simon J. Teat; Christine M. Beavers; Drew A. Fowler; Juan J. Morales; Marco Evangelisti; Scott J. Dalgarno; Euan K. Brechin","[MnIII4LnIII4] Calix[4]arene Clusters as Enhanced Magnetic Coolers and Molecular Magnets","Journal of the American Chemical Society","2010","132","","12983","12990","10.1021/ja104848m","","","0.7749","synchrotron","","0.0776","0.0511","","","0.1219","0.1313","","","","","","0.921","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103055","12.5554","0.0016","19.869","0.003","19.126","0.002","90","","96.678","0.002","90","","4738.9","1.1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","di(Lithium tetrahydrofuran) Iron(II) tetrakis(bistert-butyl ketimide)","","- C44 H88 Fe Li2 N4 O2 -","- C44 H88 Fe Li2 N4 O2 -","- C176 H352 Fe4 Li8 N16 O8 -","4","1","","Richard A. Lewis; Guang Wu; Trevor W. Hayton","Synthesis and Characterization of an Iron(IV) Ketimide Complex","Journal of the American Chemical Society","2010","132","","12814","12816","10.1021/ja104934n","","","0.71073","MoKα","","0.1309","0.072","","","0.1488","0.1828","","","","","","1.063","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103056","10.7816","0.0017","11.8835","0.0019","18.739","0.003","87.016","0.003","81.074","0.003","69.225","0.003","2217.6","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Lithium dimethoxyethane Iron(III) tetrakis(bistert-butyl ketimide)","","- C40 H82 Fe Li N4 O2 -","- C40 H82 Fe Li N4 O2 -","- C80 H164 Fe2 Li2 N8 O4 -","2","1","","Richard A. Lewis; Guang Wu; Trevor W. Hayton","Synthesis and Characterization of an Iron(IV) Ketimide Complex","Journal of the American Chemical Society","2010","132","","12814","12816","10.1021/ja104934n","","","0.71073","MoKα","","0.0737","0.0465","","","0.101","0.1161","","","","","","1.055","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103057","22.138","0.004","8.5192","0.0016","22.613","0.004","90","","111.493","0.003","90","","3968.2","1.3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Iron(IV) tetrakis(bistert-butyl ketimide)","","- C36 H72 Fe N4 -","- C36 H54 Fe N4 -","- C144 H216 Fe4 N16 -","4","0.5","","Richard A. Lewis; Guang Wu; Trevor W. Hayton","Synthesis and Characterization of an Iron(IV) Ketimide Complex","Journal of the American Chemical Society","2010","132","","12814","12816","10.1021/ja104934n","","","0.71073","MoKα","","0.0962","0.0716","","","0.1824","0.1989","","","","","","1.078","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103058","8.7176","0.0018","10.561","0.002","17.692","0.004","90","","104.079","0.003","90","","1579.9","0.6","100","2","100","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C44 H32 N2 -","- C44 H32 N2 -","- C88 H64 N4 -","2","0.5","","Timothy D. Lash; Sarah A. Jones; Gregory M. Ferrence","Synthesis and Characterization of Tetraphenyl-21,23-dideazaporphyrin: The Best Evidence Yet That Porphyrins Really Are the [18]Annulenes of Nature","Journal of the American Chemical Society","2010","132","","12786","12787","10.1021/ja105146a","","x-ray","0.71073","MoKα","","0.1041","0.0556","","","0.1093","0.1298","","","","","","1.013","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103059","3.8159","0.0001","3.8159","0.0001","6.246","0.0003","90","","90","","90","","90.949","0.006","249","2","249","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","Iron telluride","Iron telluride","","- Fe1.13 S0.05 Te0.95 -","- Fe1.123 S0.052 Te0.948 -","- Fe2.246 S0.104 Te1.896 -","2","0.125","","Pawel Zajdel; Ping-Yen Hsieh; Efrain E. Rodriguez; Nicholas P. Butch; Jeff D. Magill; Johnpierre Paglione; Peter Zavalij; Matthew R. Suchomel; Mark A. Green","Phase Separation and Suppression of the Structural and Magnetic Transitions in Superconducting Doped Iron Tellurides, Fe1+xTe1-ySy","Journal of the American Chemical Society","2010","132","","13000","13007","10.1021/ja105279p","","","0.71073","MoKα","","0.0194","0.0193","","","0.0422","0.0423","","","","","","1","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103060","10.2808","0.0002","11.0503","0.0002","17.9965","0.0004","84.552","0.001","89.25","0.001","67.981","0.001","1886.26","0.07","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H58 N3 P Si -","- C39 H58 N3 P Si -","- C78 H116 N6 P2 Si2 -","2","1","","David Gau; Ricardo Rodriguez; Tsuyoshi Kato; Nathalie Saffon-Merceron; Antoine Baceiredo","Diastereoselective Synthesis of Bulky, Strongly Nucleophilic, and Configurationally Stable P-Stereogenic Tricyclic Phosphines","Journal of the American Chemical Society","2010","132","","12841","12843","10.1021/ja1054912","","","0.71073","MoKα","","0.0626","0.0459","","","0.1134","0.1236","","","","","","1.041","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103061","11.759","0.0003","12.459","0.0002","18.486","0.0003","72.49","0.001","85.614","0.001","62.576","0.001","2286.38","0.08","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H66 N3 O P Si -","- C51 H66 N3 O P Si -","- C102 H132 N6 O2 P2 Si2 -","2","1","","David Gau; Ricardo Rodriguez; Tsuyoshi Kato; Nathalie Saffon-Merceron; Antoine Baceiredo","Diastereoselective Synthesis of Bulky, Strongly Nucleophilic, and Configurationally Stable P-Stereogenic Tricyclic Phosphines","Journal of the American Chemical Society","2010","132","","12841","12843","10.1021/ja1054912","","","0.71073","MoKα","","0.0726","0.0541","","","0.1403","0.154","","","","","","1.05","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103062","11.2805","0.0008","10.0135","0.0007","33.283","0.002","90","","93.313","0.002","90","","3753.3","0.4","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H54 N3 P Si -","- C41 H54 N3 P Si -","- C164 H216 N12 P4 Si4 -","4","1","","David Gau; Ricardo Rodriguez; Tsuyoshi Kato; Nathalie Saffon-Merceron; Antoine Baceiredo","Diastereoselective Synthesis of Bulky, Strongly Nucleophilic, and Configurationally Stable P-Stereogenic Tricyclic Phosphines","Journal of the American Chemical Society","2010","132","","12841","12843","10.1021/ja1054912","","","0.71073","MoKα","","0.114","0.0556","","","0.1114","0.1328","","","","","","1.008","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103063","10.2915","0.0002","14.4688","0.0002","17.2543","0.0003","108.789","0.001","100.115","0.001","92.699","0.001","2379.69","0.07","193","2","193","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C48 H72 Cl3 N3 P Rh Si -","- C48 H72 Cl3 N3 P Rh Si -","- C96 H144 Cl6 N6 P2 Rh2 Si2 -","2","1","","David Gau; Ricardo Rodriguez; Tsuyoshi Kato; Nathalie Saffon-Merceron; Antoine Baceiredo","Diastereoselective Synthesis of Bulky, Strongly Nucleophilic, and Configurationally Stable P-Stereogenic Tricyclic Phosphines","Journal of the American Chemical Society","2010","132","","12841","12843","10.1021/ja1054912","","x-ray","0.71073","MoKα","","0.0752","0.0451","","","0.0945","0.1067","","","","","","0.973","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103064","6.0604","0.0012","10.0127","0.0019","24.814","0.005","90","","90","","90","","1505.7","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H12 F5 N O2 -","- C15 H12 F5 N O2 -","- C60 H48 F20 N4 O8 -","4","1","","Shifa Zhu; Xue Xu; Jason A. Perman; X. Peter Zhang","A General and Efficient Cobalt(II)-Based Catalytic System for Highly Stereoselective Cyclopropanation of Alkenes with α-Cyanodiazoacetates","Journal of the American Chemical Society","2010","132","","12796","12799","10.1021/ja1056246","","","1.54178","CuKα","","0.053","0.051","","","0.1296","0.1364","","","","","","1.085","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103065","8.5842","0.0002","8.5197","0.0002","8.4723","0.0002","90","","90","","90","","619.62","0.03","100","2","100","2","","","","","","","","4","P m n 21","P 2ac -2","31","","","","- C14 H19 N O2 -","- C14 H20 N O2 -","- C28 H40 N2 O4 -","2","0.5","","Shifa Zhu; Xue Xu; Jason A. Perman; X. Peter Zhang","A General and Efficient Cobalt(II)-Based Catalytic System for Highly Stereoselective Cyclopropanation of Alkenes with α-Cyanodiazoacetates","Journal of the American Chemical Society","2010","132","","12796","12799","10.1021/ja1056246","","","1.54178","CuKα","","0.0376","0.0375","","","0.0911","0.0915","","","","","","1.145","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103066","6.1618","0.0007","12.7291","0.0014","15.3398","0.0017","90","","90","","90","","1203.2","0.2","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-hydroxy-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-4,7-methanoisoindol-1-one","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","","Satoshi Takebayashi; Jeremy M. John; Steven H. Bergens","Desymmetrization of meso-Cyclic Imides via Enantioselective Monohydrogenation","Journal of the American Chemical Society","2010","132","","12832","12834","10.1021/ja105783u","","","0.71073","MoKα","","0.0411","0.0358","","","0.083","0.0866","","","","","","1.062","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103067","6.1944","0.0004","12.7213","0.0008","15.5031","0.0009","90","","90","","90","","1221.66","0.13","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H14 F N O2 -","- C15 H14 F N O2 -","- C60 H56 F4 N4 O8 -","4","1","","Satoshi Takebayashi; Jeremy M. John; Steven H. Bergens","Desymmetrization of meso-Cyclic Imides via Enantioselective Monohydrogenation","Journal of the American Chemical Society","2010","132","","12832","12834","10.1021/ja105783u","","","0.71073","MoKα","","0.0304","0.0295","","","0.0799","0.081","","","","","","1.071","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103068","8.7288","0.0003","11.5872","0.0004","17.581","0.0006","90","","103.441","0.0004","90","","1729.48","0.1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H21 N O -","- C24 H21 N O -","- C96 H84 N4 O4 -","4","2","","Satoshi Takebayashi; Jeremy M. John; Steven H. Bergens","Desymmetrization of meso-Cyclic Imides via Enantioselective Monohydrogenation","Journal of the American Chemical Society","2010","132","","12832","12834","10.1021/ja105783u","","","0.71073","MoKα","","0.0328","0.0302","","","0.0783","0.0841","","","","","","1.052","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103069","13.8572","0.0002","7.249","0.0001","15.4928","0.0003","90","","104.936","0.001","90","","1503.69","0.04","150","2","150","2","","","","","","","synthesis as described","7","P 1 21 1","P 2yb","4","RajanBabu1733","","","- C24 H46 B N3 O2 Si Sn -","- C24 H46 B N3 O2 Si Sn -","- C48 H92 B2 N6 O4 Si2 Sn2 -","2","1","","Ramakrishna Reddy Singidi; Amanda M. Kutney; Judith C. Gallucci; T. V. RajanBabu","Stereoselective Cyclization of Functionalized 1,n-Diynes Mediated by [X-Y] Reagents [X-Y = R3Si-SnR'3 or (R2N)2B-SnR'3]: Synthesis and Properties of Atropisomeric 1,3-Dienes","Journal of the American Chemical Society","2010","132","","13078","13087","10.1021/ja105939v","","x-ray","0.71073","MoKα","","0.041","0.0286","","","0.0556","0.0591","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103070","11.561","0.004","11.7","0.004","6.524","0.002","90","","90","","90","","882.5","0.5","293","2","293","2","","","","","","","","4","P n n 2","P 2 -2n","34","","","","- B5 I O9 Pb2 -","- B5 I O9 Pb2 -","- B20 I4 O36 Pb8 -","4","1","","Yi-Zhi Huang; Li-Ming Wu; Xin-Tao Wu; Long-Hua Li; Ling Chen; Yong-Fan Zhang","Pb2B5O9I: An Iodide Borate with Strong Second Harmonic Generation","Journal of the American Chemical Society","2010","132","","12788","12789","10.1021/ja106066k","","","0.71073","MoKα","","0.0475","0.0454","","","0.1185","0.1212","","","","","","1.14","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103071","12.199","0.004","12.756","0.004","20.89","0.007","90.313","0.004","96.724","0.004","94.821","0.004","3216.5","1.8","95","2","95","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H81 Au2 Cl9 F2 N4 -","- C56 H78 Au2 F2 N4 -","- C112 H156 Au4 F4 N8 -","2","1","","Neal P. Mankad; F. Dean Toste","C-C Coupling Reactivity of an Alkylgold(III) Fluoride Complex with Arylboronic Acids","Journal of the American Chemical Society","2010","132","","12859","12861","10.1021/ja106257n","","","0.71073","MoKα","","0.0788","0.0442","","","0.0948","0.1071","","","","","","0.775","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103072","11.884","0.002","12.592","0.003","12.596","0.003","81.025","0.003","86.999","0.003","66.552","0.002","1708","0.6","128","2","128","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H43 Au Cl6 F2 N2 -","- C28 H41 Au F N2 -","- C56 H82 Au2 F2 N4 -","2","1","","Neal P. Mankad; F. Dean Toste","C-C Coupling Reactivity of an Alkylgold(III) Fluoride Complex with Arylboronic Acids","Journal of the American Chemical Society","2010","132","","12859","12861","10.1021/ja106257n","","","0.71073","MoKα","","0.0271","0.0241","","","0.0744","0.0795","","","","","","0.41","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103073","8.27048","0.00015","11.4124","0.0002","14.4475","0.0003","69.8042","0.001","84.6144","0.0011","88.0854","0.0011","1274.15","0.04","123.1","","123.1","","","","","","","","","5","P 1","P 1","1","","","","- C28 H35 N O2 Si -","- C28 H35 N O2 Si -","- C56 H70 N2 O4 Si2 -","2","2","","Takahiro Nishimura; Hiroki Makino; Makoto Nagaosa; Tamio Hayashi","Rhodium-Catalyzed Enantioselective 1,6-Addition of Arylboronic Acids to Enynamides: Asymmetric Synthesis of Axially Chiral Allenylsilanes","Journal of the American Chemical Society","2010","132","","12865","12867","10.1021/ja1066509","","","1.54187","CuKα","","","0.0576","","","","0.2049","","","","","","1.102","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103074","11.81","0.002","14.161","0.003","28.699","0.005","90","","90","","90","","4799.7","1.5","123","2","123","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C56.33 H52.65 Cl0.65 F4 N O Rh Si -","- C56.325 H52.65 Cl0.65 F4 N O Rh Si -","- C225.3 H210.6 Cl2.6 F16 N4 O4 Rh4 Si4 -","4","1","","Takahiro Nishimura; Hiroki Makino; Makoto Nagaosa; Tamio Hayashi","Rhodium-Catalyzed Enantioselective 1,6-Addition of Arylboronic Acids to Enynamides: Asymmetric Synthesis of Axially Chiral Allenylsilanes","Journal of the American Chemical Society","2010","132","","12865","12867","10.1021/ja1066509","","","0.71075","MoKα","","0.0463","0.0407","","","0.0895","0.0927","","","","","","1.011","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103075","15.341","0.002","12.998","0.002","23.922","0.004","90","","94.07","0.02","90","","4758.1","1.3","301","2","301","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 Cl6 Fe2 N4 -","- C16 H20 Cl6 Fe2 N4 -","- C128 H160 Cl48 Fe16 N32 -","8","1","","Toby Wai-Shan Chow; Ella Lai-Ming Wong; Zhen Guo; Yungen Liu; Jie-Sheng Huang; Chi-Ming Che","cis-Dihydroxylation of Alkenes with Oxone Catalyzed by Iron Complexes of a Macrocyclic Tetraaza Ligand and Reaction Mechanism by ESI-MS Spectrometry and DFT Calculations","Journal of the American Chemical Society","2010","132","","13229","13239","10.1021/ja100967g","","","0.71073","MoKα","","0.0379","0.0338","","","0.086","0.0892","","","","","","1.045","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103076","13.806","0.003","9.909","0.002","16.903","0.004","90","","90","","90","","2312.4","0.9","301","2","301","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C18 H23 Cl3 Fe N5 O4 -","- C18 H24 Cl3 Fe N5 O4 -","- C72 H96 Cl12 Fe4 N20 O16 -","4","0.5","","Toby Wai-Shan Chow; Ella Lai-Ming Wong; Zhen Guo; Yungen Liu; Jie-Sheng Huang; Chi-Ming Che","cis-Dihydroxylation of Alkenes with Oxone Catalyzed by Iron Complexes of a Macrocyclic Tetraaza Ligand and Reaction Mechanism by ESI-MS Spectrometry and DFT Calculations","Journal of the American Chemical Society","2010","132","","13229","13239","10.1021/ja100967g","","","0.71073","MoKα","","0.0379","0.0295","","","0.0797","0.0866","","","","","","1.031","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103077","10.332","0.001","15.908","0.001","24.346","0.001","90","","101.907","0.001","90","","3915.4","0.5","150","0.1","150","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 Cl N2 P2 S2 Sc -","- C42 H38 Cl N2 P2 S2 Sc -","- C168 H152 Cl4 N8 P8 S8 Sc4 -","4","1","","Marie Fustier; Xavier F. Le Goff; Pascal Le Floch; Nicolas Mézailles","Nucleophilic Scandium Carbene Complexes","Journal of the American Chemical Society","2010","132","","13108","13110","10.1021/ja103220s","","","0.71069","MoKα","","0.096","0.049","","","0.1108","0.1264","","","","","","1.036","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103078","11.473","0.001","11.567","0.001","17.119","0.001","75.186","0.001","75.057","0.001","79.232","0.001","2104.2","0.3","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C70 H80 Cl4 O7 P4 S4 Sc4 -","- C66 H72 Cl4 O6 P4 S4 Sc4 -","- C66 H72 Cl4 O6 P4 S4 Sc4 -","1","0.5","","Marie Fustier; Xavier F. Le Goff; Pascal Le Floch; Nicolas Mézailles","Nucleophilic Scandium Carbene Complexes","Journal of the American Chemical Society","2010","132","","13108","13110","10.1021/ja103220s","","","0.71069","MoKα","","0.0714","0.0494","","","0.1473","0.1572","","","","","","0.989","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103079","18.17","0.004","9.5255","0.0019","20.973","0.004","90","","107.4","0.03","90","","3463.9","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H62 Fe Ni P2 -","- C34 H62 Fe Ni P2 -","- C136 H248 Fe4 Ni4 P8 -","4","1","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","0.71073","MoKα","","0.1244","0.0827","","","0.1459","0.1693","","","","","","1.143","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103080","18.29","0.004","9.6288","0.0019","20.917","0.004","90","","107.63","0.03","90","","3510.7","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H62 Fe P2 Pd -","- C34 H62 Fe P2 Pd -","- C136 H248 Fe4 P8 Pd4 -","4","1","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","0.71073","MoKα","","0.0859","0.0599","","","0.1182","0.1328","","","","","","1.144","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103081","18.301","0.004","9.6527","0.0019","20.902","0.004","90","","107.77","0.03","90","","3516.3","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H62 Fe P2 Pt -","- C34 H62 Fe P2 Pt -","- C136 H248 Fe4 P8 Pt4 -","4","1","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","0.71073","MoKα","","0.0488","0.0382","","","0.0716","0.0772","","","","","","1.08","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103082","10.3014","0.0011","18.0421","0.0019","19.625","0.002","90","","90.787","0.007","90","","3647.1","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H62 Fe O P2 Pd -","- C35 H62 Fe O P2 Pd -","- C140 H248 Fe4 O4 P8 Pd4 -","4","1","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","0.71073","MoKα","","0.1303","0.0473","","","0.0799","0.102","","","","","","0.962","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103083","13.0565","0.001","17.1744","0.0013","15.4708","0.0013","90","","90.521","0.005","90","","3469","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H62 Ni P2 -","- C34 H62 Ni P2 -","- C136 H248 Ni4 P8 -","4","1","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","1.54178","CuKα","","0.0491","0.037","","","0.1022","0.1248","","","","","","0.514","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103084","9.9919","0.001","17.1547","0.0017","20.575","0.002","90","","90.144","0.006","90","","3526.7","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H62 P2 Pd -","- C34 H62 P2 Pd -","- C136 H248 P8 Pd4 -","4","1","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","0.71073","MoKα","","0.0444","0.0297","","","0.0671","0.0734","","","","","","1.007","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103085","11.0266","0.0009","16.0425","0.0013","20.8119","0.0017","85.394","0.004","83.297","0.004","75.518","0.004","3535.2","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H62 P2 Pt -","- C34 H62 P2 Pt -","- C136 H248 P8 Pt4 -","4","2","","Inmaculada Matas; George R. Whittell; Benjamin M. Partridge; Jason P. Holland; Mairi F. Haddow; Jennifer C. Green; Ian Manners","Synthesis, Electronic Structure, and Reactivity of Strained Nickel-, Palladium-, and Platinum-Bridged [1]Ferrocenophanes","Journal of the American Chemical Society","2010","132","","13279","13289","10.1021/ja103367e","","","0.71073","MoKα","","0.0382","0.0266","","","0.0516","0.055","","","","","","1.037","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103086","15.242","0.002","6.8033","0.0012","15.381","0.002","90","","114.544","0.003","90","","1450.8","0.4","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H14 N4 -","- C19 H14 N4 -","- C76 H56 N16 -","4","1","","Youjun Yang; Stephanie K. Seidlits; Michelle M. Adams; Vincent M. Lynch; Christine E. Schmidt; Eric V. Anslyn; Jason B. Shear","A Highly Selective Low-Background Fluorescent Imaging Agent for Nitric Oxide","Journal of the American Chemical Society","2010","132","","13114","13116","10.1021/ja1040013","","","0.71073","MoKα","","0.0945","0.0515","","","0.1085","0.1275","","","","","","1.094","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103087","18.4363","0.0009","19.1408","0.001","31.0479","0.0016","89.481","0.001","79.964","0.001","62.354","0.001","9524.5","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","U18Py2PCP6","","","- C6 K11 O127 P16 U18.5 -","- C6 K11 O127 P16 U18.5 -","- C12 K22 O254 P32 U37 -","2","1","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0512","0.0371","","","0.0909","0.094","","","","","","0.97","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103088","29.819","0.002","27.014","0.002","26.777","0.002","90","","90","","90","","21570","3","193","2","193","2","","","","","","","","4","C m c e","-C 2ac 2","64","U20Py6a","","","- K10 O134 P12 U20 -","- K10 O134 P12 U20 -","- K40 O536 P48 U80 -","4","0.25","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.053","0.0469","","","0.1499","0.1527","","","","","","1.173","","","","has coordinates","270822","2021-11-23","08:35:27","" "4103089","35.968","0.005","18.094","0.002","31.033","0.005","90","","115.851","0.004","90","","18175","4","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","U20Py6b","","","- K14 O132 P12 U20 -","- K14 O132 P12 U20 -","- K56 O528 P48 U80 -","4","0.5","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0959","0.0608","","","0.1473","0.16","","","","","","0.945","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103090","30.641","0.002","19.1329","0.0015","21.936","0.003","90","","129.563","0.001","90","","9914.1","1.7","273","2","273","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","U20Py10","","","- K29 O158 P20 U20 -","- K29 O158 P20 U20 -","- K58 O316 P40 U40 -","2","0.25","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0445","0.0346","","","0.0957","0.0986","","","","","","1.076","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103091","25.237","0.0008","25.237","0.0008","21.9026","0.0007","90","","90","","90","","13949.9","0.8","100","2","100","2","","","","","","","","4","I 4/m","-I 4","87","U24PCP12","","","- C12 O168 P24 U24 -","- C12 O168 P24 U24 -","- C24 O336 P48 U48 -","2","0.125","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0397","0.0302","","","0.0721","0.0736","","","","","","0.935","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103092","22.746","0.002","22.746","0.002","30.426","0.004","90","","90","","90","","15742","3","273","2","273","2","","","","","","","","4","P 42/m n m","-P 4n 2n","136","U24Py12","","","- Na8 O180 P24 U24 -","- Na8 O180 P24 U24 -","- Na16 O360 P48 U48 -","2","0.125","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0598","0.0493","","","0.1329","0.1369","","","","","","1.015","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103093","32.035","0.002","18.9376","0.0013","37.919","0.003","90","","106.728","0.002","90","","22031","3","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","U26Py6","","","- K9 O162 P12 U26 -","- K9 O162 P12 U26 -","- K36 O648 P48 U104 -","4","0.5","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0606","0.0452","","","0.1135","0.1176","","","","","","0.998","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103094","25.225","0.002","19.7976","0.0019","27.139","0.003","90","","95.21","0.001","90","","13497","2","100","2","100","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","U26Py11","","","- K20 O185 P22 U26 -","- K20 O185 P22 U26 -","- K40 O370 P44 U52 -","2","0.5","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0564","0.0481","","","0.1269","0.1299","","","","","","1.055","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103095","28.456","0.003","28.456","0.003","28.08","0.007","90","","90","","90","","22738","7","273","2","273","2","","","","","","","","4","I 4 m m","I 4 -2","107","U32Py16","","","- Na4 O240 P32 U32 -","- Na4 O240 P32 U32 -","- Na8 O480 P64 U64 -","2","0.125","","Jie Ling; Jie Qiu; Ginger E. Sigmon; Matthew Ward; Jennifer E. S. Szymanowski; Peter C. Burns","Uranium Pyrophosphate/Methylenediphosphonate Polyoxometalate Cage Clusters","Journal of the American Chemical Society","2010","132","","13395","13402","10.1021/ja1048219","","","0.71073","MoKα","","0.0313","0.0279","","","0.0686","0.0691","","","","","","0.968","","","","has coordinates","178776","2020-10-21","18:00:00","" "4103096","12.73","0.002","28.884","0.005","18.417","0.003","90","","94.92","0.002","90","","6746.9","1.9","15","2","15","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Dipp*GeAgGeDipp*][SbF6].2chlorobenzene","","","- C72 H84 Ag Cl2 F6 Ge2 Sb -","- C72 H84 Ag Cl2 F6 Ge2 Sb -","- C288 H336 Ag4 Cl8 F24 Ge8 Sb4 -","4","0.5","","Xinping Wang; Yang Peng; Marilyn M. Olmstead; Håkon Hope; Philip P. Power","A Ditetrylyne as a π-Electron Donor: Synthesis and Characterization of [AgAr'GeGeAr']+SbF6- and [Ag2Ar'GeGe(F)Ar']+SbF6- (Ar' = C6H3-2,6(C6H3-2,6-Pri2)2)","Journal of the American Chemical Society","2010","132","","13150","13151","10.1021/ja1051236","","","0.71073","MoKα","","0.0933","0.0746","","","0.166","0.1767","","","","","","1.22","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103097","21.2232","0.0006","12.9714","0.0004","24.1179","0.0009","90","","108.767","0.003","90","","6286.5","0.4","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[D*GeAgGeFAgD*][SbF6].chlorobenzene","","","- C66 H79 Ag2 Cl F7 Ge2 Sb -","- C66 H79 Ag2 Cl F7 Ge2 Sb -","- C264 H316 Ag8 Cl4 F28 Ge8 Sb4 -","4","0.5","","Xinping Wang; Yang Peng; Marilyn M. Olmstead; Håkon Hope; Philip P. Power","A Ditetrylyne as a π-Electron Donor: Synthesis and Characterization of [AgAr'GeGeAr']+SbF6- and [Ag2Ar'GeGe(F)Ar']+SbF6- (Ar' = C6H3-2,6(C6H3-2,6-Pri2)2)","Journal of the American Chemical Society","2010","132","","13150","13151","10.1021/ja1051236","","","0.71073","MoKα","","0.046","0.0424","","","0.0836","0.0849","","","","","","1.22","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103098","8.5681","0.0004","17.6354","0.0008","8.9391","0.0004","90","","98.93","0.001","90","","1334.34","0.11","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Thiourea - 1,2-bis(4-pyridyl)ethylene (1:1 co-crystal)","","- C13 H14 N4 S -","- C13 H14 N4 S -","- C52 H56 N16 S4 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0421","0.0369","","","0.1008","0.107","","","","","","1.046","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103099","8.5377","0.0007","37.726","0.003","9.988","0.0008","90","","113.591","0.001","90","","2948.2","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Thiourea - 1-(4-pyridyl)-2-(4-cyanophenyl)ethylene (2:2 co-crystal)","","- C30 H28 N8 S2 -","- C30 H28 N8 S2 -","- C120 H112 N32 S8 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0641","0.0467","","","0.1215","0.1374","","","","","","1.065","","","","has coordinates,has disorder","178776","2020-10-21","18:00:00","" "4103100","8.4015","0.0005","17.9557","0.001","18.3422","0.001","90","","90.894","0.001","90","","2766.7","0.3","296","2","296","2","","","","","","","","4","P 1 n 1","P -2yac","7","","Thiourea - 1-(4-pyridyl)-2-(phenyl)ethylene (4:4 co-crystal)","","- C56 H60 N12 S4 -","- C56 H60 N12 S4 -","- C112 H120 N24 S8 -","2","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.078","0.0438","","","0.0934","0.1089","","","","","","1.015","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103101","8.6368","0.0004","9.0716","0.0004","18.1959","0.0009","90","","101.156","0.001","90","","1398.7","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Thiourea - 1-(4-pyridyl)-2-(4-fluorophenyl)ethylene (1:1 co-crystal)","","- C14 H14 F N3 S -","- C14 H14 F N3 S -","- C56 H56 F4 N12 S4 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0736","0.045","","","0.1146","0.1314","","","","","","1.025","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103102","8.5011","0.0005","18.8095","0.0011","18.3865","0.001","90","","98.242","0.001","90","","2909.7","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Thiourea - 1-(4-pyridyl)-2-(4-chlorophenyl)ethylene (1:1 co-crystal)","","- C14 H14 Cl N3 S -","- C14 H14 Cl N3 S -","- C112 H112 Cl8 N24 S8 -","8","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0702","0.049","","","0.1164","0.131","","","","","","1.061","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103103","8.5033","0.0004","18.8687","0.0008","18.5703","0.0008","90","","97.819","0.001","90","","2951.8","0.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Thiourea - 1-(4-pyridyl)-2-(4-bromophenyl)ethylene (1:1 co-crystal)","","- C14 H14 Br N3 S -","- C14 H14 Br N3 S -","- C112 H112 Br8 N24 S8 -","8","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0567","0.0372","","","0.0881","0.0977","","","","","","1.084","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103104","30.3481","0.0014","8.5791","0.0004","11.2687","0.0005","90","","95.238","0.001","90","","2921.7","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Thiourea - 1-(4-pyridyl)-2-(4-tolyl)ethylene (2:2 co-crystal)","","- C30 H34 N6 S2 -","- C30 H34 N6 S2 -","- C120 H136 N24 S8 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0654","0.0457","","","0.114","0.1293","","","","","","1.022","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103105","8.4917","0.0009","11.8893","0.0013","15.9374","0.0017","83.888","0.002","82.103","0.002","72.755","0.002","1518.5","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Thiourea - 1-(4-pyridyl)-2-(4-methoxyphenyl)ethylene (2:2 co-crystal)","","- C30 H34 N6 O2 S2 -","- C30 H34 N6 O2 S2 -","- C60 H68 N12 O4 S4 -","2","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0662","0.0447","","","0.1132","0.13","","","","","","1.017","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103106","8.1013","0.0004","19.9354","0.001","9.799","0.0005","90","","90","","90","","1582.56","0.14","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Thiourea - 1-(4-pyridyl)-2-(2,4-dichlorophenyl)ethylene (1:1 co-crystal)","","- C14 H13 Cl2 N3 S -","- C14 H13 Cl2 N3 S -","- C56 H52 Cl8 N12 S4 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.043","0.0306","","","0.0686","0.0744","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103107","30.6036","0.0019","8.7108","0.0005","11.9036","0.0007","90","","98.025","0.001","90","","3142.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Thiourea - 1-(4-pyridyl)-2-(4-ethylphenyl)ethylene (2:2 co-crystal)","","- C32 H38 N6 S2 -","- C32 H38 N6 S2 -","- C128 H152 N24 S8 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0795","0.059","","","0.151","0.1739","","","","","","1.04","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103108","8.5713","0.0009","13.2462","0.0014","15.878","0.0017","70.433","0.002","82.671","0.002","71.703","0.002","1612.2","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Thiourea - 1-(4-pyridyl)-2-(2-naphthyl)ethylene (2:2 co-crystal)","","- C36 H34 N6 S2 -","- C36 H34 N6 S2 -","- C72 H68 N12 S4 -","2","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.06","0.0459","","","0.1145","0.1311","","","","","","1.024","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103109","8.4795","0.0003","9.5571","0.0003","10.604","0.0003","91.245","0.001","98.067","0.001","95.441","0.001","846.47","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Thiourea - trans-1-(2-Pyridyl)-2-(4-pyridyl)ethylene (2:1 co-crystal)","","- C14 H18 N6 S2 -","- C14 H18 N6 S2 -","- C28 H36 N12 S4 -","2","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0437","0.0407","","","0.1028","0.1072","","","","","","1.082","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103110","8.5533","0.0006","9.606","0.0006","11.5275","0.0008","68.215","0.001","75.05","0.001","83.772","0.001","849.64","0.1","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","thiourea and 1-(2-pyridyl)-2-(3-pyridyl)ethylene (2:1 Co-crystal)","","- C14 H18 N6 S2 -","- C14 H18 N6 S2 -","- C28 H36 N12 S4 -","2","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.051","0.0403","","","0.1003","0.1083","","","","","","1.017","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103111","8.1625","0.0007","22.6","0.002","9.7018","0.0009","90","","107.557","0.001","90","","1706.3","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Thiourea - 1,2-bis(2-pyridyl)ethylene (2:1 co-crystal)","","- C14 H18 N6 S2 -","- C14 H18 N6 S2 -","- C56 H72 N24 S8 -","4","1","","Balakrishna R. Bhogala; Burjor Captain; Anand Parthasarathy; V. Ramamurthy","Thiourea as a Template for Photodimerization of Azastilbenes","Journal of the American Chemical Society","2010","132","","13434","13442","10.1021/ja105166d","","","0.71073","MoKα","","0.0481","0.0436","","","0.1052","0.1082","","","","","","1.147","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103112","10.3592","0.0002","10.4724","0.0002","11.3705","0.0001","102.787","0.001","93.846","0.001","90.24","","1200.01","0.03","84","2","84","2","","","","","","","","8","P 1","P 1","1","","","","- C49 H51 F6 Ir N O P3 S3 -","- C49 H51 F6 Ir N O P3 S3 -","- C49 H51 F6 Ir N O P3 S3 -","1","1","","George R. Clark; Lauren A. Ferguson; Amy E. McIntosh; Tilo Söhnel; L. James Wright","Functionalization of Metallabenzenes through Nucleophilic Aromatic Substitution of Hydrogen","Journal of the American Chemical Society","2010","132","","13443","13452","10.1021/ja105239t","","","0.71073","MoKα","","0.064","0.0623","","","0.152","0.1542","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103113","11.4866","0.0008","14.6889","0.001","27.657","0.002","96.337","0.006","90.484","0.006","102.217","0.005","4530.5","0.6","88","2","88","2","","","","","","","","7","P -1","-P 1","2","","","","- C47 H47 F6 Ir N P3 S3 -","- C47 H47 F6 Ir N P3 S3 -","- C188 H188 F24 Ir4 N4 P12 S12 -","4","2","","George R. Clark; Lauren A. Ferguson; Amy E. McIntosh; Tilo Söhnel; L. James Wright","Functionalization of Metallabenzenes through Nucleophilic Aromatic Substitution of Hydrogen","Journal of the American Chemical Society","2010","132","","13443","13452","10.1021/ja105239t","","","0.71073","MoKα","","0.2261","0.0907","","","0.1925","0.2505","","","","","","1.012","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103114","17.8209","0.001","10.1255","0.0006","23.1175","0.0012","90","","96.557","0.004","90","","4144.2","0.4","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H44 Ir N P2 S3 -","- C47 H44 Ir N P2 S3 -","- C188 H176 Ir4 N4 P8 S12 -","4","1","","George R. Clark; Lauren A. Ferguson; Amy E. McIntosh; Tilo Söhnel; L. James Wright","Functionalization of Metallabenzenes through Nucleophilic Aromatic Substitution of Hydrogen","Journal of the American Chemical Society","2010","132","","13443","13452","10.1021/ja105239t","","","0.71073","MoKα","","0.2008","0.0791","","","0.1388","0.1816","","","","","","0.965","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103115","11.86","0.0003","21.6582","0.0005","19.9376","0.0005","90","","101.649","0.001","90","","5015.8","0.2","89","2","89","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C50 H53 Cl2 F6 Ir N P3 S3 -","- C50 H53 Cl2 F6 Ir N P3 S3 -","- C200 H212 Cl8 F24 Ir4 N4 P12 S12 -","4","1","","George R. Clark; Lauren A. Ferguson; Amy E. McIntosh; Tilo Söhnel; L. James Wright","Functionalization of Metallabenzenes through Nucleophilic Aromatic Substitution of Hydrogen","Journal of the American Chemical Society","2010","132","","13443","13452","10.1021/ja105239t","","","0.71073","MoKα","","0.0492","0.0303","","","0.0615","0.0688","","","","","","1.008","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103116","9.899","0.003","13.034","0.005","15.353","0.007","90","","101.97","0.015","90","","1937.8","1.3","123.1","","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H20 Cl N O2 S -","- C21 H20 Cl N O2 S -","- C84 H80 Cl4 N4 O8 S4 -","4","2","","Ryo Shintani; Momotaro Takeda; Takaoki Tsuji; Tamio Hayashi","Rhodium-Catalyzed Asymmetric Arylation of N-Tosyl Ketimines","Journal of the American Chemical Society","2010","132","","13168","13169","10.1021/ja106114q","","","0.71075","MoKα","","","0.0501","","","","0.061","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103117","18.014","0.004","24.694","0.005","26.113","0.005","90","","90","","90","","11616","4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H37.75 N2 O7 -","- C31 H37.75 N2 O7 -","- C496 H604 N32 O112 -","16","4","","Yoshikazu Sasaki; Daisuke Kato; Dale L. Boger","Asymmetric Total Synthesis of Vindorosine, Vindoline, and Key Vinblastine Analogues","Journal of the American Chemical Society","2010","132","","13533","13544","10.1021/ja106284s","","","0.71073","MoKα","","0.152","0.0784","","","0.1919","0.2458","","","","","","0.992","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103118","8.8278","0.0018","16.708","0.003","30.252","0.006","90","","90","","90","","4462","1.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 N2 O5 -","- C24 H30 N2 O5 -","- C192 H240 N16 O40 -","8","2","","Yoshikazu Sasaki; Daisuke Kato; Dale L. Boger","Asymmetric Total Synthesis of Vindorosine, Vindoline, and Key Vinblastine Analogues","Journal of the American Chemical Society","2010","132","","13533","13544","10.1021/ja106284s","","","0.71073","MoKα","","0.0778","0.0614","","","0.1359","0.1439","","","","","","1.117","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103119","10.979","0.002","9.2119","0.0018","11.677","0.002","90","","90.66","0.03","90","","1180.9","0.4","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H30 N2 O7 -","- C24 H30 N2 O7 -","- C48 H60 N4 O14 -","2","1","","Yoshikazu Sasaki; Daisuke Kato; Dale L. Boger","Asymmetric Total Synthesis of Vindorosine, Vindoline, and Key Vinblastine Analogues","Journal of the American Chemical Society","2010","132","","13533","13544","10.1021/ja106284s","","","0.71073","MoKα","","0.0892","0.0661","","","0.1245","0.1344","","","","","","1.107","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103120","15.515","0.003","16.884","0.003","17.999","0.004","90","","90","","90","","4714.9","1.6","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 Cl N2 O5 -","- C24 H31 Cl N2 O5 -","- C192 H248 Cl8 N16 O40 -","8","2","","Yoshikazu Sasaki; Daisuke Kato; Dale L. Boger","Asymmetric Total Synthesis of Vindorosine, Vindoline, and Key Vinblastine Analogues","Journal of the American Chemical Society","2010","132","","13533","13544","10.1021/ja106284s","","","0.71073","MoKα","","0.0698","0.0595","","","0.1313","0.136","","","","","","1.156","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103121","15.716","0.003","16.897","0.003","18.545","0.004","90","","90","","90","","4924.7","1.7","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 I N2 O5 -","- C24 H31 I N2 O5 -","- C192 H248 I8 N16 O40 -","8","2","","Yoshikazu Sasaki; Daisuke Kato; Dale L. Boger","Asymmetric Total Synthesis of Vindorosine, Vindoline, and Key Vinblastine Analogues","Journal of the American Chemical Society","2010","132","","13533","13544","10.1021/ja106284s","","","0.71073","MoKα","","0.0506","0.0445","","","0.1113","0.116","","","","","","1.064","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103122","7.8185","0.0016","8.3688","0.0017","22.032","0.004","90","","95","0.03","90","","1436.1","0.5","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H36 N2 O7 -","- C30 H36 N2 O7 -","- C60 H72 N4 O14 -","2","1","","Yoshikazu Sasaki; Daisuke Kato; Dale L. Boger","Asymmetric Total Synthesis of Vindorosine, Vindoline, and Key Vinblastine Analogues","Journal of the American Chemical Society","2010","132","","13533","13544","10.1021/ja106284s","","","0.71073","MoKα","","0.0979","0.0758","","","0.1988","0.219","","","","","","0.908","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103123","13.2107","0.001","11.2408","0.0009","13.749","0.001","90","","91.133","0.002","90","","2041.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H15 B F10 N2 -","- C19 H15 B F10 N2 -","- C76 H60 B4 F40 N8 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0921","0.0425","","","0.0921","0.1135","","","","","","0.997","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103124","11.4966","0.0006","11.8061","0.0006","16.2558","0.0009","90","","101.241","0.003","90","","2164.1","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H19 B F10 N2 -","- C21 H19 B F10 N2 -","- C84 H76 B4 F40 N8 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0639","0.0388","","","0.0841","0.0944","","","","","","1.016","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103125","34.51","0.003","11.4156","0.001","12.7933","0.0011","90","","109.377","0.008","90","","4754.5","0.8","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20.5 H15.5 B Cl F10 N2 O2 -","- C20.5 H15.5 B Cl F10 N2 O2 -","- C164 H124 B8 Cl8 F80 N16 O16 -","8","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.1895","0.0686","","","0.1894","0.2653","","","","","","0.968","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103126","11.2343","0.0005","16.3811","0.0007","15.2027","0.0007","90","","97.19","0.002","90","","2775.8","0.2","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H29 B F10 N4 -","- C26 H29 B F10 N4 -","- C104 H116 B4 F40 N16 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.076","0.0396","","","0.0849","0.0989","","","","","","1.011","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103127","16.1775","0.0008","9.8189","0.0005","12.9563","0.0006","90","","95.769","0.001","90","","2047.62","0.17","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 B F10 N2 O -","- C20 H15 B F10 N2 O -","- C80 H60 B4 F40 N8 O4 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0471","0.0358","","","0.0929","0.1005","","","","","","1.026","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103128","10.3891","0.0004","11.689","0.0004","21.6116","0.0007","90","","96.453","0.001","90","","2607.85","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 B F10 N3 -","- C24 H24 B F10 N3 -","- C96 H96 B4 F40 N12 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0779","0.0453","","","0.1158","0.1359","","","","","","1.029","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103129","9.7338","0.0003","14.8731","0.0004","18.2826","0.0005","90","","93.477","0.002","90","","2641.93","0.13","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H25 B F10 N2 O -","- C28 H25 B F10 N2 O -","- C112 H100 B4 F40 N8 O4 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0649","0.0405","","","0.1043","0.1176","","","","","","1.026","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103130","8.2916","0.0012","10.6546","0.0015","12.5718","0.0018","100.759","0.007","98.769","0.007","101.432","0.007","1048.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H18 B F10 N3 -","- C21 H18 B F10 N3 -","- C42 H36 B2 F20 N6 -","2","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0701","0.0429","","","0.1141","0.1282","","","","","","1.027","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103131","8.4288","0.0003","9.3068","0.0004","17.6394","0.0008","76.475","0.002","85.958","0.002","89.111","0.002","1342","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H21 B F10 N2 -","- C27 H21 B F10 N2 -","- C54 H42 B2 F20 N4 -","2","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.1082","0.0531","","","0.1387","0.169","","","","","","1.014","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103132","14.6255","0.0012","16.4744","0.0016","20.2803","0.0018","90","","90","","90","","4886.5","0.8","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H19 B F10 N2 -","- C25 H19 B F10 N2 -","- C200 H152 B8 F80 N16 -","8","1","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0614","0.0374","","","0.0761","0.0875","","","","","","0.966","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103133","14.3554","0.0003","15.9382","0.0003","20.1115","0.0004","89.598","0.001","74.192","0.001","64.346","0.001","3958.26","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H15 B F10 N2 -","- C19 H15 B F10 N2 -","- C152 H120 B8 F80 N16 -","8","4","","Meghan A. Dureen; Douglas W. Stephan","Reactions of Boron Amidinates with CO2 and CO and Other Small Molecules","Journal of the American Chemical Society","2010","132","","13559","13568","10.1021/ja1064153","","","0.71073","MoKα","","0.0947","0.0517","","","0.1192","0.1406","","","","","","1.025","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103134","9.4012","0.0005","10.2413","0.0004","17.7652","0.0008","90","","90","","90","","1710.44","0.14","113","2","113","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H26 B N O3 -","- C19 H26 B N O3 -","- C76 H104 B4 N4 O12 -","4","1","","Toshimichi Ohmura; Tomotsugu Awano; Michinori Suginome","Stereospecific Suzuki-Miyaura Coupling of Chiral α-(Acylamino)benzylboronic Esters with Inversion of Configuration","Journal of the American Chemical Society","2010","132","","13191","13193","10.1021/ja106632j","","","0.71075","MoKα","","0.0687","0.0402","","","0.0747","0.0919","","","","","","1.1","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103135","5.6619","0.0003","10.3717","0.0006","30.2873","0.0014","90","","90","","90","","1778.58","0.16","113","2","113","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H20 Cl N O2 -","- C22 H20 Cl N O2 -","- C88 H80 Cl4 N4 O8 -","4","1","","Toshimichi Ohmura; Tomotsugu Awano; Michinori Suginome","Stereospecific Suzuki-Miyaura Coupling of Chiral α-(Acylamino)benzylboronic Esters with Inversion of Configuration","Journal of the American Chemical Society","2010","132","","13191","13193","10.1021/ja106632j","","","0.71075","MoKα","","0.0317","0.0292","","","0.0715","0.0732","","","","","","1.047","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103136","8.1081","0.0005","20.472","0.0013","19.2978","0.0013","90","","92.273","0.001","90","","3200.7","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C35 H38 Br N3 O4 -","- C35 H39.5 Br N3 O4 -","- C140 H158 Br4 N12 O16 -","4","2","","Zhiwei Zuo; Weiqing Xie; Dawei Ma","Total Synthesis and Absolute Stereochemical Assignment of (-)-Communesin F","Journal of the American Chemical Society","2010","132","","13226","13228","10.1021/ja106739g","","","0.71073","MoKα","","0.1061","0.0535","","","0.1023","0.1131","","","","","","0.742","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103137","9.9282","0.0004","9.1895","0.0003","14.1922","0.0005","90","","91.579","0.002","90","","1294.34","0.08","193","2","193","2","","","","","","","chemical synthesis","4","P 1 2/c 1","-P 2yc","13","","Bis[2-(N,N-dimethylaminomethyl)phenyl-C,N]pyridineiron(II) Benzene Solvate","","- C29 H35 Fe N3 -","- C29 H35 Fe N3 -","- C58 H70 Fe2 N6 -","2","0.5","","Wu, Jessica Y.; Stanzl, Benjamin N.; Ritter, Tobias","A Strategy for the Synthesis of Well-Defined Iron Catalysts and Application to Regioselective Diene Hydrosilylation","Journal of the American Chemical Society","2010","132","38","13214","13216","10.1021/ja106853y","","","0.71073","MoKα","","0.0529","0.032","","","0.0589","0.0656","","","","","","1.04","","","","has coordinates,has disorder","276389","2022-06-29","09:14:29","" "4103138","11.816","0.002","17.074","0.003","19.126","0.003","102.702","0.003","100.082","0.003","99.736","0.003","3618.4","1.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Bis((2,6-diisopropylphenyl)iminopyridyl) pyridine iron(II)","","","- C41 H49 Fe N5 -","- C41 H49 Fe N5 -","- C164 H196 Fe4 N20 -","4","2","","Wu, Jessica Y.; Stanzl, Benjamin N.; Ritter, Tobias","A Strategy for the Synthesis of Well-Defined Iron Catalysts and Application to Regioselective Diene Hydrosilylation","Journal of the American Chemical Society","2010","132","38","13214","13216","10.1021/ja106853y","","","0.71073","MoKα","","0.1065","0.0561","","","0.1221","0.1462","","","","","","0.975","","","","has coordinates","219217","2020-10-21","18:00:00","" "4103139","37.4619","0.0019","37.4619","0.0019","20.9301","0.0015","90","","90","","120","","25438","3","93.1","","93.1","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C390 H336 Br6 I12 N18 O6 -","- C390.36 H324.36 Br6.12 I12 N18 O6 -","- C1171.08 H973.08 Br18.36 I36 N54 O18 -","3","0.166667","","Shuichi Hiraoka; Takashi Nakamura; Motoo Shiro; Mitsuhiko Shionoya","In-Water Truly Monodisperse Aggregation of Gear-Shaped Amphiphiles Based on Hydrophobic Surface Engineering","Journal of the American Chemical Society","2010","132","","13223","13225","10.1021/ja1069135","","","1.54187","CuKα","","","0.1452","","","","0.4109","","","","","","1.421","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103140","7.6944","0.0019","8.914","0.002","9.926","0.003","96.945","0.004","102.309","0.004","91.532","0.004","659.3","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H32 N2 O2 -","- C32 H32 N2 O2 -","- C32 H32 N2 O2 -","1","0.5","","Seong-Jun Yoon; Jong Won Chung; Johannes Gierschner; Kil Suk Kim; Moon-Gun Choi; Dongho Kim; Soo Young Park","Multistimuli Two-Color Luminescence Switching via Different Slip-Stacking of Highly Fluorescent Molecular Sheets","Journal of the American Chemical Society","2010","132","","13675","13683","10.1021/ja1044665","","","0.71073","MoKα","","0.0721","0.0618","","","0.1809","0.1938","","","","","","1.052","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103141","12.863","0.01","19.259","0.015","3.596","0.003","90","","90","","90","","890.8","1.2","120","2","120","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Cl H10 O9 Yb3 -","- O7 Yb3 -","- O28 Yb12 -","4","0.25","","Helen V. Goulding; Sarah E. Hulse; William Clegg; Ross W. Harrington; Helen Y. Playford; Richard I. Walton; Andrew M. Fogg","Yb3O(OH)6Cl.2H2O: An Anion-Exchangeable Hydroxide with a Cationic Inorganic Framework Structure","Journal of the American Chemical Society","2010","132","","13618","13620","10.1021/ja104636x","","","0.6889","synchrotron","","0.0749","0.0582","","","0.1418","0.1485","","","","","","0.986","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103142","19.3079","0.0012","16.9887","0.0011","24.5185","0.0017","90","","104.227","0.005","90","","7795.8","0.9","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C33 H55 B F4 N5 O P2 Rh -","- C33 H55 B F4 N5 O P2 Rh -","- C264 H440 B8 F32 N40 O8 P16 Rh8 -","8","2","","Lisa D. Julian; John F. Hartwig","Intramolecular Hydroamination of Unbiased and Functionalized Primary Aminoalkenes Catalyzed by a Rhodium Aminophosphine Complex","Journal of the American Chemical Society","2010","132","","13813","13822","10.1021/ja1052126","","","0.71073","MoKα","","0.2036","0.0762","","","0.1877","0.2532","","","","","","0.989","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103143","17.6713","0.0007","23.1701","0.0009","28.4113","0.0011","90","","90","","90","","11632.9","0.8","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H23 F12 N3 O2 S -","- C26 H23 F12 N3 O2 S -","- C416 H368 F192 N48 O32 S16 -","16","4","","Eric G. Klauber; Chandra Kanta De; Tejas K. Shah; Daniel Seidel","Merging Nucleophilic and Hydrogen Bonding Catalysis: An Anion Binding Approach to the Kinetic Resolution of Propargylic Amines","Journal of the American Chemical Society","2010","132","","13624","13626","10.1021/ja105337h","","","0.71073","MoKα","","0.1346","0.0778","","","0.1667","0.1877","","","","","","1.024","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103144","4.9747","0.0003","9.0028","0.0006","16.3273","0.0011","90","","94.265","0.001","90","","729.21","0.08","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H14 Cl N O -","- C17 H14 Cl N O -","- C34 H28 Cl2 N2 O2 -","2","1","","Eric G. Klauber; Chandra Kanta De; Tejas K. Shah; Daniel Seidel","Merging Nucleophilic and Hydrogen Bonding Catalysis: An Anion Binding Approach to the Kinetic Resolution of Propargylic Amines","Journal of the American Chemical Society","2010","132","","13624","13626","10.1021/ja105337h","","","0.71073","MoKα","","0.044","0.0407","","","0.0909","0.0927","","","","","","1.007","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103145","13.7797","0.0006","9.5135","0.0005","16.2298","0.0006","90","","117.249","0.003","90","","1891.5","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 N3 Ni -","- C21 H23 N3 Ni -","- C84 H92 N12 Ni4 -","4","1","","Anna Magdalena Oertel; Vincent Ritleng; Michael J. Chetcuti; Luis F. Veiros","C-H Activation of Acetonitrile at Nickel: Ligand Flip and Conversion of N-Bound Acetonitrile into a C-Bound Cyanomethyl Ligand","Journal of the American Chemical Society","2010","132","","13588","13589","10.1021/ja105368p","","","0.71073","MoKα","","0.0446","0.034","","","0.0973","0.1093","","","","","","1.176","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103146","14.0902","0.0004","11.4279","0.0005","16.0073","0.0006","90","","110.029","0.002","90","","2421.63","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H31 N3 Ni -","- C28 H31 N3 Ni -","- C112 H124 N12 Ni4 -","4","1","","Anna Magdalena Oertel; Vincent Ritleng; Michael J. Chetcuti; Luis F. Veiros","C-H Activation of Acetonitrile at Nickel: Ligand Flip and Conversion of N-Bound Acetonitrile into a C-Bound Cyanomethyl Ligand","Journal of the American Chemical Society","2010","132","","13588","13589","10.1021/ja105368p","","","0.71073","MoKα","","0.068","0.0417","","","0.0834","0.094","","","","","","1.014","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103147","13.8731","0.0011","20.8602","0.0017","21.8492","0.0018","90","","90","","90","","6323.1","0.9","100","","100","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C81 H66 Br Fe N2 O6 -","- C81 H62 Br Fe N2 O6 -","- C324 H248 Br4 Fe4 N8 O24 -","4","1","","Hiromichi Egami; Kenji Matsumoto; Takuya Oguma; Takashi Kunisu; Tsutomu Katsuki","Enantioenriched Synthesis of C1-Symmetric BINOLs: Iron-Catalyzed Cross-Coupling of 2-Naphthols and Some Mechanistic Insight","Journal of the American Chemical Society","2010","132","","13633","13635","10.1021/ja105442m","","","0.71073","MoKα","","0.0607","0.0427","","","0.0947","0.1022","","","","","","0.998","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103148","15.1812","0.0018","15.1812","0.0018","52.476","0.006","90","","90","","90","","12094","2","100","","100","","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C152 H142 Fe2 N4 O10 -","- C152 H100 Fe2 N4 O10 -","- C608 H400 Fe8 N16 O40 -","4","0.5","","Hiromichi Egami; Kenji Matsumoto; Takuya Oguma; Takashi Kunisu; Tsutomu Katsuki","Enantioenriched Synthesis of C1-Symmetric BINOLs: Iron-Catalyzed Cross-Coupling of 2-Naphthols and Some Mechanistic Insight","Journal of the American Chemical Society","2010","132","","13633","13635","10.1021/ja105442m","","","0.71073","MoKα","","0.0817","0.0688","","","0.1985","0.2076","","","","","","1.106","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103149","10.4897","0.0004","12.1851","0.0004","19.8709","0.0011","100.796","0.002","99.262","0.002","93.058","0.001","2453.23","0.19","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H46 Au2 N2 O7 P4 -","- C52 H46 Au2 N2 O7 P4 -","- C104 H92 Au4 N4 O14 P8 -","2","1","","Andrea Deák; Tünde Tunyogi; Zoltán Károly; Szilvia Klébert; Gábor Pálinkás","Guest Escape and Uptake in Nonporous Crystals of a Gold(I) Macrocycle","Journal of the American Chemical Society","2010","132","","13627","13629","10.1021/ja105458e","","","0.7107","MoKα","","0.084","0.0627","","","0.1798","0.2188","","","","","","1.081","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103150","10.2469","0.0016","12.2663","0.0019","19.899","0.003","100.672","0.007","99.456","0.007","91.69","0.007","2419.8","0.7","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C52.81 H47.23 Au2 N2 O6.81 P4 -","- C52.808 H47.232 Au2 N2 O6.808 P4 -","- C105.616 H94.464 Au4 N4 O13.616 P8 -","2","1","","Andrea Deák; Tünde Tunyogi; Zoltán Károly; Szilvia Klébert; Gábor Pálinkás","Guest Escape and Uptake in Nonporous Crystals of a Gold(I) Macrocycle","Journal of the American Chemical Society","2010","132","","13627","13629","10.1021/ja105458e","","","0.7107","MoKα","","0.0493","0.0439","","","0.098","0.1","","","","","","1.112","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103151","10.3075","0.0014","12.0786","0.0016","19.744","0.003","102.098","0.003","98.414","0.003","93.488","0.004","2367","0.6","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H44 Au2 N2 O6 P4 -","- C52 H44 Au2 N2 O6 P4 -","- C104 H88 Au4 N4 O12 P8 -","2","1","","Andrea Deák; Tünde Tunyogi; Zoltán Károly; Szilvia Klébert; Gábor Pálinkás","Guest Escape and Uptake in Nonporous Crystals of a Gold(I) Macrocycle","Journal of the American Chemical Society","2010","132","","13627","13629","10.1021/ja105458e","","","0.56089","AgKα","","0.042","0.0322","","","0.0672","0.0704","","","","","","1.052","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103152","10.1132","0.0018","12.053","0.002","19.88","0.004","98.638","0.008","101.042","0.007","90.974","0.008","2348.8","0.7","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H44 Au2 N2 O6 P4 -","- C52 H44 Au2 N2 O6 P4 -","- C104 H88 Au4 N4 O12 P8 -","2","1","","Andrea Deák; Tünde Tunyogi; Zoltán Károly; Szilvia Klébert; Gábor Pálinkás","Guest Escape and Uptake in Nonporous Crystals of a Gold(I) Macrocycle","Journal of the American Chemical Society","2010","132","","13627","13629","10.1021/ja105458e","","","0.7107","MoKα","","0.0568","0.0469","","","0.0806","0.0843","","","","","","1.063","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103153","7.2955","0.0002","11.2522","0.0003","9.2269","0.0002","90","","103.73","0.001","90","","735.8","0.03","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","potassium dodecafluoro-closo-dodecaborate(2-) dihydrate","","","- B12 F12 H4 K2 O2 -","- B12 F12 H4 K2 O2 -","- B24 F24 H8 K4 O4 -","2","0.5","","Dmitry V. Peryshkov; Alexey A. Popov; Steven H. Strauss","Latent Porosity in Potassium Dodecafluoro-closo-dodecaborate(2-). Structures and Rapid Room Temperature Interconversions of Crystalline K2B12F12, K2(H2O)2B12F12, and K2(H2O)4B12F12 in the Presence of Water Vapor","Journal of the American Chemical Society","2010","132","","13902","13913","10.1021/ja105522d","","","0.71073","MoKα","","0.0211","0.0198","","","0.0572","0.058","","","","","","1.109","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103154","8.3988","0.0003","8.5982","0.0004","12.7454","0.0005","98.83","0.002","102.056","0.002","104.958","0.002","848.39","0.06","110","2","110","2","","","","","","","","5","P -1","-P 1","2","potassium dodecafluoro-closo-dodecaborate(2-) tetrahydrate","","","- B12 F12 H8 K2 O4 -","- B12 F12 H8 K2 O4 -","- B24 F24 H16 K4 O8 -","2","1","","Dmitry V. Peryshkov; Alexey A. Popov; Steven H. Strauss","Latent Porosity in Potassium Dodecafluoro-closo-dodecaborate(2-). Structures and Rapid Room Temperature Interconversions of Crystalline K2B12F12, K2(H2O)2B12F12, and K2(H2O)4B12F12 in the Presence of Water Vapor","Journal of the American Chemical Society","2010","132","","13902","13913","10.1021/ja105522d","","","0.71073","MoKα","","0.0221","0.0204","","","0.057","0.0582","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103155","4.6663","0.0004","8.7995","0.0007","9.4153","0.0008","90","","90.325","0.005","90","","386.6","0.06","243","2","243","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","F Xe O N O2","","","- F N O3 Xe -","- F N O3 Xe -","- F4 N4 O12 Xe4 -","4","1","","Matthew D. Moran; David S. Brock; Hélène P. A. Mercier; Gary J. Schrobilgen","Xe3OF3+, a Precursor to a Noble-Gas Nitrate; Syntheses and Structural Characterizations of FXeONO2, XeF2.HNO3, and XeF2.N2O4","Journal of the American Chemical Society","2010","132","","13823","13839","10.1021/ja105618w","","","0.71073","MoKα","","0.0559","0.0417","","","0.0771","0.0807","","","","","","1.755","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103156","17.3543","0.0007","5.6539","0.0002","4.7658","0.0002","90","","90","","90","","467.62","0.03","113","2","113","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- F2 H N O3 Xe -","- F2 H N O3 Xe -","- F8 H4 N4 O12 Xe4 -","4","0.5","","Matthew D. Moran; David S. Brock; Hélène P. A. Mercier; Gary J. Schrobilgen","Xe3OF3+, a Precursor to a Noble-Gas Nitrate; Syntheses and Structural Characterizations of FXeONO2, XeF2.HNO3, and XeF2.N2O4","Journal of the American Chemical Society","2010","132","","13823","13839","10.1021/ja105618w","","","0.71073","MoKα","","0.016","0.014","","","0.0311","0.0317","","","","","","1.302","","","","has coordinates","211196","2020-10-21","18:00:00","" "4103157","4.5822","0.0003","5.0597","0.0003","6.2761","0.0005","79.17","0.007","88.454","0.005","81.083","0.005","141.189","0.017","243","2","243","2","","","","","","","","4","P -1","-P 1","2","Xe F2 N2 O4","","","- F2 N2 O4 Xe -","- F2 N2 O4 Xe -","- F2 N2 O4 Xe -","1","0.5","","Matthew D. Moran; David S. Brock; Hélène P. A. Mercier; Gary J. Schrobilgen","Xe3OF3+, a Precursor to a Noble-Gas Nitrate; Syntheses and Structural Characterizations of FXeONO2, XeF2.HNO3, and XeF2.N2O4","Journal of the American Chemical Society","2010","132","","13823","13839","10.1021/ja105618w","","","0.71073","MoKα","","0.0419","0.0385","","","0.0725","0.0742","","","","","","1.066","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103158","10.4241","0.0005","10.8197","0.0004","14.1094","0.0006","90","","101.722","0.002","90","","1558.15","0.12","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H37 Br O6 -","- C36 H37 Br O6 -","- C72 H74 Br2 O12 -","2","1","","Ji Qi; Aaron B. Beeler; Qiang Zhang; John A. Porco, Jr.","Catalytic Enantioselective Alkylative Dearomatization-Annulation: Total Synthesis and Absolute Configuration Assignment of Hyperibone K","Journal of the American Chemical Society","2010","132","","13642","13644","10.1021/ja1057828","","","0.71073","MoKα","","0.0563","0.0376","","","0.0728","0.0798","","","","","","0.938","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103159","10.858","0.002","13.071","0.003","13.421","0.003","98.01","0.03","114.7","0.03","95.4","0.03","1688.9","0.8","393","2","393","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H33 Cu F12 N4 O6 -","- C27.5 H33 Cu F12 N4 O6 -","- C55 H66 Cu2 F24 N8 O12 -","2","1","","Matvey V. Fedin; Sergey L. Veber; Ksenia Yu. Maryunina; Galina V. Romanenko; Elizaveta A. Suturina; Nina P. Gritsan; Renad Z. Sagdeev; Victor I. Ovcharenko; Elena G. Bagryanskaya","Intercluster Exchange Pathways in Polymer-Chain Molecular Magnets Cu(hfac)2LR Unveiled by Electron Paramagnetic Resonance","Journal of the American Chemical Society","2010","132","","13886","13891","10.1021/ja105862w","","","0.71073","MoKα","","0.0437","0.0414","","","0.1123","0.1144","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103160","10.8114","0.0017","13.26","0.002","13.415","0.002","99.515","0.002","95.225","0.002","114.016","0.002","1705.5","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cu F12 N4 O6 -","- C28 H34 Cu F12 N4 O6 -","- C56 H68 Cu2 F24 N8 O12 -","2","1","","Matvey V. Fedin; Sergey L. Veber; Ksenia Yu. Maryunina; Galina V. Romanenko; Elizaveta A. Suturina; Nina P. Gritsan; Renad Z. Sagdeev; Victor I. Ovcharenko; Elena G. Bagryanskaya","Intercluster Exchange Pathways in Polymer-Chain Molecular Magnets Cu(hfac)2LR Unveiled by Electron Paramagnetic Resonance","Journal of the American Chemical Society","2010","132","","13886","13891","10.1021/ja105862w","","","0.71073","MoKα","","0.0412","0.0378","","","0.0987","0.1014","","","","","","1.034","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103161","10.0757","0.0018","13.044","0.002","13.736","0.003","99.469","0.003","103.364","0.002","105.094","0.002","1646.6","0.5","60","2","60","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H30 Cu F12 N4 O6 -","- C28 H30 Cu F12 N4 O6 -","- C56 H60 Cu2 F24 N8 O12 -","2","1","","Matvey V. Fedin; Sergey L. Veber; Ksenia Yu. Maryunina; Galina V. Romanenko; Elizaveta A. Suturina; Nina P. Gritsan; Renad Z. Sagdeev; Victor I. Ovcharenko; Elena G. Bagryanskaya","Intercluster Exchange Pathways in Polymer-Chain Molecular Magnets Cu(hfac)2LR Unveiled by Electron Paramagnetic Resonance","Journal of the American Chemical Society","2010","132","","13886","13891","10.1021/ja105862w","","","0.71073","MoKα","","0.0508","0.0422","","","0.102","0.1061","","","","","","1.057","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103162","29.726","0.003","9.5736","0.0011","24.757","0.003","90","","125.289","0.001","90","","5750.9","1.1","50","2","50","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","1","","Matvey V. Fedin; Sergey L. Veber; Ksenia Yu. Maryunina; Galina V. Romanenko; Elizaveta A. Suturina; Nina P. Gritsan; Renad Z. Sagdeev; Victor I. Ovcharenko; Elena G. Bagryanskaya","Intercluster Exchange Pathways in Polymer-Chain Molecular Magnets Cu(hfac)2LR Unveiled by Electron Paramagnetic Resonance","Journal of the American Chemical Society","2010","132","","13886","13891","10.1021/ja105862w","","","0.71073","MoKα","","0.0485","0.0407","","","0.0982","0.1012","","","","","","1.241","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103163","7.52136","0.00006","14.49051","0.00013","39.6415","0.0003","90","","90","","90","","4320.46","0.06","100","","100","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C28 H26 O4 -","- C28 H26 O4 -","- C224 H208 O32 -","8","1","","Jian He; Jason L. Crase; Shriya H. Wadumethrige; Khushabu Thakur; Lin Dai; Shouzhong Zou; Rajendra Rathore; C. Scott Hartley","ortho-Phenylenes: Unusual Conjugated Oligomers with a Surprisingly Long Effective Conjugation Length","Journal of the American Chemical Society","2010","132","","13848","13857","10.1021/ja106050s","","","1.5418","CuKα","","0.0362","0.0341","","","0.0869","0.0886","","","","","","1.025","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103164","9.3709","0.0002","12.4562","0.0002","15.7073","0.0003","77.5803","0.0017","82.0708","0.0017","81.3866","0.0017","1759.7","0.06","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H41 N O6 -","- C44 H41 N O6 -","- C88 H82 N2 O12 -","2","1","","Jian He; Jason L. Crase; Shriya H. Wadumethrige; Khushabu Thakur; Lin Dai; Shouzhong Zou; Rajendra Rathore; C. Scott Hartley","ortho-Phenylenes: Unusual Conjugated Oligomers with a Surprisingly Long Effective Conjugation Length","Journal of the American Chemical Society","2010","132","","13848","13857","10.1021/ja106050s","","","1.5418","CuKα","","0.0377","0.0338","","","0.0874","0.0898","","","","","","1.053","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103165","6.5667","0.0006","15.2297","0.0014","18.5936","0.0018","90","","90","","90","","1859.5","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 O P S -","- C19 H25 O P S -","- C76 H100 O4 P4 S4 -","4","1","","Jonathan J. Gammon; Viktoria H. Gessner; Greg R. Barker; Johan Granander; Adrian C. Whitwood; Carsten Strohmann; Peter O'Brien; Brian Kelly","Synthesis of P-Stereogenic Compounds via Kinetic Deprotonation and Dynamic Thermodynamic Resolution of Phosphine Sulfides: Opposite Sense of Induction Using (-)-Sparteine","Journal of the American Chemical Society","2010","132","","13922","13927","10.1021/ja1060966","","","0.71073","MoKα","","0.0374","0.035","","","0.0918","0.094","","","","","","1.066","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103166","11.5593","0.0008","11.6886","0.0008","33.86","0.002","90","","90","","90","","4574.9","0.5","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H40 Li N2 P S -","- C21 H40 Li N2 P S -","- C168 H320 Li8 N16 P8 S8 -","8","2","","Jonathan J. Gammon; Viktoria H. Gessner; Greg R. Barker; Johan Granander; Adrian C. Whitwood; Carsten Strohmann; Peter O'Brien; Brian Kelly","Synthesis of P-Stereogenic Compounds via Kinetic Deprotonation and Dynamic Thermodynamic Resolution of Phosphine Sulfides: Opposite Sense of Induction Using (-)-Sparteine","Journal of the American Chemical Society","2010","132","","13922","13927","10.1021/ja1060966","","","0.71073","MoKα","","0.0533","0.0469","","","0.1118","0.1187","","","","","","1.065","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103167","6.2989","0.0003","10.875","0.0005","20.2407","0.001","90","","93.892","0.001","90","","1383.3","0.11","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(RP,RC)-1-(t-Butylmethylphosphinothioyl)-3,3-dimethylbutan-2-ol","","- C11 H25 O P S -","- C11 H25 O P S -","- C44 H100 O4 P4 S4 -","4","2","","Jonathan J. Gammon; Viktoria H. Gessner; Greg R. Barker; Johan Granander; Adrian C. Whitwood; Carsten Strohmann; Peter O'Brien; Brian Kelly","Synthesis of P-Stereogenic Compounds via Kinetic Deprotonation and Dynamic Thermodynamic Resolution of Phosphine Sulfides: Opposite Sense of Induction Using (-)-Sparteine","Journal of the American Chemical Society","2010","132","","13922","13927","10.1021/ja1060966","","x-ray","0.71073","MoKα","","0.0292","0.0276","","","0.0663","0.067","","","","","","1.03","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103168","10.5593","0.0002","18.815","0.0004","22.6797","0.0005","90","","90","","90","","4505.85","0.16","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C39 H65 Cl3 N4 O7 -","- C39 H65 Cl3 N4 O7 -","- C156 H260 Cl12 N16 O28 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of 12-Helical Secondary Structure in β-Peptides Containing Side Chain Groups","Journal of the American Chemical Society","2010","132","","13879","13885","10.1021/ja1062532","","","0.71073","Mo-Kα","","0.042","0.0348","","","0.0869","0.0944","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103169","9.491","0.003","9.624","0.003","11.899","0.004","94.225","0.005","93.287","0.005","112.31","0.005","998.5","0.6","105","2","105","2","","","","","","","","4","P 1","P 1","1","","","","- C40 H60 N4 O7 -","- C40 H60 N4 O7 -","- C40 H60 N4 O7 -","1","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of 12-Helical Secondary Structure in β-Peptides Containing Side Chain Groups","Journal of the American Chemical Society","2010","132","","13879","13885","10.1021/ja1062532","","","0.71073","Mo-Kα","","0.065","0.0513","","","0.1215","0.1294","","","","","","1.021","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103170","10.446","0.002","19.955","0.004","12.161","0.002","90","","95.02","0.003","90","","2525.2","0.8","105","2","105","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C50 H79 N5 O9 -","- C50 H79 N5 O9 -","- C100 H158 N10 O18 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of 12-Helical Secondary Structure in β-Peptides Containing Side Chain Groups","Journal of the American Chemical Society","2010","132","","13879","13885","10.1021/ja1062532","","","0.71073","Mo-Kα","","0.0841","0.0623","","","0.1509","0.1627","","","","","","1.028","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103171","10.6925","0.0013","25.843","0.003","30.397","0.004","90","","90","","90","","8399.5","1.8","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C68 H104 N8 O11 -","- C68 H104 N8 O11 -","- C272 H416 N32 O44 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of 12-Helical Secondary Structure in β-Peptides Containing Side Chain Groups","Journal of the American Chemical Society","2010","132","","13879","13885","10.1021/ja1062532","","","0.71073","Mo-Kα","","0.1079","0.0993","","","0.2633","0.2706","","","","","","1.065","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103172","9.4582","0.0001","15.6589","0.0003","23.444","0.0004","105.277","0.001","97.885","0.001","94.084","0.001","3296.8","0.09","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C62 H94 Br N7 O12 -","- C62 H94 Br N7 O12 -","- C124 H188 Br2 N14 O24 -","2","2","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of 12-Helical Secondary Structure in β-Peptides Containing Side Chain Groups","Journal of the American Chemical Society","2010","132","","13879","13885","10.1021/ja1062532","","","1.54178","CuKα","","0.0704","0.0689","","","0.1916","0.194","","","","","","0.987","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103173","11.3031","0.0014","21.144","0.003","25.31","0.003","90","","90","","90","","6048.9","1.3","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C64.5 H99 K N4 Ni2 -","- C64.5 H99 K N4 Ni2 -","- C258 H396 K4 N16 Ni8 -","4","1","","Stefan Pfirrmann; Christian Limberg; Christian Herwig; Christina Knispel; Beatrice Braun; Eckhard Bill; Reinhard Stösser","A Reduced β-Diketiminato-Ligated Ni3H4 Unit Catalyzing H/D Exchange","Journal of the American Chemical Society","2010","132","","13684","13691","10.1021/ja106266v","","","0.71073","MoKα","","0.0859","0.0535","","","0.1206","0.1377","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103174","15.9902","0.0008","19.8449","0.0006","12.4857","0.0006","90","","124.252","0.003","90","","3274.9","0.3","100","2","100","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C64 H100 K2 N4 Ni3 -","- C64 H100 K2 N4 Ni3 -","- C128 H200 K4 N8 Ni6 -","2","0.25","","Stefan Pfirrmann; Christian Limberg; Christian Herwig; Christina Knispel; Beatrice Braun; Eckhard Bill; Reinhard Stösser","A Reduced β-Diketiminato-Ligated Ni3H4 Unit Catalyzing H/D Exchange","Journal of the American Chemical Society","2010","132","","13684","13691","10.1021/ja106266v","","","0.71073","MoKα","","0.0557","0.0361","","","0.0706","0.0754","","","","","","0.993","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103175","14.0286","0.0008","21.2222","0.0011","20.5735","0.0012","90","","93.221","0.005","90","","6115.4","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H96 K N4 Ni3 O -","- C62 H96 K N4 Ni3 O -","- C248 H384 K4 N16 Ni12 O4 -","4","1","","Stefan Pfirrmann; Christian Limberg; Christian Herwig; Christina Knispel; Beatrice Braun; Eckhard Bill; Reinhard Stösser","A Reduced β-Diketiminato-Ligated Ni3H4 Unit Catalyzing H/D Exchange","Journal of the American Chemical Society","2010","132","","13684","13691","10.1021/ja106266v","","","0.71073","MoKα","","0.0364","0.0288","","","0.0647","0.0674","","","","","","1.033","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103176","14.1224","0.0014","21.321","0.002","25.094","0.002","90","","123.442","0.004","90","","6305","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H96 K2 N4 Ni2 O2 -","- C66 H96 K2 N4 Ni2 O2 -","- C264 H384 K8 N16 Ni8 O8 -","4","1","","Stefan Pfirrmann; Christian Limberg; Christian Herwig; Christina Knispel; Beatrice Braun; Eckhard Bill; Reinhard Stösser","A Reduced β-Diketiminato-Ligated Ni3H4 Unit Catalyzing H/D Exchange","Journal of the American Chemical Society","2010","132","","13684","13691","10.1021/ja106266v","","","0.71073","MoKα","","0.1012","0.0597","","","0.102","0.1167","","","","","","1.056","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103177","23.7702","0.0005","12.1352","0.0006","23.323","0.0011","90","","116.306","0.002","90","","6030.9","0.4","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34.5 H16 B F15 -","- C34.5 H16 B F15 -","- C276 H128 B8 F120 -","8","1","","Chao Chen; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Carbon-Carbon Bond Activation by 1,1-Carboboration of Internal Alkynes","Journal of the American Chemical Society","2010","132","","13594","13595","10.1021/ja106365j","","","1.54178","CuKα","","0.0533","0.0442","","","0.1128","0.1204","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103178","12.2855","0.0005","12.4303","0.0006","18.0373","0.0008","70.022","0.004","70.262","0.004","69.078","0.002","2343.94","0.19","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H37 B F15 P -","- C53 H37 B F15 P -","- C106 H74 B2 F30 P2 -","2","1","","Chao Chen; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Carbon-Carbon Bond Activation by 1,1-Carboboration of Internal Alkynes","Journal of the American Chemical Society","2010","132","","13594","13595","10.1021/ja106365j","","","1.54178","CuKα","","0.0878","0.0583","","","0.1392","0.1598","","","","","","1.046","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103179","31.2753","0.001","5.7604","0.0002","20.1748","0.0011","90","","103.369","0.004","90","","3536.2","0.3","223","2","223","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C23 H22 -","- C23 H22 -","- C184 H176 -","8","1","","Chao Chen; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Carbon-Carbon Bond Activation by 1,1-Carboboration of Internal Alkynes","Journal of the American Chemical Society","2010","132","","13594","13595","10.1021/ja106365j","","","1.54178","CuKα","","0.0548","0.0465","","","0.1208","0.1279","","","","","","1.026","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103180","15.6115","0.0007","15.652","0.0006","23.8733","0.0011","86.806","0.001","78.394","0.001","69.151","0.001","5339.2","0.4","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H142 O43 Ti14 -","- C66 H142 O43 Ti14 -","- C132 H284 O86 Ti28 -","2","1","","Jason B. Benedict; Renata Freindorf; Elzbieta Trzop; Jeffrey Cogswell; Philip Coppens","Large Polyoxotitanate Clusters: Well-Defined Models for Pure-Phase TiO2Structures and Surfaces","Journal of the American Chemical Society","2010","132","","13669","13671","10.1021/ja106436y","","","0.71073","MoKα","","0.1389","0.0717","","","0.183","0.2326","","","","","","1.004","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103181","12.6425","0.0007","18.9568","0.001","29.532","0.0017","76.349","0.002","82.7","0.002","87.053","0.002","6820.3","0.7","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C84 H178 O61 Ti18 -","- C84 H178 O61 Ti18 -","- C168 H356 O122 Ti36 -","2","1","","Jason B. Benedict; Renata Freindorf; Elzbieta Trzop; Jeffrey Cogswell; Philip Coppens","Large Polyoxotitanate Clusters: Well-Defined Models for Pure-Phase TiO2Structures and Surfaces","Journal of the American Chemical Society","2010","132","","13669","13671","10.1021/ja106436y","","","0.71073","MoKα","","0.0689","0.0398","","","0.0963","0.1127","","","","","","1.028","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103182","29.7286","0.0008","29.7286","0.0008","126.826","0.003","90","","90","","120","","97071","4","90","2","90","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C111 H224 O84 Ti28 -","- C111 H224 O84 Ti28 -","- C1998 H4032 O1512 Ti504 -","18","0.5","","Jason B. Benedict; Renata Freindorf; Elzbieta Trzop; Jeffrey Cogswell; Philip Coppens","Large Polyoxotitanate Clusters: Well-Defined Models for Pure-Phase TiO2Structures and Surfaces","Journal of the American Chemical Society","2010","132","","13669","13671","10.1021/ja106436y","","","0.71073","MoKα","","0.0684","0.0538","","","0.1757","0.1989","","","","","","1.14","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103183","10.28","0.002","10.274","0.002","10.758","0.002","90","","96.23","0.03","90","","1129.5","0.4","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H27 N O6 -","- C25 H27 N O6 -","- C50 H54 N2 O12 -","2","1","","Lian-Zhu Liu; Jin-Chun Han; Guo-Zong Yue; Chuang-Chuang Li; Zhen Yang","Asymmetric Total Synthesis of Caribenol A","Journal of the American Chemical Society","2010","132","","13608","13609","10.1021/ja106585n","","","0.71073","MoKα","","0.0618","0.0537","","","0.1426","0.1486","","","","","","1.08","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103184","13.408","0.003","8.3858","0.0017","15.601","0.003","90","","107.93","0.03","90","","1668.9","0.7","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C76 H84 N4 O12 -","4","1","","James P. Lajiness; Dale L. Boger","Synthesis and Characterization of a Cyclobutane Duocarmycin Derivative Incorporating the 1,2,10,11-Tetrahydro-9H-cyclobuta[c]benzo[e]indol-4-one (CbBI) Alkylation Subunit","Journal of the American Chemical Society","2010","132","","13936","13940","10.1021/ja106986f","","","0.71073","MoKα","","0.1011","0.0708","","","0.1746","0.1918","","","","","","1.086","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103185","24.6055","0.0017","33.271","0.002","33.271","0.002","90","","90","","90","","27237","3","253","2","253","2","","","","","","","","4","I m m m","-I 2 2","71","UMCM-151","","","- C42 H22 Cu3 O15 -","- C42 H22 Cu3 O15 -","- C336 H176 Cu24 O120 -","8","0.5","","Jennifer K. Schnobrich; Olivier Lebel; Katie A. Cychosz; Anne Dailly; Antek G. Wong-Foy; Adam J. Matzger","Linker-Directed Vertex Desymmetrization for the Production of Coordination Polymers with High Porosity","Journal of the American Chemical Society","2010","132","","13941","13948","10.1021/ja107423k","","","1.54178","CuKα","","0.1744","0.1327","","","0.3493","0.3785","","","","","","1.14","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103186","26.3043","0.0011","26.3043","0.0011","26.5885","0.0019","90","","90","","120","","15932.3","1.5","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","UMCM-152","","","- C14 H7 Cu O5 -","- C14 H7 Cu O5 -","- C252 H126 Cu18 O90 -","18","1","","Jennifer K. Schnobrich; Olivier Lebel; Katie A. Cychosz; Anne Dailly; Antek G. Wong-Foy; Adam J. Matzger","Linker-Directed Vertex Desymmetrization for the Production of Coordination Polymers with High Porosity","Journal of the American Chemical Society","2010","132","","13941","13948","10.1021/ja107423k","","","1.54187","CuKα","","0.0681","0.0555","","","0.1404","0.1555","","","","","","1.053","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103187","21.7064","0.0007","29.0072","0.0011","43.7","0.003","90","","90","","90","","27515","2","150","2","150","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","UMCM-153","","","- C14 H7 Cu O5 -","- C14 H7 Cu O5 -","- C448 H224 Cu32 O160 -","32","1","","Jennifer K. Schnobrich; Olivier Lebel; Katie A. Cychosz; Anne Dailly; Antek G. Wong-Foy; Adam J. Matzger","Linker-Directed Vertex Desymmetrization for the Production of Coordination Polymers with High Porosity","Journal of the American Chemical Society","2010","132","","13941","13948","10.1021/ja107423k","","","1.54187","CuKα","","0.1064","0.0768","","","0.1949","0.2088","","","","","","0.988","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103188","11.8586","0.0002","30.771","0.0006","17.4516","0.0012","90","","90.983","0.006","90","","6367.2","0.5","95","2","95","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","UMCM-154","","","- C29 H13 O10 Zn2 -","- C29 H13 O10 Zn2 -","- C116 H52 O40 Zn8 -","4","0.5","","Jennifer K. Schnobrich; Olivier Lebel; Katie A. Cychosz; Anne Dailly; Antek G. Wong-Foy; Adam J. Matzger","Linker-Directed Vertex Desymmetrization for the Production of Coordination Polymers with High Porosity","Journal of the American Chemical Society","2010","132","","13941","13948","10.1021/ja107423k","","","1.54187","CuKα","","0.085","0.0724","","","0.2508","0.2802","","","","","","1.169","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103189","19.127","0.013","20.19","0.013","19.788","0.014","90","","93.402","0.023","90","","7628","9","123","2","123","2","","","","","","","","8","P 1 21 1","P 2yb","4","09124","","","- C82 H52 B Cu F24 N2 O P2 -","- C82 H52 B Cu F24 N2 O P2 -","- C328 H208 B4 Cu4 F96 N8 O4 P8 -","4","2","","Conor S. Smith; Charles W. Branham; Brian J. Marquardt; Kent R. Mann","Oxygen Gas Sensing by Luminescence Quenching in Crystals of Cu(xantphos)(phen)+ Complexes","Journal of the American Chemical Society","2010","132","","14079","14085","10.1021/ja103112m","","","0.71073","MoKα","","0.0949","0.0532","","","0.1183","0.1424","","","","","","1.006","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103190","11.086","0.0012","17.201","0.0018","19.803","0.002","76.694","0.002","73.782","0.002","88.21","0.002","3526.4","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C81 H52 B Cu F20 N2 O P2 -","- C81 H52 B Cu F20 N2 O P2 -","- C162 H104 B2 Cu2 F40 N4 O2 P4 -","2","1","","Conor S. Smith; Charles W. Branham; Brian J. Marquardt; Kent R. Mann","Oxygen Gas Sensing by Luminescence Quenching in Crystals of Cu(xantphos)(phen)+ Complexes","Journal of the American Chemical Society","2010","132","","14079","14085","10.1021/ja103112m","","","0.71069","MoKα","","0.0903","0.0455","","","0.1051","0.1279","","","","","","1.063","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103191","15.289","0.002","16.539","0.002","17.019","0.002","102.685","0.002","108.556","0.002","97.253","0.002","3889.7","0.8","123","2","123","2","","","","","","","","8","P -1","-P 1","2","08104","","","- C85 H56 B Cu F24 N2 O P2 -","- C85 H56 B Cu F24 N2 O P2 -","- C170 H112 B2 Cu2 F48 N4 O2 P4 -","2","1","","Conor S. Smith; Charles W. Branham; Brian J. Marquardt; Kent R. Mann","Oxygen Gas Sensing by Luminescence Quenching in Crystals of Cu(xantphos)(phen)+ Complexes","Journal of the American Chemical Society","2010","132","","14079","14085","10.1021/ja103112m","","","0.71073","MoKα","","0.0578","0.038","","","0.092","0.1052","","","","","","1.015","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103192","20.755","0.003","21.087","0.003","39.817","0.006","102.684","0.002","90.297","0.003","106.636","0.002","16246","4","123","2","123","2","","","","","","","","8","P -1","-P 1","2","","","","- C89 H64 B Cu F24 N2 O P2 -","- C89 H64 B Cu F24 N2 O P2 -","- C712 H512 B8 Cu8 F192 N16 O8 P16 -","8","4","","Conor S. Smith; Charles W. Branham; Brian J. Marquardt; Kent R. Mann","Oxygen Gas Sensing by Luminescence Quenching in Crystals of Cu(xantphos)(phen)+ Complexes","Journal of the American Chemical Society","2010","132","","14079","14085","10.1021/ja103112m","","","0.71073","MoKα","","0.1882","0.0925","","","0.2414","0.3005","","","","","","1.057","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103193","16.7605","0.0005","17.7508","0.0005","14.1762","0.0004","90","","117.053","0.002","90","","3756.1","0.2","193","2","193","2","","","","","","","chemical synthesis","7","C 1 2/c 1","-C 2yc","15","tr040","(Acetato){10-benzo[h]quinolinato)chloropalladium(III) Dimer . Iodobenzene . Dichloromethane Solvate","","- C37 H29 Cl4 I N2 O4 Pd2 -","- C36 H27 Cl2 I N2 O4 Pd2 -","- C144 H108 Cl8 I4 N8 O16 Pd8 -","4","0.5","","David C. Powers; Diego Benitez; Ekaterina Tkatchouk; William A. Goddard; Tobias Ritter","Bimetallic Reductive Elimination from Dinuclear Pd(III) Complexes","Journal of the American Chemical Society","2010","132","","14092","14103","10.1021/ja1036644","","","0.71073","MoKα","","0.0491","0.0336","","","0.0761","0.0804","","","","","","1.075","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103194","10.0632","0.0002","11.2475","0.0002","13.923","0.0002","96.989","0.001","95.423","0.001","108.992","0.001","1463.85","0.05","193","2","193","2","","","","","","","chemical synthesis","6","P -1","-P 1","2","DCP2","Tris(μ~2~-acetato)-bis(benzo[h]quinolato)-(μ~2~-chloro)-tripalladium(II)","","- C32 H25 Cl N2 O6 Pd3 -","- C32 H25 Cl N2 O6 Pd3 -","- C64 H50 Cl2 N4 O12 Pd6 -","2","1","","David C. Powers; Diego Benitez; Ekaterina Tkatchouk; William A. Goddard; Tobias Ritter","Bimetallic Reductive Elimination from Dinuclear Pd(III) Complexes","Journal of the American Chemical Society","2010","132","","14092","14103","10.1021/ja1036644","","","0.71073","MoKα","","0.0479","0.0369","","","0.0792","0.0834","","","","","","1.091","","","","has coordinates","194623","2020-10-21","18:00:00","" "4103195","16.039","0.002","16.038","0.002","9.9156","0.0013","90","","90","","90","","2550.6","0.6","193","2","193","2","","","","","","","chemical synthesis","5","P m m n :2","-P 2ab 2a","59","DCP1","(Acetato)(10-benzo[h]quinolinato)palladium(II) dimer","","- C30 H22 N2 O4 Pd2 -","- C30 H22 N2 O4 Pd2 -","- C120 H88 N8 O16 Pd8 -","4","0.5","","David C. Powers; Diego Benitez; Ekaterina Tkatchouk; William A. Goddard; Tobias Ritter","Bimetallic Reductive Elimination from Dinuclear Pd(III) Complexes","Journal of the American Chemical Society","2010","132","","14092","14103","10.1021/ja1036644","","","0.71073","MoKα","","0.0297","0.0282","","","0.0701","0.0713","","","","","","1.12","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103196","16.3668","0.0004","17.4864","0.0004","26.005","0.0006","90","","90","","90","","7442.5","0.3","193","2","193","2","","","","","","","chemical synthesis","6","P b c a","-P 2ac 2ab","61","DCP-IV-15","Bis(acetato)bis(μ~2~-acetato)-bis(10-benzo[h]quinolato)- dipalladium(III) bis(dichloromethane) solvate","","- C36 H32 Cl4 N2 O8 Pd2 -","- C36 H32 Cl4 N2 O8 Pd2 -","- C288 H256 Cl32 N16 O64 Pd16 -","8","1","","David C. Powers; Diego Benitez; Ekaterina Tkatchouk; William A. Goddard; Tobias Ritter","Bimetallic Reductive Elimination from Dinuclear Pd(III) Complexes","Journal of the American Chemical Society","2010","132","","14092","14103","10.1021/ja1036644","","","0.71073","MoKα","","0.0866","0.0428","","","0.0819","0.0969","","","","","","1.005","","","","has coordinates,has disorder","178777","2020-10-21","18:00:00","" "4103197","14.089","0.005","7.999","0.003","15.361","0.005","90","","90","","90","","1731.2","1.1","110","2","110","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C4.5 H9 B0.5 F2 Fe N2.5 O1.5 S -","- C4.5 H9 B0.5 F2 Fe N2.5 O1.5 S -","- C36 H72 B4 F16 Fe8 N20 O12 S8 -","8","2","","Chung-Hung Hsieh; Marcetta Y. Darensbourg","A {Fe(NO)3}10 Trinitrosyliron Complex Stabilized by an N-Heterocyclic Carbene and the Cationic and Neutral {Fe(NO)2}9/10 Products of Its NO Release","Journal of the American Chemical Society","2010","132","","14118","14125","10.1021/ja104135x","","","0.71073","MoKα","","0.0275","0.0245","","","0.0529","0.0541","","","","","","1.016","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103198","8.252","0.004","10.218","0.005","15.767","0.008","104.936","0.006","95.022","0.006","101.285","0.006","1246.3","1.1","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H25 B F4 Fe N5 O3.5 -","- C21 H25 B F4 Fe N5 O3.5 -","- C42 H50 B2 F8 Fe2 N10 O7 -","2","1","","Chung-Hung Hsieh; Marcetta Y. Darensbourg","A {Fe(NO)3}10 Trinitrosyliron Complex Stabilized by an N-Heterocyclic Carbene and the Cationic and Neutral {Fe(NO)2}9/10 Products of Its NO Release","Journal of the American Chemical Society","2010","132","","14118","14125","10.1021/ja104135x","","","0.71073","MoKα","","0.0927","0.0701","","","0.1632","0.1793","","","","","","1.001","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103199","7.61","0.005","8.319","0.005","19.33","0.012","78.557","0.011","87.345","0.01","69.123","0.01","1120.3","1.2","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H24 Fe N4 O3 -","- C22 H24 Fe N4 O3 -","- C44 H48 Fe2 N8 O6 -","2","1","","Chung-Hung Hsieh; Marcetta Y. Darensbourg","A {Fe(NO)3}10 Trinitrosyliron Complex Stabilized by an N-Heterocyclic Carbene and the Cationic and Neutral {Fe(NO)2}9/10 Products of Its NO Release","Journal of the American Chemical Society","2010","132","","14118","14125","10.1021/ja104135x","","","0.71073","MoKα","","0.0723","0.0466","","","0.0978","0.1131","","","","","","1.036","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103200","16.344","0.012","8.202","0.006","22.232","0.017","90","","93.201","0.009","90","","2976","4","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H32 Fe N4 O3.5 S -","- C27 H32 Fe N4 O3.5 S -","- C108 H128 Fe4 N16 O14 S4 -","4","1","","Chung-Hung Hsieh; Marcetta Y. Darensbourg","A {Fe(NO)3}10 Trinitrosyliron Complex Stabilized by an N-Heterocyclic Carbene and the Cationic and Neutral {Fe(NO)2}9/10 Products of Its NO Release","Journal of the American Chemical Society","2010","132","","14118","14125","10.1021/ja104135x","","","0.71073","MoKα","","0.0838","0.0572","","","0.1552","0.1709","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103201","18.745","0.002","16.1454","0.0018","16.911","0.002","90","","94.181","0.004","90","","5104.4","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[SiP(Ph)3]Pt-CH3","","","- C63 H61 O2 P3 Pt Si -","- C63 H61 O2 P3 Pt Si -","- C252 H244 O8 P12 Pt4 Si4 -","4","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0844","0.0506","","","0.1189","0.1457","","","","","","1.091","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103202","11.1768","0.0012","13.3695","0.0014","15.7387","0.0016","87.699","0.002","84.961","0.002","86.359","0.002","2336.6","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[SiP(Ph)3]Pt-Cl","","","- C55 H44 Cl3 P3 Pt Si -","- C55 H44 Cl3 P3 Pt Si -","- C110 H88 Cl6 P6 Pt2 Si2 -","2","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0489","0.0422","","","0.104","0.1081","","","","","","1.082","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103203","18.572","0.003","16.157","0.003","16.968","0.003","90","","96.473","0.003","90","","5059.1","1.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[SiP(Ph)3]Pt-H","","","- C62 H59 O2 P3 Pt Si -","- C62 H59 O2 P3 Pt Si -","- C248 H236 O8 P12 Pt4 Si4 -","4","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0776","0.0435","","","0.0872","0.1036","","","","","","1.025","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103204","13.1515","0.0015","17.621","0.002","19.654","0.002","65.549","0.002","77.723","0.002","86.737","0.002","4048.9","0.8","100","2","100","2","","","","","","","","8","P -1","-P 1","2","{[SiP(Ph)3]Pt-OEt2}{BArF}","","","- C90 H64 B F24 O P3 Pt Si -","- C90 H64 B F24 O P3 Pt Si -","- C180 H128 B2 F48 O2 P6 Pt2 Si2 -","2","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0663","0.0463","","","0.1053","0.1152","","","","","","1.037","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103205","12.6057","0.0011","17.5913","0.0016","20.2306","0.0018","84.459","0.002","84.435","0.002","86.795","0.002","4439.2","0.7","100","2","100","2","","","","","","","","8","P -1","-P 1","2","{[SiP(Ph)3]Pt-Cl2CH2}{BArF}","","","- C45 H31 B0.5 Cl4 F12 P1.5 Pt0.5 Si0.5 -","- C45 H31 B0.5 Cl4 F12 P1.5 Pt0.5 Si0.5 -","- C180 H124 B2 Cl16 F48 P6 Pt2 Si2 -","4","2","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.084","0.0635","","","0.16","0.1736","","","","","","1.05","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103206","13.2678","0.0011","17.6132","0.0015","18.7753","0.0016","84.415","0.002","72.421","0.002","86.39","0.001","4160.2","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","{[SiP(Ph)3]Pt-tol}{BArF}","","","- C46.5 H29.5 B0.5 F12 P1.5 Pt0.5 Si0.5 -","- C46.5 H31 B0.5 F12 P1.5 Pt0.5 Si0.5 -","- C186 H124 B2 F48 P6 Pt2 Si2 -","4","2","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0448","0.0351","","","0.0745","0.0795","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103207","11.088","0.002","11.156","0.002","35.058","0.007","89.95","0.03","88.84","0.03","61.63","0.03","3814.8","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[SiP(iPr)3]Pt-H","","","- C38.5 H61 P3 Pt Si -","- C38.5 H61 P3 Pt Si -","- C154 H244 P12 Pt4 Si4 -","4","2","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0407","0.0307","","","0.0637","0.0674","","","","","","1.062","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103208","12.8824","0.001","38.101","0.003","14.3445","0.0011","90","","92.557","0.001","90","","7033.7","0.9","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","{[SiP(iPr)3]Pt}{BArF}","","","- C68 H66 B F24 P3 Pt Si -","- C68 H66 B F24 P3 Pt Si -","- C272 H264 B4 F96 P12 Pt4 Si4 -","4","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0485","0.0358","","","0.072","0.0767","","","","","","1.094","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103209","12.8547","0.0012","14.9356","0.0013","38.282","0.004","90","","96.574","0.002","90","","7301.5","1.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","{[SiP(iPr)3]Pt-NCMe}{BArF}","","","- C70 H69 B F24 N P3 Pt Si -","- C70 H69 B F24 N P3 Pt Si -","- C280 H276 B4 F96 N4 P12 Pt4 Si4 -","4","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0474","0.0341","","","0.0706","0.0762","","","","","","1.06","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103210","10.1305","0.0007","24.594","0.002","15.8544","0.0013","90","","91.071","0.002","90","","3949.4","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[SiP(iPr)3]Pd-Cl","","","- C37 H56 Cl3 P3 Pd Si -","- C37 H56 Cl3 P3 Pd Si -","- C148 H224 Cl12 P12 Pd4 Si4 -","4","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.045","0.0333","","","0.0751","0.082","","","","","","1.052","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103211","12.8728","0.001","38.131","0.003","14.4024","0.0011","90","","92.337","0.001","90","","7063.6","0.9","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","{[SiP(iPr)3]Pd}{BArF}","","","- C68 H66 B F24 P3 Pd Si -","- C68 H66 B F24 P3 Pd Si -","- C272 H264 B4 F96 P12 Pd4 Si4 -","4","1","","Charlene Tsay; Neal P. Mankad; Jonas C. Peters","Four-Coordinate, trigonal Pyramidal Pt(II) and Pd(II) Complexes","Journal of the American Chemical Society","2010","132","","13975","13977","10.1021/ja105284p","","","0.71073","MoKα","","0.0729","0.0483","","","0.1419","0.1603","","","","","","1.067","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103212","37.113","0.006","8.4961","0.0015","7.3282","0.0013","90","","95.987","0.003","90","","2298.1","0.7","93","2","93","2","","","","","","","","4","C 1 2 1","C 2y","5","","1,2-Bis(2-methyl-5-(1-naphthyl)-3-thienyl)perfluorocyclopentene and perfluoronaphthalene","","- C55 H22 F22 S2 -","- C55 H22 F22 S2 -","- C110 H44 F44 S4 -","2","0.5","","Masakazu Morimoto; Masahiro Irie","A Diarylethene Cocrystal that Converts Light into Mechanical Work","Journal of the American Chemical Society","2010","132","","14172","14178","10.1021/ja105356w","","","0.71073","MoKα","","0.0551","0.0528","","","0.1413","0.1464","","","","","","1.069","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103213","37.055","0.007","8.5204","0.0017","7.3284","0.0014","90","","95.687","0.003","90","","2302.4","0.8","93","2","93","2","","","","","","","","4","C 1 2 1","C 2y","5","","1,2-Bis(2-methyl-5-(1-naphthyl)-3-thienyl)perfluorocyclopentene and perfluoronaphthalene","","- C55 H22 F22 S2 -","- C55 H22 F22 S2 -","- C110 H44 F44 S4 -","2","0.5","","Masakazu Morimoto; Masahiro Irie","A Diarylethene Cocrystal that Converts Light into Mechanical Work","Journal of the American Chemical Society","2010","132","","14172","14178","10.1021/ja105356w","","","0.71073","MoKα","","0.0784","0.0759","","","0.1957","0.1998","","","","","","1.114","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103214","9.6333","0.0015","11.8268","0.0018","24.376","0.004","93.111","0.002","91.991","0.002","90.387","0.002","2771.3","0.8","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","1,2-dimethyl-8,8,9,9,10,10-hexafluoro-4,14-di(1-naphthyl)-3,15-dithiatetracyclo-[10.3.0.0^2,6^.0^7,11^]pentadeca-4,6(7),11(12),13-tetraene","","- C35 H22 F6 S2 -","- C35 H22 F6 S2 -","- C140 H88 F24 S8 -","4","2","","Masakazu Morimoto; Masahiro Irie","A Diarylethene Cocrystal that Converts Light into Mechanical Work","Journal of the American Chemical Society","2010","132","","14172","14178","10.1021/ja105356w","","","0.71073","MoKα","","0.0823","0.0773","","","0.2097","0.2122","","","","","","1.14","","","","has coordinates","211399","2020-10-21","18:00:00","" "4103215","37.27","0.003","7.0743","0.0006","18.1981","0.0017","90","","93.537","0.002","90","","4789","0.7","143","1","143","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H31 N O3 S -","- C26 H31 N O3 S -","- C208 H248 N8 O24 S8 -","8","1","","Petr Valenta; Patrick J. Carroll; Patrick J. Walsh","Stereoselective Synthesis of β-Hydroxy Enamines, Aminocyclopropanes, and 1,3-Amino Alcohols via Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14179","14190","10.1021/ja105435y","","","0.71073","MoKα","","0.0578","0.0455","","","0.1111","0.121","","","","","","1.078","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103216","24.2849","0.0011","8.0847","0.0004","24.1022","0.0011","90","","90","","90","","4732.1","0.4","163","1","163","1","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C25 H35 N O3 S -","- C25 H35 N O3 S -","- C200 H280 N8 O24 S8 -","8","1","","Petr Valenta; Patrick J. Carroll; Patrick J. Walsh","Stereoselective Synthesis of β-Hydroxy Enamines, Aminocyclopropanes, and 1,3-Amino Alcohols via Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14179","14190","10.1021/ja105435y","","","0.71073","MoKα","","0.0848","0.0529","","","0.1263","0.1428","","","","","","1.032","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103217","17.8473","0.0019","11.6887","0.0013","24.162","0.003","90","","90.76","0.006","90","","5040","1","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H33 N O3 S -","- C29 H33 N O3 S -","- C232 H264 N8 O24 S8 -","8","4","","Petr Valenta; Patrick J. Carroll; Patrick J. Walsh","Stereoselective Synthesis of β-Hydroxy Enamines, Aminocyclopropanes, and 1,3-Amino Alcohols via Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14179","14190","10.1021/ja105435y","","","0.71073","MoKα","","0.0786","0.055","","","0.1304","0.1426","","","","","","1.099","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103218","16.7153","0.0015","6.1216","0.0007","23.543","0.002","90","","101.35","0.006","90","","2361.9","0.4","143","1","143","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H31 N O3 S -","- C27 H31 N O3 S -","- C108 H124 N4 O12 S4 -","4","1","","Petr Valenta; Patrick J. Carroll; Patrick J. Walsh","Stereoselective Synthesis of β-Hydroxy Enamines, Aminocyclopropanes, and 1,3-Amino Alcohols via Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14179","14190","10.1021/ja105435y","","","0.71073","MoKα","","0.0693","0.042","","","0.0944","0.1055","","","","","","1.022","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103219","7.4514","0.0002","11.2179","0.0003","22.8043","0.0006","90","","90","","90","","1906.19","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H26 Br N O4 -","- C19 H26 Br N O4 -","- C76 H104 Br4 N4 O16 -","4","1","","Željko Skoko; Sharona Zamir; Panče Naumov; Joel Bernstein","The Thermosalient Phenomenon. ""Jumping Crystals"" and Crystal Chemistry of the Anticholinergic Agent Oxitropium Bromide","Journal of the American Chemical Society","2010","132","","14191","14202","10.1021/ja105508b","","","0.71073","MoKα","","0.0881","0.0461","","","0.1019","0.1246","","","","","","1.047","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103220","7.3927","0.0002","10.1512","0.0004","24.6291","0.0009","90","","90","","90","","1848.29","0.11","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H26 Br N O4 -","- C19 H26 Br N O4 -","- C76 H104 Br4 N4 O16 -","4","1","","Željko Skoko; Sharona Zamir; Panče Naumov; Joel Bernstein","The Thermosalient Phenomenon. ""Jumping Crystals"" and Crystal Chemistry of the Anticholinergic Agent Oxitropium Bromide","Journal of the American Chemical Society","2010","132","","14191","14202","10.1021/ja105508b","","","0.71073","MoKα","","0.0517","0.0321","","","0.0695","0.0764","","","","","","1.019","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103221","7.4709","0.0007","11.2277","0.0011","22.7979","0.0018","90","0.005","90","0.005","90","0.005","1912.3","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H26 Br N O4 -","- C19 H26 Br N O4 -","- C76 H104 Br4 N4 O16 -","4","1","","Željko Skoko; Sharona Zamir; Panče Naumov; Joel Bernstein","The Thermosalient Phenomenon. ""Jumping Crystals"" and Crystal Chemistry of the Anticholinergic Agent Oxitropium Bromide","Journal of the American Chemical Society","2010","132","","14191","14202","10.1021/ja105508b","","","0.71073","MoKα","","0.1348","0.0528","","","0.1055","0.1329","","","","","","0.968","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103222","19.7588","0.0009","7.783","0.0004","20.3595","0.001","90","","90","","90","","3130.9","0.3","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C36 H37 Br O6 -","- C36 H37 Br O6 -","- C144 H148 Br4 O24 -","4","1","","Qiang Zhang; Branko Mitasev; Ji Qi; John A. Porco","Total Synthesis of Plukenetione A","Journal of the American Chemical Society","2010","132","","14212","14215","10.1021/ja105784s","","","0.71073","MoKα","","0.0677","0.0363","","","0.0699","0.0791","","","","","","1.02","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103223","16.1664","0.0006","22.2456","0.0009","8.7124","0.0004","90","","91.709","0.002","90","","3131.9","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H37 Br O6 -","- C36 H37 Br O6 -","- C144 H148 Br4 O24 -","4","1","","Qiang Zhang; Branko Mitasev; Ji Qi; John A. Porco","Total Synthesis of Plukenetione A","Journal of the American Chemical Society","2010","132","","14212","14215","10.1021/ja105784s","","","0.71073","MoKα","","0.0734","0.0414","","","0.0968","0.1122","","","","","","1.007","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103224","8.3166","0.0008","10.244","0.001","18.5583","0.0017","93.377","0.003","93.939","0.004","93.022","0.004","1572","0.3","180","2","180","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C32 H42 B N8 Nb -","- C32 H42 B N8 Nb -","- C64 H84 B2 N16 Nb2 -","2","1","","Cédric Boulho; Pascal Oulié; Laure Vendier; Michel Etienne; Véronique Pimienta; Abel Locati; Fabienne Bessac; Feliu Maseras; Dimitrios A. Pantazis; John E. McGrady","C-H Bond Activation of Benzene by Unsaturated η2-Cyclopropene and η2-Benzyne Complexes of Niobium","Journal of the American Chemical Society","2010","132","","14239","14250","10.1021/ja1061505","","","0.71073","MoKα","","0.0982","0.0624","","","0.1344","0.1494","","","","","","1.083","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103225","31.593","0.003","10.0459","0.0006","27.465","0.002","90","","113.036","0.01","90","","8021.8","1.2","180","2","180","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H44 B N6 Nb O2 -","- C28 H44 B N6 Nb O2 -","- C224 H352 B8 N48 Nb8 O16 -","8","1","","Cédric Boulho; Pascal Oulié; Laure Vendier; Michel Etienne; Véronique Pimienta; Abel Locati; Fabienne Bessac; Feliu Maseras; Dimitrios A. Pantazis; John E. McGrady","C-H Bond Activation of Benzene by Unsaturated η2-Cyclopropene and η2-Benzyne Complexes of Niobium","Journal of the American Chemical Society","2010","132","","14239","14250","10.1021/ja1061505","","","0.71073","MoKα","","0.0846","0.0505","","","0.1319","0.1455","","","","","","0.867","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103226","8.2075","0.0005","15.1721","0.0009","10.3794","0.0006","90","","93.729","0.005","90","","1289.76","0.13","180","2","180","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C26 H32 B N6 Nb O -","- C26 H32 B N6 Nb O -","- C52 H64 B2 N12 Nb2 O2 -","2","1","","Cédric Boulho; Pascal Oulié; Laure Vendier; Michel Etienne; Véronique Pimienta; Abel Locati; Fabienne Bessac; Feliu Maseras; Dimitrios A. Pantazis; John E. McGrady","C-H Bond Activation of Benzene by Unsaturated η2-Cyclopropene and η2-Benzyne Complexes of Niobium","Journal of the American Chemical Society","2010","132","","14239","14250","10.1021/ja1061505","","","0.71073","MoKα","","0.0443","0.0302","","","0.0508","0.0534","","","","","","0.927","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103227","11.3446","0.0005","35.9037","0.001","15.6188","0.0007","90","","109.927","0.005","90","","5980.8","0.5","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H64 Cl6 O12 Ru2 -","- C56 H64 Cl6 O12 Ru2 -","- C224 H256 Cl24 O48 Ru8 -","4","1","","Sebastian Mirtschin; Adam Slabon-Turski; Rosario Scopelliti; Aldrik H. Velders; Kay Severin","A Coordination Cage with an Adaptable Cavity Size","Journal of the American Chemical Society","2010","132","","14004","14005","10.1021/ja1063789","","","0.71073","MoKα","","0.0656","0.0569","","","0.144","0.1485","","","","","","1.105","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103228","28.744","0.009","32.301","0.009","31.287","0.008","90","","107.183","0.019","90","","27752","14","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C240 H204 Cl36 N12 O36 Ru6 -","- C240 H204 Cl36 N12 O36 Ru6 -","- C960 H816 Cl144 N48 O144 Ru24 -","4","1","","Sebastian Mirtschin; Adam Slabon-Turski; Rosario Scopelliti; Aldrik H. Velders; Kay Severin","A Coordination Cage with an Adaptable Cavity Size","Journal of the American Chemical Society","2010","132","","14004","14005","10.1021/ja1063789","","","0.71073","MoKα","","0.286","0.1637","","","0.3893","0.4662","","","","","","1.424","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103229","42.321","0.004","27.694","0.003","22.302","0.003","90","","93.769","0.011","90","","26082","5","140","2","140","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C240 H208 Cl20 N12 O36 Ru6 -","- C240 H208 Cl20 N12 O36 Ru6 -","- C960 H832 Cl80 N48 O144 Ru24 -","4","0.5","","Sebastian Mirtschin; Adam Slabon-Turski; Rosario Scopelliti; Aldrik H. Velders; Kay Severin","A Coordination Cage with an Adaptable Cavity Size","Journal of the American Chemical Society","2010","132","","14004","14005","10.1021/ja1063789","","","0.71073","MoKα","","0.2705","0.1589","","","0.3981","0.4461","","","","","","1.145","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103230","11.3147","0.0006","14.0739","0.0008","12.8472","0.0007","90","","90","0.005","90","","2045.81","0.19","12","2","12","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C41 H34 Cl4 Cr2 Fe N12 -","- C41 H34 Cl4 Cr2 Fe N12 -","- C82 H68 Cl8 Cr4 Fe2 N24 -","2","1","","Michael Nippe; Jingfang Wang; Eckhard Bill; Håkon Hope; Naresh S. Dalal; John F. Berry","Crystals in Which Some Metal Atoms are More Equal Than Others: Inequalities From Crystal Packing and Their Spectroscopic/Magnetic Consequences","Journal of the American Chemical Society","2010","132","","14261","14272","10.1021/ja106510g","","","0.71073","MoKα","","0.0242","0.0238","","","0.0576","0.0579","","","","","","1.019","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103231","12.8741","0.0005","14.0942","0.0005","11.3501","0.0004","90","","90","","90","","2059.48","0.13","100","2","100","2","","","","","","","","6","P n n 2","P 2 -2n","34","","","","- C41 H34 Cl4 Cr2 Mn N12 -","- C41 H34 Cl4 Cr2 Mn N12 -","- C82 H68 Cl8 Cr4 Mn2 N24 -","2","0.5","","Michael Nippe; Jingfang Wang; Eckhard Bill; Håkon Hope; Naresh S. Dalal; John F. Berry","Crystals in Which Some Metal Atoms are More Equal Than Others: Inequalities From Crystal Packing and Their Spectroscopic/Magnetic Consequences","Journal of the American Chemical Society","2010","132","","14261","14272","10.1021/ja106510g","","","0.71073","MoKα","","0.0781","0.0498","","","0.1063","0.1149","","","","","","0.953","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103232","11.3859","0.0004","14.1065","0.0004","12.8842","0.0004","90","","89.9967","0.0004","90","","2069.4","0.11","11","2","11","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C41 H34 Cl4 Cr2 Mn N12 -","- C41 H34 Cl4 Cr2 Mn N12 -","- C82 H68 Cl8 Cr4 Mn2 N24 -","2","1","","Michael Nippe; Jingfang Wang; Eckhard Bill; Håkon Hope; Naresh S. Dalal; John F. Berry","Crystals in Which Some Metal Atoms are More Equal Than Others: Inequalities From Crystal Packing and Their Spectroscopic/Magnetic Consequences","Journal of the American Chemical Society","2010","132","","14261","14272","10.1021/ja106510g","","","0.71073","MoKα","","0.0235","0.023","","","0.0579","0.0583","","","","","","1.057","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103233","16.255","0.003","15.817","0.003","17.08","0.003","90","","98.676","0.003","90","","4341.1","1.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H42 Cl2 Mn Mo2 N12 O -","- C44 H42 Cl2 Mn Mo2 N12 O -","- C176 H168 Cl8 Mn4 Mo8 N48 O4 -","4","1","","Michael Nippe; Jingfang Wang; Eckhard Bill; Håkon Hope; Naresh S. Dalal; John F. Berry","Crystals in Which Some Metal Atoms are More Equal Than Others: Inequalities From Crystal Packing and Their Spectroscopic/Magnetic Consequences","Journal of the American Chemical Society","2010","132","","14261","14272","10.1021/ja106510g","","","0.71073","MoKα","","0.0829","0.0582","","","0.121","0.1326","","","","","","1.049","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103234","9.0668","0.0007","9.8264","0.0007","40.256","0.003","95.495","0.01","92.413","0.01","104.368","0.01","3450.3","0.5","301","2","301","2","","","","","","","","6","P -1","-P 1","2","","","","- C43.5 H28 Au Cl F2 N2 -","- C43.5 H28 Au Cl F2 N2 -","- C174 H112 Au4 Cl4 F8 N8 -","4","2","","Vonika Ka-Man Au; Keith Man-Chung Wong; Daniel Ping-Kuen Tsang; Mei-Yee Chan; Nianyong Zhu; Vivian Wing-Wah Yam","High-Efficiency Green Organic Light-Emitting Devices Utilizing Phosphorescent Bis-cyclometalated Alkynylgold(III) Complexes","Journal of the American Chemical Society","2010","132","","14273","14278","10.1021/ja106579d","","","0.71073","MoKα","","0.0529","0.0415","","","0.0885","0.0916","","","","","","1.185","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103235","7.9489","0.0006","15.3972","0.0011","13.091","0.0009","90","","106.67","0.001","90","","1534.88","0.19","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 Br1.15 Cl5.85 S Sb -","- C4 H10 Br1.153 Cl5.847 S Sb -","- C16 H40 Br4.612 Cl23.388 S4 Sb4 -","4","1","","Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks","Simple Reagents for Direct Halonium-Induced Polyene Cyclizations","Journal of the American Chemical Society","2010","132","","14303","14314","10.1021/ja106813s","","","0.71073","MoKα","","0.0782","0.0707","","","0.2072","0.2154","","","","","","1.088","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103236","6.5204","0.0003","7.5841","0.0003","14.6753","0.0007","97.119","0.001","98.834","0.001","109.628","0.001","663.32","0.05","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H21 Br O3 -","- C12 H21 Br O3 -","- C24 H42 Br2 O6 -","2","1","","Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks","Simple Reagents for Direct Halonium-Induced Polyene Cyclizations","Journal of the American Chemical Society","2010","132","","14303","14314","10.1021/ja106813s","","","0.71073","MoKα","","0.038","0.0281","","","0.068","0.0721","","","","","","1.036","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103237","15.821","0.003","7.1644","0.0012","15.281","0.003","90","","116.583","0.002","90","","1549","0.5","125","2","125","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 Br O3 -","- C16 H25 Br O3 -","- C64 H100 Br4 O12 -","4","1","","Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks","Simple Reagents for Direct Halonium-Induced Polyene Cyclizations","Journal of the American Chemical Society","2010","132","","14303","14314","10.1021/ja106813s","","","0.71073","MoKα","","0.1552","0.0548","","","0.0997","0.1304","","","","","","1.006","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103238","8.4507","0.0013","11.6837","0.0018","13.062","0.002","63.818","0.002","73.597","0.002","71.708","0.002","1083.1","0.3","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H33 Br O4 -","- C23 H33 Br O4 -","- C46 H66 Br2 O8 -","2","1","","Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks","Simple Reagents for Direct Halonium-Induced Polyene Cyclizations","Journal of the American Chemical Society","2010","132","","14303","14314","10.1021/ja106813s","","","0.71073","MoKα","","0.0793","0.0672","","","0.1675","0.1754","","","","","","1.066","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103239","11.3702","0.0008","15.5446","0.001","15.5823","0.001","119.103","0.001","90.465","0.001","91.236","0.001","2405.3","0.3","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H20 Cl7 I2 S2 Sb -","- C8 H20 Cl7 I2 S2 Sb -","- C32 H80 Cl28 I8 S8 Sb4 -","4","2","","Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks","Simple Reagents for Direct Halonium-Induced Polyene Cyclizations","Journal of the American Chemical Society","2010","132","","14303","14314","10.1021/ja106813s","","","0.71073","MoKα","","0.0735","0.0556","","","0.146","0.16","","","","","","1.073","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103240","7.365","0.002","23.739","0.006","9.854","0.003","90","","109.818","0.003","90","","1620.8","0.8","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C38 H38 N4 O4 -","- C38 H38 N4 O4 -","- C76 H76 N8 O8 -","2","1","","Haoxing Wu; Fei Xue; Xue Xiao; Yong Qin","Total Synthesis of (+)-Perophoramidine and Determination of the Absolute Configuration","Journal of the American Chemical Society","2010","132","","14052","14054","10.1021/ja1070043","","","0.71073","MoKα","","0.0494","0.0424","","","0.0813","0.0846","","","","","","1.003","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103241","22.998","0.0017","8.563","0.003","16.146","0.005","90","","90","","90","","3179.7","1.5","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","Zinc 1,3,5-Benzenetriphosphonatehydrate","","","- C6 H3 O13 P3 Zn3 -","- C6 H3 O13 P3 Zn3 -","- C48 H24 O104 P24 Zn24 -","8","","","Jared M. Taylor; Roger K. Mah; Igor L. Moudrakovski; Christopher I. Ratcliffe; Ramanathan Vaidhyanathan; George K. H. Shimizu","Facile Proton Conduction via Ordered Water Molecules in a Phosphonate Metal-Organic Framework","Journal of the American Chemical Society","2010","132","","14055","14057","10.1021/ja107035w","","","0.71073","MoKα","","0.0502","0.0401","","","0.0926","0.0997","","","","","","1.13","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103242","22.972","0.005","8.571","0.0017","16.148","0.003","90","","90","","90","","3179.4","1.1","173","2","173","2","","","","","","","","5","C m c a","-C 2ac 2","64","Zinc 1,3,5-Benzenetriphosphonate tetrahydrate","","","- C6 H7 O13 P3 Zn3 -","- C6 H3 O13 P3 Zn3 -","- C48 H24 O104 P24 Zn24 -","8","","","Jared M. Taylor; Roger K. Mah; Igor L. Moudrakovski; Christopher I. Ratcliffe; Ramanathan Vaidhyanathan; George K. H. Shimizu","Facile Proton Conduction via Ordered Water Molecules in a Phosphonate Metal-Organic Framework","Journal of the American Chemical Society","2010","132","","14055","14057","10.1021/ja107035w","","","0.71073","MoKα","","0.0406","0.033","","","0.0972","0.102","","","","","","1.168","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103243","17.507","0.004","39.237","0.008","24.684","0.005","90","","131.52","0.03","90","","12695","8","113","1","113","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C98 H160 N19 O10 P2 -","- C98 H160 N19 O10 P2 -","- C392 H640 N76 O40 P8 -","4","1","","Jonathan L. Sessler; Jiajia Cai; Han-Yuan Gong; Xiaoping Yang; Jonathan F. Arambula; Benjamin P. Hay","A Pyrrolyl-Based Triazolophane: A Macrocyclic Receptor With CH and NH Donor Groups That Exhibits a Preference for Pyrophosphate Anions","Journal of the American Chemical Society","2010","132","","14058","14060","10.1021/ja107098r","","","0.710747","MoKα","","0.1368","0.0979","","","0.2669","0.2973","","","","","","0.973","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103244","18.799","0.004","7.4924","0.0015","23.685","0.005","90","","125.38","0.03","90","","2720","1.4","223","2","223","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C54 H68 N16 O5 -","- C54 H68 N16 O5 -","- C108 H136 N32 O10 -","2","0.5","","Jonathan L. Sessler; Jiajia Cai; Han-Yuan Gong; Xiaoping Yang; Jonathan F. Arambula; Benjamin P. Hay","A Pyrrolyl-Based Triazolophane: A Macrocyclic Receptor With CH and NH Donor Groups That Exhibits a Preference for Pyrophosphate Anions","Journal of the American Chemical Society","2010","132","","14058","14060","10.1021/ja107098r","","","0.710747","MoKα","","0.1945","0.0929","","","0.2083","0.27","","","","","","0.986","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103245","13.6803","0.0005","15.5256","0.0006","17.9443","0.0007","70.35","","80.36","","67.26","","3307.2","0.2","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C46 H114 N2 Si12 -","- C46 H114 N2 Si12 -","- C92 H228 N4 Si24 -","2","1","","Torahiko Yamaguchi; Akira Sekiguchi; Matthias Driess","An N-Heterocyclic Carbene-Disilyne Complex and Its Reactivity toward ZnCl2","Journal of the American Chemical Society","2010","132","","14061","14063","10.1021/ja107160g","","","0.71073","MoKα","","0.0447","0.0353","","","0.0943","0.1008","","","","","","1.027","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103246","10.3809","0.0012","16.1779","0.0019","21.481","0.003","93.502","0.002","90.604","0.002","107.516","0.002","3432.3","0.7","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C47 H108 Cl2 N2 Si12 Zn -","- C47 H108 Cl2 N2 Si12 Zn -","- C94 H216 Cl4 N4 Si24 Zn2 -","2","1","","Torahiko Yamaguchi; Akira Sekiguchi; Matthias Driess","An N-Heterocyclic Carbene-Disilyne Complex and Its Reactivity toward ZnCl2","Journal of the American Chemical Society","2010","132","","14061","14063","10.1021/ja107160g","","","0.71073","MoKα","","0.077","0.0479","","","0.1137","0.127","","","","","","1.025","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103247","20.116","0.003","9.738","0.005","18.742","0.006","90","","90","","90","","3671","2","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C40 H48 N2 Si Zr -","- C40 H48 N2 Si Zr -","- C160 H192 N8 Si4 Zr4 -","4","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.0812","0.075","","","0.1269","0.1295","","","","","","1.242","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103248","40.229","0.008","10.358","0.002","18.927","0.004","90","","99.51","0.03","90","","7778","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C41 H49 N O Si Zr -","- C41 H49 N O Si Zr -","- C328 H392 N8 O8 Si8 Zr8 -","8","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.1951","0.0701","","","0.0917","0.0968","","","","","","0.981","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103249","8.833","0.004","11.184","0.005","29.474","0.012","90","","92.658","0.005","90","","2909","2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H43 N O2 Si -","- C30 H43 N O2 Si -","- C120 H172 N4 O8 Si4 -","4","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.0761","0.0729","","","0.1695","0.1717","","","","","","1.267","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103250","13.699","0.003","17.736","0.004","16.404","0.003","90","","103.28","0.03","90","","3879","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H53 N3 Si Zr -","- C42 H53 N3 Si Zr -","- C168 H212 N12 Si4 Zr4 -","4","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.2475","0.0632","","","0.1298","0.2109","","","","","","0.845","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103251","10.347","0.002","11.153","0.002","18.713","0.004","97.37","0.03","92.83","0.03","109","0.03","2015.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H56 N Si Zr -","- C44 H56 N Si Zr -","- C88 H112 N2 Si2 Zr2 -","2","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.0826","0.0476","","","0.0953","0.1001","","","","","","0.996","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103252","14.593","0.003","8.5806","0.0017","17.839","0.004","90","","91.89","0.03","90","","2232.5","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H29 N Si -","- C25 H29 N Si -","- C100 H116 N4 Si4 -","4","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.1413","0.0469","","","0.0867","0.1211","","","","","","0.999","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103253","9.5247","0.0012","18.891","0.002","19.036","0.002","90","","90","","90","","3425.2","0.7","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C40 H40 Cl N O Si Zr -","- C40 H40 Cl N O Si Zr -","- C160 H160 Cl4 N4 O4 Si4 Zr4 -","4","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.0568","0.0533","","","0.0989","0.1007","","","","","","1.134","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103254","15.934","0.003","15.239","0.003","15.016","0.003","90","","94.65","0.03","90","","3634.2","1.2","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H44 N2 Si Zr -","- C42 H34 N2 Si Zr -","- C168 H136 N8 Si4 Zr4 -","4","1","","Shaoguang Zhang; Wen-Xiong Zhang; Jing Zhao; Zhenfeng Xi","Cleavage and Reorganization of Zr-C/Si-C Bonds Leading to Zr/Si-N Organometallic and Heterocyclic Compounds","Journal of the American Chemical Society","2010","132","","14042","14045","10.1021/ja1074932","","","0.71073","MoKα","","0.3024","0.072","","","0.176","0.24","","","","","","0.759","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103255","11.861","0.002","19.126","0.004","18.467","0.004","90","","94.46","0.03","90","","4176.6","1.5","143","2","143","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H61 Ce Cl N4 O Si6 -","- C26 H61 Ce Cl N4 O Si6 -","- C104 H244 Ce4 Cl4 N16 O4 Si24 -","4","1","","Peter Dröse; Alan R. Crozier; Samira Lashkari; Jochen Gottfriedsen; Steffen Blaurock; Cristian G. Hrib; Cäcilia Maichle-Mössmer; Christoph Schädle; Reiner Anwander; Frank T. Edelmann","Facile Access to Tetravalent Cerium Compounds: One-Electron Oxidation Using Iodine(III) Reagents","Journal of the American Chemical Society","2010","132","","14046","14047","10.1021/ja107494h","","","0.71073","MoKα","","0.0381","0.0319","","","0.0722","0.0744","","","","","","1.131","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103256","11.153","0.002","12.925","0.003","19.583","0.004","98.76","0.03","90.93","0.03","104.79","0.03","2693.1","1.1","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H75 Ce Cl N6 O3 Si6 -","- C42 H75 Ce Cl N6 O3 Si6 -","- C84 H150 Ce2 Cl2 N12 O6 Si12 -","2","1","","Peter Dröse; Alan R. Crozier; Samira Lashkari; Jochen Gottfriedsen; Steffen Blaurock; Cristian G. Hrib; Cäcilia Maichle-Mössmer; Christoph Schädle; Reiner Anwander; Frank T. Edelmann","Facile Access to Tetravalent Cerium Compounds: One-Electron Oxidation Using Iodine(III) Reagents","Journal of the American Chemical Society","2010","132","","14046","14047","10.1021/ja107494h","","","0.71073","MoKα","","0.0397","0.0299","","","0.0688","0.0704","","","","","","0.906","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103257","8.3124","0.0003","14.3667","0.0004","13.382","0.0005","90","","91.514","0.003","90","","1597.54","0.09","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18.5 H18.5 Ce Cl -","- C18.5 H18.5 Ce Cl -","- C74 H74 Ce4 Cl4 -","4","1","","Peter Dröse; Alan R. Crozier; Samira Lashkari; Jochen Gottfriedsen; Steffen Blaurock; Cristian G. Hrib; Cäcilia Maichle-Mössmer; Christoph Schädle; Reiner Anwander; Frank T. Edelmann","Facile Access to Tetravalent Cerium Compounds: One-Electron Oxidation Using Iodine(III) Reagents","Journal of the American Chemical Society","2010","132","","14046","14047","10.1021/ja107494h","","","0.71073","MoKα","","0.0327","0.027","","","0.0518","0.0535","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103258","4.873","0.006","13.133","0.016","13.3","0.016","90","","100.56","","90","","836.7","1.8","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H11 Ce O9 -","- C17 H11 Ce O9 -","- C34 H22 Ce2 O18 -","2","1","","Dongbin Dang; Pengyan Wu; Cheng He; Zhong Xie; Chunying Duan","Homochiral Metal-Organic Frameworks for Heterogeneous Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14321","14323","10.1021/ja101208s","","","0.71073","MoKα","","0.1742","0.0777","","","0.1412","0.1723","","","","","","1.084","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103259","4.88","0.009","13.11","0.03","13.29","0.02","90","","100.58","","90","","836","3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H11 Ce N0 O9 -","- C17 H11 Ce O9 -","- C34 H22 Ce2 O18 -","2","1","","Dongbin Dang; Pengyan Wu; Cheng He; Zhong Xie; Chunying Duan","Homochiral Metal-Organic Frameworks for Heterogeneous Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14321","14323","10.1021/ja101208s","","","0.71073","MoKα","","0.1479","0.0822","","","0.2054","0.2517","","","","","","0.98","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103260","8.664","0.004","26.844","0.013","15.377","0.007","90","","93.593","0.007","90","","3569","3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C70 H64 Cd2 N6 O16 -","- C70 H58 Cd2 N6 O16 -","- C140 H116 Cd4 N12 O32 -","2","1","","Dongbin Dang; Pengyan Wu; Cheng He; Zhong Xie; Chunying Duan","Homochiral Metal-Organic Frameworks for Heterogeneous Asymmetric Catalysis","Journal of the American Chemical Society","2010","132","","14321","14323","10.1021/ja101208s","","","0.71073","MoKα","","0.3184","0.0759","","","0.1565","0.2231","","","","","","0.975","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103261","12.4649","0.0005","12.4649","0.0005","47.8243","0.0016","90","","90","","90","","7430.6","0.5","200","2","200","2","","","","","","","","2","I 41 c d","I 4bw -2c","110","Ph4-NDPL","","","- C60 H34 -","- C60 H34 -","- C480 H272 -","8","0.5","","Akihiro Shimizu; Takashi Kubo; Mikio Uruichi; Kyuya Yakushi; Masayoshi Nakano; Daisuke Shiomi; Kazunobu Sato; Takeji Takui; Yasukazu Hirao; Kouzou Matsumoto; Hiroyuki Kurata; Yasushi Morita; Kazuhiro Nakasuji","Alternating Covalent Bonding Interactions in a One-Dimensional Chain of a Phenalenyl-Based Singlet Biradical Molecule Having Kekulé Structures","Journal of the American Chemical Society","2010","132","","14421","14428","10.1021/ja1037287","","","0.71075","MoKα","","0.1068","0.0666","","","0.1595","0.183","","","","","","1.055","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103262","14.319","0.002","6.8536","0.0008","32.694","0.004","90","","93.782","0.002","90","","3201.5","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C70.5 H65.5 N12.5 O5.5 -","- C60 H36 N10 -","- C120 H72 N20 -","2","0.5","","Wenbin Yang; Alex Greenaway; Xiang Lin; Ryotaro Matsuda; Alexander J. Blake; Claire Wilson; William Lewis; Peter Hubberstey; Susumu Kitagawa; Neil R. Champness; Martin Schröder","Exceptional Thermal Stability in a Supramolecular Organic Framework: Porosity and Gas Storage","Journal of the American Chemical Society","2010","132","","14457","14469","10.1021/ja1042935","","","0.71073","MoKα","","0.152","0.0783","","","0.188","0.209","","","","","","0.85","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103263","8.372","0.0014","12.087","0.002","16.072","0.003","87.336","0.003","88.089","0.003","79.577","0.003","1597.3","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C76 H68 N12 O2 -","- C76 H68 N12 O2 -","- C76 H68 N12 O2 -","1","0.5","","Wenbin Yang; Alex Greenaway; Xiang Lin; Ryotaro Matsuda; Alexander J. Blake; Claire Wilson; William Lewis; Peter Hubberstey; Susumu Kitagawa; Neil R. Champness; Martin Schröder","Exceptional Thermal Stability in a Supramolecular Organic Framework: Porosity and Gas Storage","Journal of the American Chemical Society","2010","132","","14457","14469","10.1021/ja1042935","","","0.71073","MoKα","","0.0798","0.0499","","","0.127","0.149","","","","","","1.03","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103264","8.3803","0.0009","12.1013","0.0012","16.1017","0.0016","87.352","0.002","88.209","0.002","79.709","0.002","1604.5","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C76 H68 N12 O2 -","- C76 H68 N12 O2 -","- C76 H68 N12 O2 -","1","0.5","","Wenbin Yang; Alex Greenaway; Xiang Lin; Ryotaro Matsuda; Alexander J. Blake; Claire Wilson; William Lewis; Peter Hubberstey; Susumu Kitagawa; Neil R. Champness; Martin Schröder","Exceptional Thermal Stability in a Supramolecular Organic Framework: Porosity and Gas Storage","Journal of the American Chemical Society","2010","132","","14457","14469","10.1021/ja1042935","","","0.71073","MoKα","","0.0634","0.0419","","","0.105","0.114","","","","","","1.02","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103265","9.0709","0.0007","10.9421","0.0008","12.7964","0.001","93.573","0.001","99.335","0.001","104.496","0.001","1206.32","0.16","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H54 N12 O6 -","- C50 H54 N12 O6 -","- C50 H54 N12 O6 -","1","0.5","","Wenbin Yang; Alex Greenaway; Xiang Lin; Ryotaro Matsuda; Alexander J. Blake; Claire Wilson; William Lewis; Peter Hubberstey; Susumu Kitagawa; Neil R. Champness; Martin Schröder","Exceptional Thermal Stability in a Supramolecular Organic Framework: Porosity and Gas Storage","Journal of the American Chemical Society","2010","132","","14457","14469","10.1021/ja1042935","","","0.71073","MoKα","","0.0589","0.0487","","","0.113","0.119","","","","","","1.04","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103266","10.617","0.003","13.214","0.004","11.835","0.003","90","","91.952","0.006","90","","1659.4","0.8","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C40 H24 N10 -","- C40 H24 N10 -","- C80 H48 N20 -","2","0.5","","Wenbin Yang; Alex Greenaway; Xiang Lin; Ryotaro Matsuda; Alexander J. Blake; Claire Wilson; William Lewis; Peter Hubberstey; Susumu Kitagawa; Neil R. Champness; Martin Schröder","Exceptional Thermal Stability in a Supramolecular Organic Framework: Porosity and Gas Storage","Journal of the American Chemical Society","2010","132","","14457","14469","10.1021/ja1042935","","","0.71073","MoKα","","0.135","0.082","","","0.162","0.18","","","","","","1.01","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103267","7.7384","0.0013","8.4662","0.0014","14.83","0.002","74.005","0.002","83.219","0.003","77.332","0.002","909.5","0.2","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C22 H17 N3 O2 Pd -","- C22 H17 N3 O2 Pd -","- C44 H34 N6 O4 Pd2 -","2","1","","David C. Powers; Daphne Y. Xiao; Matthias A. L. Geibel; Tobias Ritter","On the Mechanism of Palladium-Catalyzed Aromatic C-H Oxidation","Journal of the American Chemical Society","2010","132","","14530","14536","10.1021/ja1054274","","","0.71073","MoKα","","0.0299","0.0248","","","0.0562","0.0592","","","","","","1.062","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103268","11.2731","0.0019","12.654","0.002","12.768","0.002","78.801","0.002","67.287","0.002","88.854","0.003","1645.1","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H26 Cl2 N4 O4 Pd2 -","- C35 H26 Cl2 N4 O4 Pd2 -","- C70 H52 Cl4 N8 O8 Pd4 -","2","1","","David C. Powers; Daphne Y. Xiao; Matthias A. L. Geibel; Tobias Ritter","On the Mechanism of Palladium-Catalyzed Aromatic C-H Oxidation","Journal of the American Chemical Society","2010","132","","14530","14536","10.1021/ja1054274","","","0.71073","MoKα","","0.0308","0.0268","","","0.0717","0.0739","","","","","","1.069","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103269","17.8217","0.0013","6.837","0.0005","26.0357","0.0016","90","","124.977","0.004","90","","2599.4","0.3","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C61 H49 Cl2 N2 Pd -","- C61 H49 Cl2 N2 Pd -","- C122 H98 Cl4 N4 Pd2 -","2","0.5","","Revital Kaminker; Leila Motiei; Antonino Gulino; Ignazio Fragalà; Linda J. W. Shimon; Guennadi Evmenenko; Pulak Dutta; Mark A. Iron; Milko E. van der Boom","Stepwise Assembly of Coordination-Based Metal-Organic Networks","Journal of the American Chemical Society","2010","132","","14554","14561","10.1021/ja105518n","","","0.71073","MoKα","","0.0985","0.0589","","","0.1419","0.1663","","","","","","1.033","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103270","9.4593","0.0006","8.7835","0.0005","16.0818","0.0009","90","","97.199","0.002","90","","1325.64","0.14","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetradiethylether difluoro ditetrafluoroborate dicopper(II)","","- C16 H40 B2 Cu2 F10 O4 -","- C16 H40 B2 Cu2 F10 O4 -","- C32 H80 B4 Cu4 F20 O8 -","2","0.5","","Ashley M. Wright; Guang Wu; Trevor W. Hayton","Structural Characterization of a Copper Nitrosyl Complex with a {CuNO}10 Configuration","Journal of the American Chemical Society","2010","132","","14336","14337","10.1021/ja105930b","","","0.71073","MoKα","","0.0484","0.0431","","","0.1177","0.123","","","","","","1.073","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103271","8.3135","0.0015","11.698","0.002","11.779","0.002","95.151","0.003","104.839","0.003","91.269","0.003","1101.6","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","pentanitromethane copper (II) hexafluorophosphate","","- C5 H15 Cu F12 N5 O10 P2 -","- C5 H15 Cu F11.98 N5 O10 P2 -","- C10 H30 Cu2 F23.96 N10 O20 P4 -","2","1","","Ashley M. Wright; Guang Wu; Trevor W. Hayton","Structural Characterization of a Copper Nitrosyl Complex with a {CuNO}10 Configuration","Journal of the American Chemical Society","2010","132","","14336","14337","10.1021/ja105930b","","","0.71073","MoKα","","0.0973","0.0693","","","0.1606","0.1702","","","","","","1.713","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103272","12.3815","0.0009","14.8062","0.001","28.388","0.002","90","","90","","90","","5204.2","0.6","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","pentanitromethane nitrosyl copper (II) hexafluorophosphate","","- C6 H18 Cu F12 N7 O13 P2 -","- C6 H18 Cu F12 N7 O13 P2 -","- C48 H144 Cu8 F96 N56 O104 P16 -","8","1","","Ashley M. Wright; Guang Wu; Trevor W. Hayton","Structural Characterization of a Copper Nitrosyl Complex with a {CuNO}10 Configuration","Journal of the American Chemical Society","2010","132","","14336","14337","10.1021/ja105930b","","","0.71073","MoKα","","0.1014","0.0515","","","0.1281","0.1582","","","","","","0.988","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103273","8.6563","0.0009","15.9398","0.0017","14.8137","0.0016","90","","98.661","0.002","90","","2020.7","0.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(mesitylene) copper (I) hexafluorophosphate","","- C18 H24 Cu F6 P -","- C18 H24 Cu F6 P -","- C72 H96 Cu4 F24 P4 -","4","0.5","","Ashley M. Wright; Guang Wu; Trevor W. Hayton","Structural Characterization of a Copper Nitrosyl Complex with a {CuNO}10 Configuration","Journal of the American Chemical Society","2010","132","","14336","14337","10.1021/ja105930b","","","0.71073","MoKα","","0.0757","0.0555","","","0.1518","0.1649","","","","","","1.05","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103274","13.7393","0.0003","18.4558","0.0004","17.0955","0.0004","90","","90.2253","0.0017","90","","4334.87","0.17","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C46 H66 I N2 O P Pd -","- C46 H66 I N2 O P Pd -","- C184 H264 I4 N8 O4 P4 Pd4 -","4","1","","Xiao-Feng Wu; Helfried Neumann; Anke Spannenberg; Thomas Schulz; Haijun Jiao; Matthias Beller","Development of a General Palladium-Catalyzed Carbonylative Heck Reaction of Aryl Halides","Journal of the American Chemical Society","2010","132","","14596","14602","10.1021/ja1059922","","","0.71073","MoKα","","0.0556","0.0301","","","0.0542","0.0577","","","","","","0.818","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103275","12.7752","0.0002","14.9793","0.0003","23.3956","0.0004","90","","102.392","0.0014","90","","4372.76","0.14","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46.2 H65.3 I1.1 N2 O1.9 P Pd -","- C46.2 H65.3 I1.1 N2 O1.9 P Pd -","- C184.8 H261.2 I4.4 N8 O7.6 P4 Pd4 -","4","1","","Xiao-Feng Wu; Helfried Neumann; Anke Spannenberg; Thomas Schulz; Haijun Jiao; Matthias Beller","Development of a General Palladium-Catalyzed Carbonylative Heck Reaction of Aryl Halides","Journal of the American Chemical Society","2010","132","","14596","14602","10.1021/ja1059922","","","0.71073","MoKα","","0.0476","0.0255","","","0.0474","0.0501","","","","","","0.813","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103276","7.2548","0.0015","7.5417","0.0016","11.167","0.003","98.349","0.004","98.643","0.004","118.152","0.003","516","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H24 N6 O6 S4 -","- C12 H24 N6 O6 S4 -","- C12 H24 N6 O6 S4 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0741","0.0668","","","0.1892","0.1956","","","","","","1.149","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103277","7.6803","0.0005","20.1103","0.0013","11.9293","0.0008","90","","92.019","0.001","90","","1841.4","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 N6 O6 S8 -","- C30 H30 N6 O6 S8 -","- C60 H60 N12 O12 S16 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.074","0.0704","","","0.2126","0.217","","","","","","1.057","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103278","7.2917","0.0004","12.1492","0.0007","15.2108","0.0009","68.059","0.001","80.634","0.001","86.118","0.001","1233.2","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 N6 O6 S4 -","- C20 H24 N6 O6 S4 -","- C40 H48 N12 O12 S8 -","2","1","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0502","0.0475","","","0.1512","0.1549","","","","","","1.104","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103279","7.1188","0.0005","12.3016","0.0009","13.0373","0.0009","81.629","0.004","75.62","0.003","79.022","0.004","1079.89","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H42 N12 O12 S6 -","- C32 H42 N12 O12 S6 -","- C32 H42 N12 O12 S6 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0503","0.044","","","0.1236","0.1296","","","","","","1.045","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103280","7.5783","0.0018","11.932","0.003","24.791","0.006","90","","90.963","0.004","90","","2241.4","0.9","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H38 N6 O6 S8 -","- C38 H38 N6 O6 S8 -","- C76 H76 N12 O12 S16 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0509","0.0427","","","0.1107","0.117","","","","","","1.119","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103281","6.1289","0.0003","7.1528","0.0004","15.7075","0.0008","93.882","0.003","96.13","0.003","93.115","0.003","681.77","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H26 N8 O6 S4 -","- C22 H26 N8 O6 S4 -","- C22 H26 N8 O6 S4 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0436","0.0378","","","0.1029","0.1071","","","","","","1.044","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103282","6.1495","0.0005","7.2725","0.0006","16.2688","0.0014","96.933","0.005","91.913","0.005","93.743","0.005","720.09","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H30 N6 O6 S4 -","- C24 H30 N6 O6 S4 -","- C24 H30 N6 O6 S4 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0387","0.0347","","","0.0899","0.0917","","","","","","1.099","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103283","6.1517","0.0004","7.2099","0.0005","16.0369","0.001","94.01","0.004","96.867","0.004","93.349","0.003","702.85","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H28 N6 O6 S4 -","- C24 H28 N6 O6 S4 -","- C24 H28 N6 O6 S4 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0339","0.0304","","","0.0769","0.0793","","","","","","1.04","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103284","7.1426","0.0009","12.7521","0.0015","13.1674","0.0016","91.845","0.002","104.765","0.002","104.145","0.002","1118.8","0.2","200","2","200","2","","","","","","","","5","P 1","P 1","1","","","","- C36 H46 N12 O12 S4 -","- C36 H46 N12 O12 S4 -","- C36 H46 N12 O12 S4 -","1","1","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0463","0.0374","","","0.1002","0.1095","","","","","","1.04","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103285","6.1627","0.0004","7.2125","0.0005","16.0535","0.0011","95.263","0.001","94.758","0.001","94.611","0.001","705.31","0.08","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H30 N8 O6 S2 -","- C26 H30 N8 O6 S2 -","- C26 H30 N8 O6 S2 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.033","0.0319","","","0.0885","0.0899","","","","","","1.055","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103286","7.1367","0.0006","12.4838","0.001","12.6842","0.0011","83.869","0.002","77.676","0.002","85.366","0.002","1095.76","0.16","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C34 H44 N12 O12 S6 -","- C34 H44 N12 O12 S6 -","- C34 H44 N12 O12 S6 -","1","1","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.4428","synchrotron","","0.08","0.05","","","0.1327","0.1557","","","","","","1.187","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103287","7.573","0.002","11.721","0.004","28.831","0.009","90","","91.22","0.006","90","","2558.5","1.4","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H44 N8 O6 S8 -","- C44 H44 N8 O6 S8 -","- C88 H88 N16 O12 S16 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0829","0.0685","","","0.1877","0.1961","","","","","","1.028","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103288","6.0857","0.0008","7.2198","0.001","18.138","0.003","94.606","0.002","99.461","0.002","91.746","0.002","782.8","0.2","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H32 N6 O8 S4 -","- C26 H32 N6 O8 S4 -","- C26 H32 N6 O8 S4 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0519","0.0376","","","0.0895","0.1058","","","","","","1.069","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103289","7.1097","0.0005","12.6139","0.001","13.8091","0.0011","110.979","0.001","101.82","0.001","93.951","0.001","1118.01","0.15","200","2","200","2","","","","","","","","5","P 1","P 1","1","","","","- C36 H46 N14 O12 S4 -","- C36 H46 N14 O12 S4 -","- C36 H46 N14 O12 S4 -","1","1","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0407","0.0308","","","0.0911","0.1005","","","","","","1.052","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103290","7.575","0.0011","29.22","0.004","11.6324","0.0018","90","","90.103","0.003","90","","2574.7","0.7","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H50 N14 O6 S2 -","- C50 H50 N14 O6 S2 -","- C100 H100 N28 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0318","0.029","","","0.0792","0.0825","","","","","","1.039","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103291","7.6405","0.0004","30.4156","0.0018","11.4061","0.0006","90","","90.726","0.001","90","","2650.5","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H54 N12 O6 S2 -","- C52 H54 N12 O6 S2 -","- C104 H108 N24 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0579","0.0438","","","0.1059","0.1152","","","","","","1.026","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103292","7.6142","0.0005","29.502","0.002","11.6308","0.0008","90","","90.1","","90","","2612.7","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H52 N12 O6 S2 -","- C52 H52 N12 O6 S2 -","- C104 H104 N24 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0789","0.0441","","","0.0911","0.1051","","","","","","1.063","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103293","6.1014","0.0004","7.3115","0.0005","17.9047","0.0013","91.168","0.001","97.062","0.001","95.911","0.001","788.02","0.09","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H34 N8 O8 S2 -","- C28 H34 N8 O8 S2 -","- C28 H34 N8 O8 S2 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0383","0.0346","","","0.1004","0.1099","","","","","","1.019","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103294","7.1176","0.0005","12.5978","0.0008","12.6173","0.0008","85.85","0.001","87.616","0.001","78.77","0.001","1106.34","0.13","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 N12 O12 S4 -","- C38 H48 N12 O12 S4 -","- C38 H48 N12 O12 S4 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0384","0.0324","","","0.1005","0.1059","","","","","","1.043","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103295","7.6038","0.0005","30.2564","0.0019","11.4283","0.0007","90","","90.043","0.001","90","","2629.2","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H56 N8 O6 S2 -","- C56 H56 N8 O6 S2 -","- C112 H112 N16 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0439","0.0368","","","0.0919","0.0966","","","","","","1.037","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103296","7.6384","0.0005","30.908","0.002","11.3694","0.0007","90","","90.739","0.001","90","","2684","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H60 N6 O6 S2 -","- C58 H60 N6 O6 S2 -","- C116 H120 N12 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0598","0.0407","","","0.0905","0.0986","","","","","","1.066","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103297","6.096","0.0004","7.2875","0.0004","18.363","0.0011","97.193","0.001","98.178","0.001","92.011","0.001","799.96","0.08","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H36 N6 O8 S2 -","- C30 H36 N6 O8 S2 -","- C30 H36 N6 O8 S2 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0446","0.0333","","","0.0842","0.0907","","","","","","1.038","","","","has coordinates,has disorder","178778","2020-10-21","18:00:00","" "4103298","7.1652","0.0005","12.5807","0.001","25.0454","0.0019","94.26","0.001","91.019","0.001","91.299","0.001","2250.4","0.3","200","2","200","2","","","","","","","","5","P 1","P 1","1","","","","- C38 H50 N12 O12 S4 -","- C38 H50 N12 O12 S4 -","- C76 H100 N24 O24 S8 -","2","2","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0695","0.0459","","","0.1248","0.1433","","","","","","1.045","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103299","7.7072","0.0006","29.84","0.002","11.4574","0.0009","90","","90.748","0.001","90","","2634.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H62 N8 O6 S2 -","- C56 H62 N8 O6 S2 -","- C112 H124 N16 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0358","0.032","","","0.0818","0.0847","","","","","","1.044","","","","has coordinates","178778","2020-10-21","18:00:00","" "4103300","7.7503","0.0006","30.182","0.002","11.5482","0.0009","90","","90.583","0.002","90","","2701.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H66 N6 O6 S2 -","- C58 H66 N6 O6 S2 -","- C116 H132 N12 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0679","0.0435","","","0.096","0.1071","","","","","","1.028","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103301","7.7596","0.0005","30.2152","0.0019","11.513","0.0007","90","","90.739","0.001","90","","2699.1","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H64 N6 O6 S2 -","- C58 H64 N6 O6 S2 -","- C116 H128 N12 O12 S4 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0549","0.0377","","","0.0872","0.0957","","","","","","1.029","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103302","6.1532","0.0008","7.2222","0.001","18.283","0.002","95.493","0.002","98.852","0.002","92.424","0.002","797.78","0.17","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H38 N6 O8 S2 -","- C30 H38 N6 O8 S2 -","- C30 H38 N6 O8 S2 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0353","0.0307","","","0.0889","0.1006","","","","","","1.111","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103303","6.2754","0.0013","7.188","0.0015","15.396","0.003","91.838","0.003","95.848","0.003","96.074","0.003","686.3","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 N8 O6 S6 -","- C20 H24 N8 O6 S6 -","- C20 H24 N8 O6 S6 -","1","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0695","0.0584","","","0.1688","0.1765","","","","","","1.186","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103304","34.32","0.004","8.1261","0.0008","10.1674","0.001","90","","99.663","0.003","90","","2795.3","0.5","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C22 H26 N6 O6 S6 -","- C22 H26 N6 O6 S6 -","- C88 H104 N24 O24 S24 -","4","1","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0277","0.0259","","","0.069","0.0709","","","","","","1.054","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103305","7.6167","0.0012","31.632","0.005","11.2812","0.0017","90","","90.604","0.002","90","","2717.8","0.7","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H44 N8 O6 S11 -","- C50 H44 N8 O6 S11 -","- C100 H88 N16 O12 S22 -","2","0.5","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.0516","0.0432","","","0.113","0.119","","","","","","1.051","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103306","12.3178","0.0007","7.4997","0.0004","38.947","0.002","90","","96.277","0.002","90","","3576.3","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 N6 O8 S5 -","- C30 H36 N6 O8 S5 -","- C120 H144 N24 O32 S20 -","4","1","","Airon C. Soegiarto; Angiolina Comotti; Michael D. Ward","Controlled Orientation of Polyconjugated Guest Molecules in Tunable Host Cavities","Journal of the American Chemical Society","2010","132","","14603","14616","10.1021/ja106106d","","","0.71073","MoKα","","0.1203","0.0872","","","0.1947","0.2108","","","","","","1.076","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103307","9.2497","0.0002","12.6393","0.0003","16.3642","0.0004","90","","100.554","0.001","90","","1880.77","0.08","173","2","173","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C41 H52 Cl Co N2 O2 -","- C41 H52 Cl Co N2 O2 -","- C82 H104 Cl2 Co2 N4 O4 -","2","1","","Aubrey L. Smith; Kenneth I. Hardcastle; Jake D. Soper","Redox-Active Ligand-Mediated Oxidative Addition and Reductive Elimination at Square Planar Cobalt(III): Multielectron Reactions for Cross-Coupling","Journal of the American Chemical Society","2010","132","","14358","14360","10.1021/ja106212w","","","0.71073","MoKα","","0.0538","0.0471","","","0.1105","0.1154","","","","","","1.055","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103308","13.036","0.014","13.449","0.014","13.553","0.014","67.671","0.015","85.679","0.016","64.31","0.015","1969","4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H55 Co N2 O2 -","- C42 H55 Co N2 O2 -","- C84 H110 Co2 N4 O4 -","2","1","","Aubrey L. Smith; Kenneth I. Hardcastle; Jake D. Soper","Redox-Active Ligand-Mediated Oxidative Addition and Reductive Elimination at Square Planar Cobalt(III): Multielectron Reactions for Cross-Coupling","Journal of the American Chemical Society","2010","132","","14358","14360","10.1021/ja106212w","","","0.71073","MoKα","","0.104","0.0558","","","0.1084","0.1266","","","","","","1.004","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103309","13.1141","0.0008","23.6161","0.0014","20.7503","0.0012","90","","106.324","0.001","90","","6167.4","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C131 H180 Li4 N8 O4 -","- C131 H172 Li4 N8 O4 -","- C262 H344 Li8 N16 O8 -","2","0.5","","Yuzhong Wang; Yaoming Xie; Mariham Y. Abraham; Pingrong Wei; Henry F. Schaefer; Paul v. R. Schleyer; Gregory H. Robinson","A Viable Anionic N-Heterocyclic Dicarbene","Journal of the American Chemical Society","2010","132","","14370","14372","10.1021/ja106631r","","","0.71073","MoKα","","0.1671","0.0736","","","0.1816","0.2249","","","","","","1.084","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103310","10.3408","0.0009","10.4182","0.0009","19.7667","0.0018","86.39","0.001","79.507","0.001","72.255","0.001","1994.2","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H60 Al Li N2 O2 -","- C38 H60 Al Li N2 O2 -","- C76 H120 Al2 Li2 N4 O4 -","2","1","","Yuzhong Wang; Yaoming Xie; Mariham Y. Abraham; Pingrong Wei; Henry F. Schaefer; Paul v. R. Schleyer; Gregory H. Robinson","A Viable Anionic N-Heterocyclic Dicarbene","Journal of the American Chemical Society","2010","132","","14370","14372","10.1021/ja106631r","","","0.71073","MoKα","","0.1758","0.0618","","","0.1251","0.166","","","","","","1.004","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103311","11.7165","0.0007","17.9698","0.0011","19.7863","0.0012","90","","101.539","0.001","90","","4081.7","0.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H66 B Li N2 O2 -","- C41 H66 B Li N2 O2 -","- C164 H264 B4 Li4 N8 O8 -","4","1","","Yuzhong Wang; Yaoming Xie; Mariham Y. Abraham; Pingrong Wei; Henry F. Schaefer; Paul v. R. Schleyer; Gregory H. Robinson","A Viable Anionic N-Heterocyclic Dicarbene","Journal of the American Chemical Society","2010","132","","14370","14372","10.1021/ja106631r","","","0.71073","MoKα","","0.0999","0.0551","","","0.1386","0.1647","","","","","","1.005","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103312","13.43","0.002","20.533","0.003","34.121","0.005","90","","90","","90","","9409","2","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C46 H74 B Li N4 -","- C46 H74 B Li N4 -","- C368 H592 B8 Li8 N32 -","8","1","","Yuzhong Wang; Yaoming Xie; Mariham Y. Abraham; Pingrong Wei; Henry F. Schaefer; Paul v. R. Schleyer; Gregory H. Robinson","A Viable Anionic N-Heterocyclic Dicarbene","Journal of the American Chemical Society","2010","132","","14370","14372","10.1021/ja106631r","","","0.71073","MoKα","","0.2127","0.0703","","","0.1504","0.2086","","","","","","1.001","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103313","9.717","0.001","9.211","0.0009","6.035","0.0005","90","","90","","90","","540.15","0.09","150","2","150","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- C5 H4 O4 -","- C5 H4 O4 -","- C20 H16 O16 -","4","0.25","","James C. Griffith; Kevin M. Jones; Sylvain Picon; Michael J. Rawling; Benson M. Kariuki; Matthew Campbell; Nicholas C. O. Tomkinson","Alkene Syn Dihydroxylation with Malonoyl Peroxides","Journal of the American Chemical Society","2010","132","","14409","14411","10.1021/ja1066674","","","0.71073","MoKα","","0.039","0.0324","","","0.0807","0.0851","","","","","","1.105","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103314","9.448","0.0007","6.465","0.0005","11.59","0.0011","90","","95.283","0.003","90","","704.93","0.1","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 O4 -","- C7 H8 O4 -","- C28 H32 O16 -","4","1","","James C. Griffith; Kevin M. Jones; Sylvain Picon; Michael J. Rawling; Benson M. Kariuki; Matthew Campbell; Nicholas C. O. Tomkinson","Alkene Syn Dihydroxylation with Malonoyl Peroxides","Journal of the American Chemical Society","2010","132","","14409","14411","10.1021/ja1066674","","","0.71073","MoKα","","0.1027","0.0602","","","0.1279","0.1487","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103315","6.492","0.0007","6.138","0.0006","7.61","0.0008","90","","91.908","0.004","90","","303.07","0.05","293","2","293","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C6 H6 O4 -","- C6 H6 O4 -","- C12 H12 O8 -","2","0.5","","James C. Griffith; Kevin M. Jones; Sylvain Picon; Michael J. Rawling; Benson M. Kariuki; Matthew Campbell; Nicholas C. O. Tomkinson","Alkene Syn Dihydroxylation with Malonoyl Peroxides","Journal of the American Chemical Society","2010","132","","14409","14411","10.1021/ja1066674","","","0.71073","MoKα","","0.0541","0.0465","","","0.1095","0.1127","","","","","","1.069","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103316","10.99","0.002","12.734","0.002","18.542","0.002","90","","101.8","0.02","90","","2540.1","0.7","100","2","100","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","hexacarbonyldi-μ-chloro(μ-4,5-bis(trimethylsilyl)pyridazine-κN1:κN2) dirhenium","","- C16 H20 Cl2 N2 O6 Re2 Si2 -","- C16 H20 Cl2 N2 O6 Re2 Si2 -","- C64 H80 Cl8 N8 O24 Re8 Si8 -","4","0.5","","Elsa Quartapelle Procopio; Matteo Mauro; Monica Panigati; Daniela Donghi; Pierluigi Mercandelli; Angelo Sironi; Giuseppe D'Alfonso; Luisa De Cola","Highly Emitting Concomitant Polymorphic Crystals of a Dinuclear Rhenium Complex","Journal of the American Chemical Society","2010","132","","14397","14399","10.1021/ja106772v","","","0.71073","MoKα","","0.0239","0.0194","","","0.0348","0.0359","","","","","","1.052","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103317","21.509","0.002","6.355","0.002","36.997","0.002","90","","90","","90","","5057.1","1.7","295","2","295","2","","","","","","","","7","P n a 21","P 2c -2n","33","","hexacarbonyldi-μ-chloro(μ-4,5-bis(trimethylsilyl)pyridazine-κN1:κN2) dirhenium","","- C16 H20 Cl2 N2 O6 Re2 Si2 -","- C16 H20 Cl2 N2 O6 Re2 Si2 -","- C128 H160 Cl16 N16 O48 Re16 Si16 -","8","2","","Elsa Quartapelle Procopio; Matteo Mauro; Monica Panigati; Daniela Donghi; Pierluigi Mercandelli; Angelo Sironi; Giuseppe D'Alfonso; Luisa De Cola","Highly Emitting Concomitant Polymorphic Crystals of a Dinuclear Rhenium Complex","Journal of the American Chemical Society","2010","132","","14397","14399","10.1021/ja106772v","","","0.71073","MoKα","","0.04","0.0344","","","0.0864","0.0917","","","","","","1.066","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103318","9.84102","0.00009","9.25426","0.00006","10.86112","0.00011","90","","108.426","0.001","90","","938.428","0.015","100","2","100","2","","","","","","","Graham Pattison","4","P 1 21 1","P 2yb","4","","","","- C24 H21 F N2 -","- C24 H21 F N2 -","- C48 H42 F2 N4 -","2","1","","Graham Pattison; Guillaume Piraux; Hon Wai Lam","Enantioselective Rhodium-Catalyzed Addition of Arylboronic Acids to Alkenylheteroarenes","Journal of the American Chemical Society","2010","132","","14373","14375","10.1021/ja106809p","","","1.5418","CuKα","","0.036","0.0352","","","0.0917","0.0925","","","","","","1.02","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103319","7.7828","0.0001","19.4165","0.0004","24.7658","0.0005","90","","90","","90","","3742.48","0.12","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H34 N6 O7 S7.77 -","- C33 H34 N6 O7 S7.771 -","- C132 H136 N24 O28 S31.084 -","4","1","","Justin Kim; Mohammad Movassaghi","General Approach to Epipolythiodiketopiperazine Alkaloids: Total Synthesis of (+)-Chaetocins A and C and (+)-12,12'-Dideoxychetracin A","Journal of the American Chemical Society","2010","132","","14376","14378","10.1021/ja106869s","","","1.54178","CuKα","","0.0612","0.0569","","","0.1527","0.1568","","","","","","1.043","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103320","13.502","0.003","13.892","0.003","40.821","0.008","90","","90","","90","","7657","3","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C80 H64 B3 Cl4.5 N O9 -","- C80 H64 B3 Cl4.5 N O9 -","- C320 H256 B12 Cl18 N4 O36 -","4","1","","Gang Hu; Anil K. Gupta; Rui H. Huang; Munmun Mukherjee; William D. Wulff","Substrate-Induced Covalent Assembly of a Chemzyme and Crystallographic Characterization of a Chemzyme-Substrate Complex","Journal of the American Chemical Society","2010","132","","14669","14675","10.1021/ja1070224","","x-ray","0.71073","MoKα","","0.1296","0.0936","","","0.261","0.2928","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103321","18.536","0.004","29.114","0.006","13.34","0.003","90","","90","","90","","7199","3","173","2","173","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C81.5 H69 B3 Cl4.5 N2 O9 -","- C82 H69 B3 Cl5 N2 O9 -","- C328 H276 B12 Cl20 N8 O36 -","4","1","","Gang Hu; Anil K. Gupta; Rui H. Huang; Munmun Mukherjee; William D. Wulff","Substrate-Induced Covalent Assembly of a Chemzyme and Crystallographic Characterization of a Chemzyme-Substrate Complex","Journal of the American Chemical Society","2010","132","","14669","14675","10.1021/ja1070224","","","0.71073","MoKα","","0.1446","0.0922","","","0.2384","0.2508","","","","","","1.41","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103322","15.4911","0.0007","8.1017","0.0004","23.2701","0.0011","90","","90","","90","","2920.5","0.2","200","2","200","2","","","","","","","","5","P c a 21","P 2c -2ac","29","Pd-complex","Pd-complex","","- C26 H25 N3 O7 Pd -","- C23 H18 N3 O4 Pd -","- C92 H72 N12 O16 Pd4 -","4","1","","Williamson Oloo; Peter Y. Zavalij; Jing Zhang; Eugene Khaskin; Andrei N. Vedernikov","Preparation and C-X Reductive Elimination Reactivity of Monoaryl PdIV-X Complexes in Water (X = OH, OH2, Cl, Br)","Journal of the American Chemical Society","2010","132","","14400","14402","10.1021/ja107185w","","","0.71073","MoKα","","0.0444","0.0343","","","0.0666","0.0695","","","","","","1","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103323","13.097","0.0016","17.566","0.002","13.4039","0.0016","90","","107.34","0.002","90","","2943.6","0.6","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Pd-complex acetate","Pd-complex acetate, acetone","","- C27.775 H28.55 N3 O5.925 Pd -","- C25 H23 N3 O5 Pd -","- C100 H92 N12 O20 Pd4 -","4","1","","Williamson Oloo; Peter Y. Zavalij; Jing Zhang; Eugene Khaskin; Andrei N. Vedernikov","Preparation and C-X Reductive Elimination Reactivity of Monoaryl PdIV-X Complexes in Water (X = OH, OH2, Cl, Br)","Journal of the American Chemical Society","2010","132","","14400","14402","10.1021/ja107185w","","","0.71073","MoKα","","0.0404","0.0357","","","0.0783","0.0798","","","","","","1.001","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103324","17.0379","0.0014","8.026","0.0007","18.886","0.0016","90","","90","","90","","2582.6","0.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","Pd-complex","Pd-complex","","- C23 H31 N3 O11 Pd -","- C23 H31 N3 O11 Pd -","- C92 H124 N12 O44 Pd4 -","4","1","","Williamson Oloo; Peter Y. Zavalij; Jing Zhang; Eugene Khaskin; Andrei N. Vedernikov","Preparation and C-X Reductive Elimination Reactivity of Monoaryl PdIV-X Complexes in Water (X = OH, OH2, Cl, Br)","Journal of the American Chemical Society","2010","132","","14400","14402","10.1021/ja107185w","","","0.71073","MoKα","","0.0269","0.0229","","","0.0454","0.0469","","","","","","1","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103325","14.4824","0.0012","12.8318","0.0011","16.8071","0.0014","90","","113.782","0.0013","90","","2858.1","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Pd-complex","Pd-complex","","- C27 H23 F6 N3 O8 Pd -","- C27 H23 F6 N3 O8 Pd -","- C108 H92 F24 N12 O32 Pd4 -","4","1","","Williamson Oloo; Peter Y. Zavalij; Jing Zhang; Eugene Khaskin; Andrei N. Vedernikov","Preparation and C-X Reductive Elimination Reactivity of Monoaryl PdIV-X Complexes in Water (X = OH, OH2, Cl, Br)","Journal of the American Chemical Society","2010","132","","14400","14402","10.1021/ja107185w","","","0.71073","MoKα","","0.0414","0.032","","","0.0656","0.0681","","","","","","1","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103326","8.4848","0.0005","8.6172","0.0005","10.4326","0.0007","79.5984","0.0009","88.5172","0.001","86.6206","0.0009","748.85","0.08","150","2","150","2","","","","","","","","5","P 1","P 1","1","Pd-complex","Pd-complex","","- C24 H39 N3 O14 Pd -","- C24 H39 N3 O14 Pd -","- C24 H39 N3 O14 Pd -","1","1","","Williamson Oloo; Peter Y. Zavalij; Jing Zhang; Eugene Khaskin; Andrei N. Vedernikov","Preparation and C-X Reductive Elimination Reactivity of Monoaryl PdIV-X Complexes in Water (X = OH, OH2, Cl, Br)","Journal of the American Chemical Society","2010","132","","14400","14402","10.1021/ja107185w","","","0.71073","MoKα","","0.0208","0.0208","","","0.0492","0.0492","","","","","","1","","","","has coordinates","211332","2020-10-21","18:00:00","" "4103327","9.8089","0.0006","8.4633","0.0005","13.9252","0.0009","90","","108.657","0.003","90","","1095.26","0.12","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H25 F3 N2 O3 -","- C25 H25 F3 N2 O3 -","- C50 H50 F6 N4 O6 -","2","1","","Lindsay M. Repka; Jane Ni; Sarah E. Reisman","Enantioselective Synthesis of Pyrroloindolines by a Formal [3 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2010","132","","14418","14420","10.1021/ja107328g","","","0.71073","MoKα","","0.0561","0.0393","","","0.0443","0.0463","","","","","","1.14","","","","has coordinates","211332","2020-10-21","18:00:00","" "4103328","13.9506","0.0005","7.2073","0.0002","16.3208","0.0005","90","","107.99","0.001","90","","1560.77","0.09","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 F3 N2 O3 -","- C16 H17 F3 N2 O3 -","- C64 H68 F12 N8 O12 -","4","1","","Lindsay M. Repka; Jane Ni; Sarah E. Reisman","Enantioselective Synthesis of Pyrroloindolines by a Formal [3 + 2] Cycloaddition Reaction","Journal of the American Chemical Society","2010","132","","14418","14420","10.1021/ja107328g","","","0.71073","MoKα","","0.0757","0.0469","","","0.0737","0.0765","","","","","","1.94","","","","has coordinates","211332","2020-10-21","18:00:00","" "4103329","6.891","0.003","13.921","0.005","8.2","0.003","90","","105.658","0.006","90","","757.4","0.5","125","2","125","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H22 O S -","- C18 H22 O S -","- C36 H44 O2 S2 -","2","1","","Jun Hee Lee; Yandong Zhang; Samuel J. Danishefsky","A Straightforward Route to Functionalizedtrans-Diels-Alder Motifs","Journal of the American Chemical Society","2010","132","","14330","14333","10.1021/ja1073855","","","0.71073","MoKα","","0.094","0.058","","","0.1217","0.1368","","","","","","1.024","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103330","10.757","0.003","22.315","0.005","7.0957","0.0016","90","","94.897","0.003","90","","1697.1","0.7","125","2","125","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H24 O2 S -","- C19 H24 O2 S -","- C76 H96 O8 S4 -","4","1","","Jun Hee Lee; Yandong Zhang; Samuel J. Danishefsky","A Straightforward Route to Functionalizedtrans-Diels-Alder Motifs","Journal of the American Chemical Society","2010","132","","14330","14333","10.1021/ja1073855","","","0.71073","MoKα","","0.1757","0.0867","","","0.1657","0.1964","","","","","","1.154","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103331","17.578","0.003","6.3654","0.001","17.405","0.003","90","","110.119","0.002","90","","1828.6","0.5","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H28 O S -","- C21 H28 O S -","- C84 H112 O4 S4 -","4","1","","Jun Hee Lee; Yandong Zhang; Samuel J. Danishefsky","A Straightforward Route to Functionalizedtrans-Diels-Alder Motifs","Journal of the American Chemical Society","2010","132","","14330","14333","10.1021/ja1073855","","","0.71073","MoKα","","0.049","0.0387","","","0.1076","0.116","","","","","","1.027","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103332","6.7742","0.0017","10.931","0.003","12.355","0.003","100.562","0.004","105.036","0.004","90.395","0.004","867.2","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H24 O4 S -","- C19 H24 O4 S -","- C38 H48 O8 S2 -","2","1","","Jun Hee Lee; Yandong Zhang; Samuel J. Danishefsky","A Straightforward Route to Functionalizedtrans-Diels-Alder Motifs","Journal of the American Chemical Society","2010","132","","14330","14333","10.1021/ja1073855","","","0.71073","MoKα","","0.0567","0.0414","","","0.1043","0.1123","","","","","","1.063","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103333","10.1764","0.0015","13.225","0.002","13.805","0.002","89.684","0.002","80.014","0.002","89.799","0.002","1829.7","0.5","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 F3 N O5 Pd -","- C18 H16 F3 N O5 Pd -","- C72 H64 F12 N4 O20 Pd4 -","4","2","","Yingda Ye; Nicholas D. Ball; Jeff W. Kampf; Melanie S. Sanford","Oxidation of a Cyclometalated Pd(II) Dimer with ""CF3+"": Formation and Reactivity of a Catalytically Competent Monomeric Pd(IV) Aquo Complex","Journal of the American Chemical Society","2010","132","","14682","14687","10.1021/ja107780w","","","0.71073","MoKα","","0.046","0.0426","","","0.1077","0.11","","","","","","1.102","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103334","22.6125","0.0009","10.5065","0.0004","24.5966","0.0012","90","","100.141","0.004","90","","5752.3","0.4","90","2","90","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C59 H75 N2 O2 P2 Si3 Y -","- C59 H75 N2 O2 P2 Si3 Y -","- C236 H300 N8 O8 P8 Si12 Y4 -","4","1","","David P. Mills; Lyndsay Soutar; William Lewis; Alexander J. Blake; Stephen T. Liddle","Regioselective C-H Activation and Sequential C-C and C-O Bond Formation Reactions of Aryl Ketones Promoted by an Yttrium Carbene","Journal of the American Chemical Society","2010","132","","14379","14381","10.1021/ja107958u","","","1.5418","CuKα","","0.0918","0.0884","","","0.259","0.262","","","","","","1.18","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103335","13.2474","0.0004","13.428","0.0004","22.4888","0.0007","73.018","0.003","77.028","0.003","64.946","0.003","3442.5","0.2","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C77.5 H83 N2 O3 P2 Si3 Y -","- C74 H79 N2 O3 P2 Si3 Y -","- C148 H158 N4 O6 P4 Si6 Y2 -","2","1","","David P. Mills; Lyndsay Soutar; William Lewis; Alexander J. Blake; Stephen T. Liddle","Regioselective C-H Activation and Sequential C-C and C-O Bond Formation Reactions of Aryl Ketones Promoted by an Yttrium Carbene","Journal of the American Chemical Society","2010","132","","14379","14381","10.1021/ja107958u","","","1.54184","CuKα","","0.0603","0.0475","","","0.1179","0.1234","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103336","22.828","0.002","10.4486","0.0011","26.112","0.003","90","","111.67","0.002","90","","5788.1","1","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C59 H62 I N2 O2.5 P2 Si2 Y -","- C57 H58 I N2 O2 P2 Si2 Y -","- C228 H232 I4 N8 O8 P8 Si8 Y4 -","4","1","","David P. Mills; Lyndsay Soutar; William Lewis; Alexander J. Blake; Stephen T. Liddle","Regioselective C-H Activation and Sequential C-C and C-O Bond Formation Reactions of Aryl Ketones Promoted by an Yttrium Carbene","Journal of the American Chemical Society","2010","132","","14379","14381","10.1021/ja107958u","","","0.71073","MoKα","","0.0668","0.0496","","","0.124","0.13","","","","","","0.97","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103337","11.3241","0.0003","21.3836","0.0007","23.4444","0.0009","90","","95.25","0.003","90","","5653.2","0.3","90","2","90","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C58.25 H72 I N2 O2 P2 Si2 Y -","- C53 H66 I N2 O2 P2 Si2 Y -","- C212 H264 I4 N8 O8 P8 Si8 Y4 -","4","1","","David P. Mills; Lyndsay Soutar; William Lewis; Alexander J. Blake; Stephen T. Liddle","Regioselective C-H Activation and Sequential C-C and C-O Bond Formation Reactions of Aryl Ketones Promoted by an Yttrium Carbene","Journal of the American Chemical Society","2010","132","","14379","14381","10.1021/ja107958u","","","1.5418","CuKα","","0.1029","0.0854","","","0.2126","0.2183","","","","","","1.167","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103338","15.3674","0.0011","19.537","0.0014","15.939","0.0011","90","","95.631","0.002","90","","4762.3","0.6","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 O2 -","- C32 H28 O2 -","- C256 H224 O16 -","8","2","","David P. Mills; Lyndsay Soutar; William Lewis; Alexander J. Blake; Stephen T. Liddle","Regioselective C-H Activation and Sequential C-C and C-O Bond Formation Reactions of Aryl Ketones Promoted by an Yttrium Carbene","Journal of the American Chemical Society","2010","132","","14379","14381","10.1021/ja107958u","","","0.71073","MoKα","","0.0874","0.048","","","0.098","0.1155","","","","","","0.998","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103339","12.801","0.002","7.5878","0.0013","12.977","0.002","90","","107.794","0.002","90","","1200.2","0.3","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 N O -","- C14 H17 N O -","- C56 H68 N4 O4 -","4","1","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.0482","0.0399","","","0.1001","0.1062","","","","","","1.06","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103340","13.694","0.002","7.116","0.0012","26.1","0.004","90","","90","","90","","2543.4","0.7","90","","90","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H16 Br N O -","- C14 H16 Br N O -","- C112 H128 Br8 N8 O8 -","8","2","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.0339","0.0292","","","0.0742","0.0865","","","","","","1.026","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103341","16.873","0.0016","11.1054","0.0011","9.3565","0.0009","90","","118.643","0.001","90","","1538.7","0.3","120","","120","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C17 H21 N O4 -","- C17 H21 N O4 -","- C68 H84 N4 O16 -","4","1","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.0285","0.028","","","0.0723","0.0727","","","","","","1.032","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103342","10.1186","0.0011","10.389","0.0011","23.513","0.003","90","","90","","90","","2471.7","0.5","120","","120","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H38 N2 O7 -","- C24 H38 N2 O7 -","- C96 H152 N8 O28 -","4","1","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.0433","0.0402","","","0.1018","0.1042","","","","","","1.044","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103343","8.523","0.004","9.727","0.004","15.532","0.006","102.381","0.007","103.948","0.006","90.253","0.006","1218.5","0.9","90","","90","","","","","","","","","6","P -1","-P 1","2","","","","- C9 H12 Br2 F3 N O -","- C9 H12 Br2 F3 N O -","- C36 H48 Br8 F12 N4 O4 -","4","2","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.1001","0.0648","","","0.1701","0.1965","","","","","","1.023","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103344","8.7129","0.0014","10.4699","0.0016","12.4154","0.0019","90","","92.979","0.002","90","","1131","0.3","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 Br N O3 -","- C10 H14 Br N O3 -","- C40 H56 Br4 N4 O12 -","4","1","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.1127","0.0955","","","0.1921","0.2007","","","","","","1.138","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103345","7.8838","0.001","14.8491","0.0019","12.2397","0.0016","90","","94.455","0.002","90","","1428.5","0.3","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 Br N O3 -","- C15 H16 Br N O3 -","- C60 H64 Br4 N4 O12 -","4","1","","Masahiro Hosoya; Yuko Otani; Masatoshi Kawahata; Kentaro Yamaguchi; Tomohiko Ohwada","Water-Stable Helical Structure of Tertiary Amides of Bicyclic β-Amino Acid Bearing 7-Azabicyclo[2.2.1]heptane. Full Control of Amide Cis-Trans Equilibrium by Bridgehead Substitution","Journal of the American Chemical Society","2010","132","","14780","14789","10.1021/ja1017877","","","0.71073","MoKα","","0.0332","0.0257","","","0.0612","0.064","","","","","","1.046","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103346","12.4707","0.0004","12.6792","0.0004","16.9635","0.0005","109.536","0.0018","100.808","0.002","91.254","0.002","2472.61","0.14","193","2","193","2","","","","","","","","10","P -1","-P 1","2","","","","- C50 H48 B Cl2 F4 Fe Ni O2 P3 S2 -","- C50 H48 B Cl2 F4 Fe Ni O2 P3 S2 -","- C100 H96 B2 Cl4 F8 Fe2 Ni2 O4 P6 S4 -","2","1","","Bryan E. Barton; Thomas B. Rauchfuss","Hydride-Containing Models for the Active Site of the Nickel-Iron Hydrogenases","Journal of the American Chemical Society","2010","132","","14877","14885","10.1021/ja105312p","","","0.71073","MoKα","","0.0849","0.0452","","","0.0857","0.0986","","","","","","0.996","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103347","44.3453","0.0008","44.3453","0.0008","44.3453","0.0008","90","","90","","90","","87205","3","95","2","95","2","","","","","","","","5","F -4 3 m","F -4 2 3","216","UMCM-3","","","- C99 H51 O32.5 S3 Zn10 -","- C99 H51 O32.5 S3 Zn10 -","- C792 H408 O260 S24 Zn80 -","8","0.0833333","","Kyoungmoo Koh; Antek G. Wong-Foy; Adam J. Matzger","Coordination Copolymerization Mediated by Zn4O(CO2R)6 Metal Clusters: a Balancing Act between Statistics and Geometry","Journal of the American Chemical Society","2010","132","","15005","15010","10.1021/ja1065009","","","1.5418","CuKα","","0.1032","0.0411","","","0.0893","0.1059","","","","","","0.839","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103348","25.0572","0.0005","25.4805","0.0005","32.9266","0.0006","90","","90","","90","","21022.6","0.7","95","2","95","2","","","","","","","","5","P n m a","-P 2ac 2n","62","UMCM-4","","","- C33 H18 N O13 Zn4 -","- C33 H18 N O13 Zn4 -","- C264 H144 N8 O104 Zn32 -","8","1","","Kyoungmoo Koh; Antek G. Wong-Foy; Adam J. Matzger","Coordination Copolymerization Mediated by Zn4O(CO2R)6 Metal Clusters: a Balancing Act between Statistics and Geometry","Journal of the American Chemical Society","2010","132","","15005","15010","10.1021/ja1065009","","","1.54187","CuKα","","0.101","0.0552","","","0.1441","0.1571","","","","","","0.949","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103349","21.3132","0.0007","12.8607","0.0004","25.0256","0.0009","90","","106.462","0.001","90","","6578.4","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C71 H81.5 B F1.5 Fe N3 -","- C71 H81.5 B F1.5 Fe N3 -","- C284 H326 B4 F6 Fe4 N12 -","4","1","","Aaron M. Tondreau; Carsten Milsmann; Andrew D. Patrick; Helen M. Hoyt; Emil Lobkovsky; Karl Wieghardt; Paul J. Chirik","Synthesis and Electronic Structure of Cationic, Neutral, and Anionic Bis(imino)pyridine Iron Alkyl Complexes: Evaluation of Redox Activity in Single-Component Ethylene Polymerization Catalysts","Journal of the American Chemical Society","2010","132","","15046","15059","10.1021/ja106575b","","","0.71073","MoKα","","0.0737","0.0487","","","0.1338","0.1453","","","","","","1.017","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103350","12.5472","0.0017","21.249","0.003","20.871","0.003","90","","92.253","0.004","90","","5560.2","1.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H84 Fe Li N5 O3 -","- C50 H84 Fe Li N5 O3 -","- C200 H336 Fe4 Li4 N20 O12 -","4","1","","Aaron M. Tondreau; Carsten Milsmann; Andrew D. Patrick; Helen M. Hoyt; Emil Lobkovsky; Karl Wieghardt; Paul J. Chirik","Synthesis and Electronic Structure of Cationic, Neutral, and Anionic Bis(imino)pyridine Iron Alkyl Complexes: Evaluation of Redox Activity in Single-Component Ethylene Polymerization Catalysts","Journal of the American Chemical Society","2010","132","","15046","15059","10.1021/ja106575b","","","0.71073","MoKα","","0.0841","0.0562","","","0.1563","0.1693","","","","","","1.104","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103351","18.6102","0.0012","10.5514","0.0007","26.7885","0.0018","90","","109.125","0.002","90","","4970","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H66 B Fe N3 -","- C58 H66 B Fe N3 -","- C232 H264 B4 Fe4 N12 -","4","1","","Aaron M. Tondreau; Carsten Milsmann; Andrew D. Patrick; Helen M. Hoyt; Emil Lobkovsky; Karl Wieghardt; Paul J. Chirik","Synthesis and Electronic Structure of Cationic, Neutral, and Anionic Bis(imino)pyridine Iron Alkyl Complexes: Evaluation of Redox Activity in Single-Component Ethylene Polymerization Catalysts","Journal of the American Chemical Society","2010","132","","15046","15059","10.1021/ja106575b","","","0.71073","MoKα","","0.0986","0.0509","","","0.108","0.1253","","","","","","1.012","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103352","10.1812","0.0002","25.7846","0.0006","11.8057","0.0003","90","","101.867","0.001","90","","3032.97","0.12","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H33 N O7 S2 -","- C32 H33 N O7 S2 -","- C128 H132 N4 O28 S8 -","4","1","","Malek Nechab; Damien Campolo; Julien Maury; Patricia Perfetti; Nicolas Vanthuyne; Didier Siri; Michèle P. Bertrand","Memory of Chirality in Cascade Rearrangements of Enediynes","Journal of the American Chemical Society","2010","132","","14742","14744","10.1021/ja106668d","","x-ray","0.71073","MoKα","","0.1602","0.0728","","","0.1962","0.2628","","","","","","1.06","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103353","6.9168","0.0002","17.2861","0.0004","20.1345","0.0007","90","","90","","90","","2407.37","0.12","293","2","293","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H23 N O4 S -","- C28 H23 N O4 S -","- C112 H92 N4 O16 S4 -","4","1","","Malek Nechab; Damien Campolo; Julien Maury; Patricia Perfetti; Nicolas Vanthuyne; Didier Siri; Michèle P. Bertrand","Memory of Chirality in Cascade Rearrangements of Enediynes","Journal of the American Chemical Society","2010","132","","14742","14744","10.1021/ja106668d","","x-ray","0.71073","MoKα","","0.1083","0.0569","","","0.1145","0.1339","","","","","","1.082","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103354","12.1663","0.0005","7.4545","0.0002","13.529","0.0007","90","","92.885","0.001","90","","1225.44","0.09","293","2","293","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C28 H27 N O6 S -","- C28 H27 N O6 S -","- C56 H54 N2 O12 S2 -","2","1","","Malek Nechab; Damien Campolo; Julien Maury; Patricia Perfetti; Nicolas Vanthuyne; Didier Siri; Michèle P. Bertrand","Memory of Chirality in Cascade Rearrangements of Enediynes","Journal of the American Chemical Society","2010","132","","14742","14744","10.1021/ja106668d","","x-ray","0.71073","MoKα","","0.1792","0.1177","","","0.1802","0.209","","","","","","1.234","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103355","10.6454","0.0009","19.1241","0.0015","16.5399","0.0013","90","","105.247","0.002","90","","3248.7","0.5","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H44 B I N2 -","- C33 H44 B I N2 -","- C132 H176 B4 I4 N8 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.0656","0.0392","","","0.0963","0.1085","","","","","","1.085","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103356","9.4185","0.0011","13.9059","0.0017","20.077","0.002","90","","98.302","0.002","90","","2602","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 B N5 -","- C27 H38 B N5 -","- C108 H152 B4 N20 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.0816","0.0555","","","0.1349","0.1454","","","","","","1.12","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103357","10.716","0.002","14.021","0.003","18.186","0.003","90","","96.989","0.004","90","","2712.1","0.9","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H38 B N3 O -","- C28 H38 B N3 O -","- C112 H152 B4 N12 O4 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.107","0.0581","","","0.1326","0.1514","","","","","","0.957","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103358","11.3135","0.0015","13.8029","0.0019","17.92","0.003","90","","93.084","0.003","90","","2794.3","0.7","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H38 B N3 S -","- C28 H38 B N3 S -","- C112 H152 B4 N12 S4 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.0903","0.0724","","","0.2078","0.2159","","","","","","1.727","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103359","9.4529","0.0009","14.1517","0.0013","19.4564","0.0018","90","","97.994","0.002","90","","2577.5","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 B N3 O2 -","- C27 H38 B N3 O2 -","- C108 H152 B4 N12 O8 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.0746","0.0523","","","0.1353","0.1494","","","","","","1.148","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103360","9.4489","0.0009","14.8309","0.0014","19.1914","0.0019","90","","98.389","0.002","90","","2660.6","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 B N3 O2 -","- C27 H38 B N3 O2 -","- C108 H152 B4 N12 O8 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.084","0.0622","","","0.185","0.1946","","","","","","1.576","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103361","10.771","0.004","16.38","0.006","19.418","0.007","89.496","0.006","75.418","0.006","87.161","0.007","3311","2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H45 B N2 O3 S -","- C34 H45 B N2 O3 S -","- C136 H180 B4 N8 O12 S4 -","4","2","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.2495","0.0659","","","0.1395","0.1785","","","","","","0.747","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103362","13.4194","0.001","13.9514","0.0011","18.1446","0.0014","90","","94.433","0.002","90","","3386.9","0.5","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H43 B N6 O2 S -","- C34 H43 B N6 O2 S -","- C136 H172 B4 N24 O8 S4 -","4","1","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.0825","0.057","","","0.1414","0.1561","","","","","","1.183","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103363","10.7146","0.0013","12.8217","0.0016","19.089","0.002","90","","90","","90","","2622.4","0.5","150","2","150","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C27 H35 I N2 -","- C27 H35 I N2 -","- C108 H140 I4 N8 -","4","0.5","","Andrey Solovyev; Qianli Chu; Steven J. Geib; Louis Fensterbank; Max Malacria; Emmanuel Lacôte; Dennis P. Curran","Substitution Reactions at Tetracoordinate Boron: Synthesis of N-Heterocyclic Carbene Boranes with Boron-Heteroatom Bonds","Journal of the American Chemical Society","2010","132","","15072","15080","10.1021/ja107025y","","","0.71073","MoKα","","0.0357","0.0304","","","0.1042","0.1102","","","","","","1.095","","","","has coordinates","268283","2021-08-30","06:31:21","" "4103364","9.199","0.002","14.76","0.003","31.273","0.007","90","","90","","90","","4246.2","1.6","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C45 H56 Cl N2 O3 P2 Rh -","- C45 H56 Cl N2 O3 P2 Rh -","- C180 H224 Cl4 N8 O12 P8 Rh4 -","4","1","","Amanda D. Worthy; Candice L. Joe; Thomas E. Lightburn; Kian L. Tan","Application of a Chiral Scaffolding Ligand in Catalytic Enantioselective Hydroformylation","Journal of the American Chemical Society","2010","132","","14757","14759","10.1021/ja107433h","","","0.71073","MoKα","","0.0706","0.0511","","","0.0858","0.0916","","","","","","1.054","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103365","9.0469","0.0012","17.621","0.003","17.863","0.002","99.309","0.002","98.314","0.002","100.804","0.002","2715","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H34 O4 S2 -","- C32 H34 O4 S2 -","- C128 H136 O16 S8 -","4","2","","Kazunori Sugiyasu; Yoshihito Honsho; Ryan M. Harrison; Akira Sato; Takeshi Yasuda; Shu Seki; Masayuki Takeuchi","A Self-Threading Polythiophene: Defect-Free Insulated Molecular Wires Endowed with Long Effective Conjugation Length","Journal of the American Chemical Society","2010","132","","14754","14756","10.1021/ja107444m","","","0.71073","MoKα","","0.0415","0.036","","","0.0945","0.0994","","","","","","1.028","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103366","21.216","0.004","8.2816","0.0017","13.126","0.003","90","","98.71","0.03","90","","2279.7","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Al Br Cl4 Sb2 Te2 -","- Al Br Cl4 Sb2 Te2 -","- Al8 Br8 Cl32 Sb16 Te16 -","8","1","","Kanishka Biswas; Qichun Zhang; In Chung; Jung-Hwan Song; John Androulakis; Arthur J. Freeman; Mercouri G. Kanatzidis","Synthesis in Ionic Liquids: [Bi2Te2Br](AlCl4), a Direct Gap Semiconductor with a Cationic Framework","Journal of the American Chemical Society","2010","132","","14760","14762","10.1021/ja107483g","","","0.71073","MoKα","","0.0412","0.0245","","","0.0625","0.068","","","","","","1.012","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103367","21.2247","0.0013","8.4778","0.0003","13.2264","0.001","90","","99.28","0.005","90","","2348.8","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Al Bi2 Br Cl4 Te2 -","- Al Bi2 Br Cl4 Te2 -","- Al8 Bi16 Br8 Cl32 Te16 -","8","1","","Kanishka Biswas; Qichun Zhang; In Chung; Jung-Hwan Song; John Androulakis; Arthur J. Freeman; Mercouri G. Kanatzidis","Synthesis in Ionic Liquids: [Bi2Te2Br](AlCl4), a Direct Gap Semiconductor with a Cationic Framework","Journal of the American Chemical Society","2010","132","","14760","14762","10.1021/ja107483g","","","0.71073","MoKα","","0.0664","0.0435","","","0.1104","0.1229","","","","","","1.055","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103368","14.1339","0.0017","22.245","0.003","6.8288","0.0008","90","","94.726","0.002","90","","2139.7","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(triaminoguanidiunium) (5Z,5'Z)-4,4'-(ethane-1,2-diyl)bis(5-(nitroimino) -4,5-dihydrotetrazol-1-ide) hydrate","","- C6 H24 N24 O5 -","- C6 H24 N24 O5 -","- C24 H96 N96 O20 -","4","1","","Young-Hyuk Joo; Jean'ne M. Shreeve","Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates","Journal of the American Chemical Society","2010","132","","15081","15090","10.1021/ja107729c","","","0.71073","MoKα","","0.0713","0.0426","","","0.0951","0.109","","","","","","1.007","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103369","26.767","0.006","4.8803","0.001","10.707","0.002","90","","92.639","0.003","90","","1397.2","0.5","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(1,1'-(ethane-1,2-diylbis(oxy))bis(1H-tetrazole-1(4H)-yl-5(4H)-ylidene)) dinitramide dihydrate","","- C4 H10 N12 O8 -","- C4 H10 N12 O8 -","- C16 H40 N48 O32 -","4","0.5","","Young-Hyuk Joo; Jean'ne M. Shreeve","Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates","Journal of the American Chemical Society","2010","132","","15081","15090","10.1021/ja107729c","","","0.71073","MoKα","","0.0372","0.0317","","","0.088","0.0918","","","","","","1.077","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103370","7.7035","0.0003","10.8458","0.0004","10.9203","0.0004","79.481","0.001","76.778","0.001","77.897","0.001","859.74","0.06","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","Carbohydrazidium (5E,5'E)-4,4'-(ethane-1,2-diylbis(oxy))bis(5-(nitroimino) -4,5-dihydrotetrazol-1-ide) dihydrate","","- C5 H16 N16 O9 -","- C5 H16 N16 O9 -","- C10 H32 N32 O18 -","2","1","","Young-Hyuk Joo; Jean'ne M. Shreeve","Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates","Journal of the American Chemical Society","2010","132","","15081","15090","10.1021/ja107729c","","","0.71073","MoKα","","0.037","0.0331","","","0.0853","0.0887","","","","","","1.045","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103371","7.5429","0.0005","8.9642","0.0006","15.2214","0.0011","80.376","0.002","82.322","0.002","77.146","0.002","984.31","0.12","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","bis(dihydrazinylmethaniminium) ((5E,5'E)-4,4'-(ethane-1,2-diylbis(oxy)) bis(5-(nitroimino)-4,5-dihydrotetrazol-1-ide))","","- C6 H20 N22 O6 -","- C6 H20 N22 O6 -","- C12 H40 N44 O12 -","2","1","","Young-Hyuk Joo; Jean'ne M. Shreeve","Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates","Journal of the American Chemical Society","2010","132","","15081","15090","10.1021/ja107729c","","","0.71073","MoKα","","0.0491","0.0383","","","0.0951","0.1024","","","","","","1.057","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103372","14.251","0.002","12.9147","0.0019","11.0418","0.0017","90","","91.008","0.002","90","","2031.9","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(dihydrazinylmethaniminium) (5Z,5'Z)-4,4'-(ethane-1,2-diyl)bis(5- (nitroimino)-4,5-dihydrotetrazol-1-ide) dihydrate","","- C6 H24 N22 O6 -","- C6 H24 N22 O6 -","- C24 H96 N88 O24 -","4","1","","Young-Hyuk Joo; Jean'ne M. Shreeve","Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates","Journal of the American Chemical Society","2010","132","","15081","15090","10.1021/ja107729c","","","0.71073","MoKα","","0.0432","0.0341","","","0.0875","0.0945","","","","","","1.05","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103373","11.795","0.0004","12.435","0.0005","21.528","0.0012","90","","97.135","0.002","90","","3133.1","0.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H47 Cl N2 O P2 Ru -","- C31.5 H47 Cl N2 O P2 Ru -","- C126 H188 Cl4 N8 O4 P8 Ru4 -","4","1","","Chidambaram Gunanathan; Boopathy Gnanaprakasam; Mark A. Iron; Linda J. W. Shimon; David Milstein","""Long-Range"" Metal-Ligand Cooperation in H2 Activation and Ammonia-Promoted Hydride Transfer with a Ruthenium-Acridine Pincer Complex","Journal of the American Chemical Society","2010","132","","14763","14765","10.1021/ja107770y","","","0.71073","MoKα","","0.0693","0.0428","","","0.1021","0.1101","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103374","14.941","0.003","12.64","0.003","20.96","0.004","90","","97.94","0.03","90","","3920.4","1.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C86 H110 N2 O7 P4 Ru2 -","- C86 H110 N2 O6.99 P4 Ru2 -","- C172 H220 N4 O13.98 P8 Ru4 -","2","0.5","","Chidambaram Gunanathan; Boopathy Gnanaprakasam; Mark A. Iron; Linda J. W. Shimon; David Milstein","""Long-Range"" Metal-Ligand Cooperation in H2 Activation and Ammonia-Promoted Hydride Transfer with a Ruthenium-Acridine Pincer Complex","Journal of the American Chemical Society","2010","132","","14763","14765","10.1021/ja107770y","","","0.71073","MoKα","","0.035","0.0266","","","0.0617","0.0685","","","","","","1.079","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103375","15.4003","0.0003","16.0686","0.0002","16.5517","0.0003","67.4337","0.0006","64.9752","0.0006","75.2821","0.0006","3406.59","0.1","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H18 F10 N4 O -","- C38 H18 F10 N4 O -","- C152 H72 F40 N16 O4 -","4","2","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.1227","0.058","","","0.1414","0.1621","","","","","","0.914","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103376","17.911","0.004","12.858","0.003","13.559","0.003","90","","110.68","0.03","90","","2921.4","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H20 F6 N4 -","- C37 H20 F6 N4 -","- C148 H80 F24 N16 -","4","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.1294","0.057","","","0.1418","0.1616","","","","","","1.034","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103377","14.816","0.003","39.268","0.008","7.422","0.001","90","","104.29","0.03","90","","4184.5","1.4","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H16 F15 Mn N4 O2 -","- C41 H16 F15 Mn N4 O2 -","- C164 H64 F60 Mn4 N16 O8 -","4","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.1466","0.0957","","","0.2615","0.28","","","","","","1.382","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103378","23.237","0.001","7.4218","0.0004","32.1102","0.0016","90","","107.732","0.002","90","","5274.6","0.5","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H8 Br8 F15 Mn N4 O2 -","- C41 H8 Br8 F15 Mn N4 O2 -","- C164 H32 Br32 F60 Mn4 N16 O8 -","4","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.1094","0.0542","","","0.1232","0.1363","","","","","","0.953","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103379","11.7695","0.0002","16.4116","0.0003","19.4712","0.0002","90","","90","","90","","3760.99","0.1","110","2","110","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C41 H22 Br4 F5 Mn N4 O2 -","- C41 H22 Br4 F5 Mn N4 O2 -","- C164 H88 Br16 F20 Mn4 N16 O8 -","4","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.0447","0.0332","","","0.0705","0.0748","","","","","","0.982","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103380","38.806","0.008","15.342","0.003","14.647","0.003","90","","90","","90","","8720","3","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C45 H33 Cl6 Mn N4 O4 -","- C45 H33 Cl6 Mn N4 O4 -","- C360 H264 Cl48 Mn8 N32 O32 -","8","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.1274","0.0625","","","0.1662","0.1872","","","","","","1.037","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103381","11.1966","0.0002","18.4159","0.0003","24.8914","0.0006","90","","99.9206","0.0006","90","","5055.75","0.17","110","2","110","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C41 H17 Br8 Cl6 Mn N4 O2 -","- C41 H17 Br8 Cl6 Mn N4 O2 -","- C164 H68 Br32 Cl24 Mn4 N16 O8 -","4","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.069","0.0452","","","0.1034","0.1095","","","","","","1.043","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103382","12.6988","0.0002","13.4937","0.0002","22.5901","0.0005","90","","95.0013","0.0007","90","","3856.16","0.12","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H25 Cl6 Mn N4 O S -","- C44 H25 Cl6 Mn N4 O S -","- C176 H100 Cl24 Mn4 N16 O4 S4 -","4","1","","Anil Kumar; Israel Goldberg; Mark Botoshansky; Yekaterina Buchman; Zeev Gross","Oxygen Atom Transfer Reactions from Isolated (Oxo)manganese(V) Corroles to Sulfides","Journal of the American Chemical Society","2010","132","","15233","15245","10.1021/ja1050296","","","0.71073","MoKα","","0.1185","0.0554","","","0.1321","0.1682","","","","","","0.965","","","","has coordinates,has disorder","178779","2020-10-21","18:00:00","" "4103383","18.9952","0.0005","18.9952","0.0005","11.8778","0.0003","90","","90","","120","","3711.54","0.17","200","2","200","2","","","","","","","","6","P 61","P 61","169","","","","- C21 H29 B F4 N2 Pd -","- C21 H29 B F4 N2 Pd -","- C126 H174 B6 F24 N12 Pd6 -","6","1","","Alison N. Campbell; Paul B. White; Ilia A. Guzei; Shannon S. Stahl","Allylic C-H Acetoxylation with a 4,5-Diazafluorenone-Ligated Palladium Catalyst: A Ligand-Based Strategy To Achieve Aerobic Catalytic Turnover","Journal of the American Chemical Society","2010","132","","15116","15119","10.1021/ja105829t","","","0.71073","MoKα","","0.053","0.0511","","","0.1361","0.137","","","","","","0.973","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103384","13.7592","0.0004","6.5942","0.0002","15.8076","0.0005","90","","90","","90","","1434.24","0.08","100","1","100","1","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C14 H11 B F4 N2 O Pd -","- C14 H11 B F4 N2 O Pd -","- C56 H44 B4 F16 N8 O4 Pd4 -","4","0.5","","Alison N. Campbell; Paul B. White; Ilia A. Guzei; Shannon S. Stahl","Allylic C-H Acetoxylation with a 4,5-Diazafluorenone-Ligated Palladium Catalyst: A Ligand-Based Strategy To Achieve Aerobic Catalytic Turnover","Journal of the American Chemical Society","2010","132","","15116","15119","10.1021/ja105829t","","","0.71073","MoKα","","0.0205","0.0191","","","0.0481","0.0493","","","","","","0.861","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103385","33.915","0.005","33.915","0.005","59.795","0.008","90","","90","","120","","59563","15","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C236 H616 N104 Ni54 O434 P8 W72 -","- C236 H387.96 N104 Ni54 O434 P8 W72 -","- C708 H1163.88 N312 Ni162 O1302 P24 W216 -","3","0.166667","","Shou-Tian Zheng; Jie Zhang; Xin-Xiong Li; Wei-Hui Fang; Guo-Yu Yang","cubic Polyoxometalate-Organic Molecular Cage","Journal of the American Chemical Society","2010","132","","15102","15103","10.1021/ja105986b","","","0.71073","MoKα","","0.1175","0.0959","","","0.2131","0.2297","","","","","","1.072","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103386","20.4563","0.0033","15.6609","0.0019","14.4447","0.0016","90","","90","","90","","4627.6","1.1","","","","","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C32 N8 O15 V3 -","- C32 N8 O15 V3 -","- C128 N32 O60 V12 -","4","1","","Michael Maes; Frederik Vermoortele; Luc Alaerts; Sarah Couck; Christine E. A. Kirschhock; Joeri F. M. Denayer; Dirk E. De Vos","Separation of Styrene and Ethylbenzene on Metal-Organic Frameworks: Analogous Structures with Different Adsorption Mechanisms","Journal of the American Chemical Society","2010","132","","15277","15285","10.1021/ja106142x","powder diffraction","","","","","","","","","","","","","0.97","","","","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103387","6.8285","0.0007","14.5274","0.0018","14.0135","0.0018","90","","90","","90","","1390.1","0.3","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C12.6 N0.6 O3 V -","- C12.678 N0.618 O3 V -","- C50.712 N2.472 O12 V4 -","4","0.5","","Michael Maes; Frederik Vermoortele; Luc Alaerts; Sarah Couck; Christine E. A. Kirschhock; Joeri F. M. Denayer; Dirk E. De Vos","Separation of Styrene and Ethylbenzene on Metal-Organic Frameworks: Analogous Structures with Different Adsorption Mechanisms","Journal of the American Chemical Society","2010","132","","15277","15285","10.1021/ja106142x","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.0537","","0.97","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103388","6.6387","0.0006","15.761","0.0014","14.1961","0.0014","90","","90","","90","","1485.4","0.2","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","","","- C16.09 Al O5 -","- C15.4496 Al O5 -","- C61.7984 Al4 O20 -","4","0.25","","Michael Maes; Frederik Vermoortele; Luc Alaerts; Sarah Couck; Christine E. A. Kirschhock; Joeri F. M. Denayer; Dirk E. De Vos","Separation of Styrene and Ethylbenzene on Metal-Organic Frameworks: Analogous Structures with Different Adsorption Mechanisms","Journal of the American Chemical Society","2010","132","","15277","15285","10.1021/ja106142x","powder diffraction","","","","","","","","","","","","","6.83","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103389","20.276","0.02","7.5323","0.0034","6.76","0.006","90","","100.72","0.11","90","","1014.4","1.5","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C11.5 Al O5 -","- C11.5 Al O5 -","- C46 Al4 O20 -","4","1","","Michael Maes; Frederik Vermoortele; Luc Alaerts; Sarah Couck; Christine E. A. Kirschhock; Joeri F. M. Denayer; Dirk E. De Vos","Separation of Styrene and Ethylbenzene on Metal-Organic Frameworks: Analogous Structures with Different Adsorption Mechanisms","Journal of the American Chemical Society","2010","132","","15277","15285","10.1021/ja106142x","powder diffraction","","","","","","","","","","","","","6.83","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103390","6.6424","0.0004","16.0436","0.0011","13.8471","0.001","90","","90","","90","","1475.66","0.17","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","","","- C15.45 Al O5 -","- C15.4528 Al O5 -","- C61.8112 Al4 O20 -","4","0.25","","Michael Maes; Frederik Vermoortele; Luc Alaerts; Sarah Couck; Christine E. A. Kirschhock; Joeri F. M. Denayer; Dirk E. De Vos","Separation of Styrene and Ethylbenzene on Metal-Organic Frameworks: Analogous Structures with Different Adsorption Mechanisms","Journal of the American Chemical Society","2010","132","","15277","15285","10.1021/ja106142x","powder diffraction","","","","","","","","","","","","","4.26","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103391","19.806","0.028","7.366","0.005","7.055","0.009","90","","104.36","0.19","90","","997","2","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C16.16 Al O3 -","- C16.4 Al O3 -","- C65.6 Al4 O12 -","4","1","","Michael Maes; Frederik Vermoortele; Luc Alaerts; Sarah Couck; Christine E. A. Kirschhock; Joeri F. M. Denayer; Dirk E. De Vos","Separation of Styrene and Ethylbenzene on Metal-Organic Frameworks: Analogous Structures with Different Adsorption Mechanisms","Journal of the American Chemical Society","2010","132","","15277","15285","10.1021/ja106142x","powder diffraction","","","","","","","","","","","","","4.26","","","","","","","has coordinates","178779","2020-10-21","18:00:00","" "4103392","7.297","0.003","8.506","0.003","21.594","0.008","90","","92.523","0.006","90","","1339","0.9","153.1","","153.1","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Cl N3 Pd S -","- C13 H12 Cl N3 Pd S -","- C52 H48 Cl4 N12 Pd4 S4 -","4","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0342","","","","0.0899","","","","","","1.191","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103393","8.645","0.003","9.574","0.003","9.938","0.003","86.455","0.008","87.41","0.009","82.196","0.008","812.8","0.5","150.1","","150.1","","","","","","","","","7","P -1","-P 1","2","","","","- C13 H13 Cl2 N3 O4 Pd S -","- C13 H13 Cl2 N3 O4 Pd S -","- C26 H26 Cl4 N6 O8 Pd2 S2 -","2","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0365","","","","0.0814","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103394","7.2466","0.001","8.687","0.0007","21.727","0.002","90","","92.269","0.005","90","","1366.7","0.3","150.1","","150.1","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Br N3 Pd S -","- C13 H12 Br N3 Pd S -","- C52 H48 Br4 N12 Pd4 S4 -","4","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0258","","","","0.0649","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103395","32.506","0.005","8.6406","0.0013","21.204","0.004","90","","120.666","0.0015","90","","5122.7","1.5","150.1","","150.1","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 Br3 N3 O5 Pd S -","- C22 H20 Br3 N3 O5 Pd S -","- C176 H160 Br24 N24 O40 Pd8 S8 -","8","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0267","","","","0.0591","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103396","9.779","0.002","12.792","0.003","13.927","0.003","97.402","0.002","96.785","0.002","110.977","0.003","1587.6","0.6","250.1","","250.1","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H30 Br3 N3 O8 Pd S -","- C27 H30 Br3 N3 O8 Pd S -","- C54 H60 Br6 N6 O16 Pd2 S2 -","2","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0469","","","","0.1266","","","","","","0.996","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103397","40.443","0.008","8.8478","0.0015","21.617","0.004","90","","117.682","0.0005","90","","6850","2","110.1","","110.1","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H26 Br4 N6 O4 Pd2 S2 -","- C32 H26 Br4 N6 O4 Pd2 S2 -","- C256 H208 Br32 N48 O32 Pd16 S16 -","8","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0338","","","","0.0758","","","","","","0.967","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103398","40.506","0.009","8.8629","0.0016","21.647","0.005","90","0.0005","117.653","0.0008","90","0.0005","6884","3","150.1","","150.1","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H26 Br4 N6 O4 Pd2 S2 -","- C32 H26 Br4 N6 O4 Pd2 S2 -","- C256 H208 Br32 N48 O32 Pd16 S16 -","8","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0356","","","","0.0836","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103399","40.66","0.02","8.883","0.004","21.737","0.011","90","","117.619","0.0018","90","","6956","6","250.1","","250.1","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H26 Br4 N6 O4 Pd2 S2 -","- C32 H26 Br4 N6 O4 Pd2 S2 -","- C256 H208 Br32 N48 O32 Pd16 S16 -","8","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0437","","","","0.1079","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103400","13.98","0.004","4.8149","0.0013","42.22","0.012","90","0.0007","98.1321","0.0008","90","0.0007","2813.3","1.4","150.1","","150.1","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 Br4 N4 O6 Pd S -","- C24 H17.51 Br4 N4 O6 Pd S -","- C96 H70.04 Br16 N16 O24 Pd4 S4 -","4","1","","Atsushi Kobayashi; Masa-aki Dosen; Mee Chang; Kiyohiko Nakajima; Shin-ichiro Noro; Masako Kato","Synthesis of Metal-Hydrazone Complexes and Vapochromic Behavior of Their Hydrogen-Bonded Proton-Transfer Assemblies","Journal of the American Chemical Society","2010","132","","15286","15298","10.1021/ja1063444","","","0.7107","MoKα","","","0.0384","","","","0.067","","","","","","0.857","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103401","10.518","0.002","10.518","0.002","39.449","0.009","90","","90","","90","","4364.2","1.5","296","2","296","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C34 H40 Br2 N6 O13 S2 -","- C34 H40 Br2 N6 O13 S2 -","- C136 H160 Br8 N24 O52 S8 -","4","0.5","","Xianxing Jiang; Yiming Cao; Yiqing Wang; Luping Liu; Fangfang Shen; Rui Wang","A Unique Approach to the Concise Synthesis of Highly Optically Active Spirooxazolines and the Discovery of a More Potent Oxindole-Type Phytoalexin Analogue","Journal of the American Chemical Society","2010","132","","15328","15333","10.1021/ja106349m","","","0.71073","MoKα","","0.2007","0.0924","","","0.2399","0.3173","","","","","","0.975","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103402","19.1703","0.0002","9.7168","0.0001","39.0199","0.0006","90","","115.416","0.001","90","","6564.92","0.15","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H55 N3 O2 Zr -","- C33 H55 N3 O2 Zr -","- C264 H440 N24 O16 Zr8 -","8","2","","Laura E. N. Allan; Guy J. Clarkson; David J. Fox; Andrew L. Gott; Peter Scott","Mechanism of Catalytic Cyclohydroamination by Zirconium Salicyloxazoline Complexes","Journal of the American Chemical Society","2010","132","","15308","15320","10.1021/ja106588m","","","0.71073","MoKα","","0.0626","0.0425","","","0.086","0.0903","","","","","","1.017","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103403","13.046","0.0008","14.4943","0.0009","17.9894","0.0012","66.648","0.003","89.161","0.003","65.823","0.003","2804.4","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H81 Hf2 N4 O4 Si2 -","- C55 H81 Hf2 N4 O4 Si2 -","- C110 H162 Hf4 N8 O8 Si4 -","2","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Functionalization of Hafnium Oxamidide Complexes Prepared from CO-Induced N2 Cleavage","Journal of the American Chemical Society","2010","132","","15340","15350","10.1021/ja106848y","","","0.71073","MoKα","","0.0332","0.0227","","","0.0485","0.0529","","","","","","1.029","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103404","12.0535","0.0004","12.2029","0.0005","19.7494","0.0008","93.492","0.002","93.53","0.002","108.196","0.002","2744.54","0.19","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H68 Hf2 N2 O6 Si2 -","- C51 H68 Hf2 N2 O6 Si2 -","- C102 H136 Hf4 N4 O12 Si4 -","2","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Functionalization of Hafnium Oxamidide Complexes Prepared from CO-Induced N2 Cleavage","Journal of the American Chemical Society","2010","132","","15340","15350","10.1021/ja106848y","","","0.71073","MoKα","","0.0407","0.0274","","","0.0615","0.065","","","","","","1.016","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103405","9.5359","0.0005","24.7208","0.0011","10.0763","0.0005","90","","109.167","0.001","90","","2243.66","0.19","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20.92 H30 Hf I1.08 N0.92 O0.92 Si -","- C20.9206 H30 Hf I1.0794 N0.9206 O0.9206 Si -","- C83.6824 H120 Hf4 I4.3176 N3.6824 O3.6824 Si4 -","4","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Functionalization of Hafnium Oxamidide Complexes Prepared from CO-Induced N2 Cleavage","Journal of the American Chemical Society","2010","132","","15340","15350","10.1021/ja106848y","","","0.71073","MoKα","","0.0303","0.0265","","","0.0641","0.0656","","","","","","1.027","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103406","17.9895","0.0012","14.7281","0.001","16.9414","0.0011","90","","117.545","0.002","90","","3979.8","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H58 Hf2 I2 N2 O2 -","- C40 H58 Hf2 I2 N2 O2 -","- C160 H232 Hf8 I8 N8 O8 -","4","1","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Functionalization of Hafnium Oxamidide Complexes Prepared from CO-Induced N2 Cleavage","Journal of the American Chemical Society","2010","132","","15340","15350","10.1021/ja106848y","","","0.71073","MoKα","","0.0651","0.0522","","","0.1403","0.1514","","","","","","1.066","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103407","10.3897","0.0005","16.7816","0.0008","13.2336","0.0005","90","","91.078","0.001","90","","2306.95","0.18","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H68 Hf2 N2 O2 Si2 -","- C50 H68 Hf2 N2 O2 Si2 -","- C100 H136 Hf4 N4 O4 Si4 -","2","0.5","","Donald J. Knobloch; Emil Lobkovsky; Paul J. Chirik","Functionalization of Hafnium Oxamidide Complexes Prepared from CO-Induced N2 Cleavage","Journal of the American Chemical Society","2010","132","","15340","15350","10.1021/ja106848y","","","0.71073","MoKα","","0.0593","0.038","","","0.085","0.0939","","","","","","1.037","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103408","10.6093","0.0006","10.9456","0.0008","20.9242","0.0013","90","","94.074","0.005","90","","2423.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 N O2 -","- C27 H33 N O2 -","- C108 H132 N4 O8 -","4","1","","Martin Breugst; Herbert Mayr","Ambident Reactivities of Pyridone Anions","Journal of the American Chemical Society","2010","132","","15380","15389","10.1021/ja106962u","","","0.71073","MoKα","","0.1672","0.0563","","","0.0835","0.1005","","","","","","0.776","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103409","29.6688","0.0005","29.6688","0.0005","72.7125","0.0011","90","","90","","120","","55429.3","1.6","293","2","293","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","","","- C192 Cl6 Mn6 N12 O38 Zn8 -","- C192 Cl6 Mn6 N12 O38 Zn8 -","- C1152 Cl36 Mn36 N72 O228 Zn48 -","6","0.333333","","Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin","Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes","Journal of the American Chemical Society","2010","132","","15390","15398","10.1021/ja1069773","","","1.54178","CuKα","","0.2226","0.1484","","","0.376","0.4163","","","","","","1.19","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103410","29.585","0.0005","29.585","0.0005","72.4624","0.0011","90","","90","","120","","54927.1","1.6","293","2","293","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C180 Cl6 Mn6 N12 O38 Zn8 -","- C180 Cl6 Mn6 N12 O38 Zn8 -","- C540 Cl18 Mn18 N36 O114 Zn24 -","3","0.333333","","Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin","Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes","Journal of the American Chemical Society","2010","132","","15390","15398","10.1021/ja1069773","","","1.54178","CuKα","","0.1257","0.0969","","","0.2318","0.2457","","","","","","1.061","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103411","35.8652","0.0019","35.8652","0.0019","87.761","0.008","90","","90","","120","","97764","12","293","2","293","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","","","- C204 Cl6 Mn6 N12 O38 Zn8 -","- C204 Cl6 Mn6 N12 O38 Zn8 -","- C1224 Cl36 Mn36 N72 O228 Zn48 -","6","0.333333","","Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin","Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes","Journal of the American Chemical Society","2010","132","","15390","15398","10.1021/ja1069773","","","1.54178","CuKα","","0.1908","0.1271","","","0.2776","0.3102","","","","","","1.149","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103412","35.884","0.0003","35.884","0.0003","87.911","0.002","90","","90","","120","","98034","3","296","2","296","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C204 Cl6 Mn6 N12 O38 Zn8 -","- C204 Cl6 Mn6 N12 O38 Zn8 -","- C612 Cl18 Mn18 N36 O114 Zn24 -","3","0.333333","","Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin","Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes","Journal of the American Chemical Society","2010","132","","15390","15398","10.1021/ja1069773","","","1.54178","CuKα","","0.2022","0.1201","","","0.2983","0.3473","","","","","","0.837","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103413","41.9263","0.0008","41.9263","0.0008","100.286","0.004","90","","90","","120","","152667","7","296","2","296","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C252 Cl6 Mn6 N12 O38 Zn8 -","- C252 Cl6 Mn6 N12 O38 Zn8 -","- C2268 Cl54 Mn54 N108 O342 Zn72 -","9","1","","Feijie Song; Cheng Wang; Joseph M. Falkowski; Liqing Ma; Wenbin Lin","Isoreticular Chiral Metal-Organic Frameworks for Asymmetric Alkene Epoxidation: Tuning Catalytic Activity by Controlling Framework Catenation and Varying Open Channel Sizes","Journal of the American Chemical Society","2010","132","","15390","15398","10.1021/ja1069773","","","1.54178","CuKα","","0.2239","0.1659","","","0.3668","0.3937","","","","","","1.19","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103414","10.062","0.0014","16.959","0.002","11.5926","0.0016","90","","94.095","0.002","90","","1973.1","0.5","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H66 N Ni P2 -","- C42 H66 N Ni P2 -","- C84 H132 N2 Ni2 P4 -","2","1","","Vlad M. Iluc; Gregory L. Hillhouse","Hydrogen-Atom Abstraction from Ni(I) Phosphido and Amido Complexes Gives Phosphinidene and Imide Ligands","Journal of the American Chemical Society","2010","132","","15148","15150","10.1021/ja107115q","","","0.71073","MoKα","","0.0424","0.0403","","","0.0955","0.0965","","","","","","1.01","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103415","10.803","0.002","20.155","0.004","18.138","0.004","90","","93.214","0.004","90","","3943.1","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H65 N Ni P2 -","- C42 H65 N Ni P2 -","- C168 H260 N4 Ni4 P8 -","4","1","","Vlad M. Iluc; Gregory L. Hillhouse","Hydrogen-Atom Abstraction from Ni(I) Phosphido and Amido Complexes Gives Phosphinidene and Imide Ligands","Journal of the American Chemical Society","2010","132","","15148","15150","10.1021/ja107115q","","","0.71073","MoKα","","0.0478","0.0408","","","0.1042","0.108","","","","","","1.039","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103416","17.0288","0.0004","10.595","0.0002","20.455","0.0004","90","","91.0273","0.0008","90","","3689.9","0.13","173.1","","173.1","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10.5 H26 I2 Ir N3 O0.5 -","- C10.5 H25.5 I2 Ir N3 O0.5 -","- C84 H204 I16 Ir8 N24 O4 -","8","2","","Ryoko Kawahara; Ken-ichi Fujita; Ryohei Yamaguchi","Multialkylation of Aqueous Ammonia with Alcohols Catalyzed by Water-Soluble Cp*Ir-Ammine Complexes","Journal of the American Chemical Society","2010","132","","15108","15111","10.1021/ja107274w","","","0.71075","MoKα","","","0.032","","","","0.0318","","","","","","0.904","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103417","16.8901","0.0002","27.588","0.0004","36.4428","0.0005","90","","102.393","0.001","90","","16585.4","0.4","150","2","150","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C122 H212 Co Cr7 F8 N O36 -","- C122 H212 Co1.04 Cr7.04 F8 N O36 -","- C488 H848 Co4.16 Cr28.16 F32 N4 O144 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.2002","0.1125","","","0.2625","0.3132","","","","","","1.058","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103418","16.8712","0.0003","27.5463","0.0004","36.476","0.0007","90","","102.254","0.001","90","","16565.6","0.5","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C122 H212 Cr8 F8 N O36 -","- C122 H212 Cr8 F8 N O36 -","- C488 H848 Cr32 F32 N4 O144 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.2508","0.1074","","","0.2171","0.265","","","","","","1.18","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103419","18.7556","0.0007","29.0775","0.0011","28.6023","0.0014","90","","100.79","0.002","90","","15322.9","1.1","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C122 H212 Cr7 F8 Mn N O36 -","- C122 H212 Cr7 F8 Mn N O36 -","- C488 H848 Cr28 F32 Mn4 N4 O144 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.2775","0.1071","","","0.2052","0.2691","","","","","","1.107","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103420","18.745","0.0011","29.0923","0.0013","28.525","0.0012","90","","100.458","0.005","90","","15297.3","1.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C122 H212 Cr7 Cu F8 N O36 -","- C122 H212 Cr7.04 Cu1.04 F8 N O36 -","- C488 H848 Cr28.16 Cu4.16 F32 N4 O144 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","","0.71073","MoKα","","0.127","0.0778","","","0.2125","0.2358","","","","","","0.978","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103421","29.828","0.0009","27.8513","0.0006","32.3305","0.001","90","","90","","90","","26858.5","1.3","150","2","150","2","","","","","","","synthesis as described","7","P b c a","-P 2ac 2ab","61","","","","- C107 H192 Cr7 F8 Fe N O35 -","- C107 H192.001 Cr7.04 F8 Fe1.04 N O35 -","- C856.004 H1536.01 Cr56.32 F64 Fe8.32 N8 O280 -","8","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.2407","0.1114","","","0.1927","0.244","","","","","","1.228","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103422","16.5136","0.0005","31.3861","0.0007","28.4164","0.0009","90","","94.6221","0.001","90","","14680.3","0.7","100","2","293","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C108 H202 Co Cr7 F8 N3 O36.5 -","- C108 H202 Co Cr7 F8 N3 O36.5 -","- C432 H808 Co4 Cr28 F32 N12 O146 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.1826","0.1071","","","0.2301","0.2772","","","","","","1.133","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103423","16.4959","0.0008","31.4557","0.0015","28.2556","0.0013","90","","94.122","0.003","90","","14623.6","1.2","90","2","90","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C107 H203.25 Cr7 F8 N3 Ni O37.25 -","- C107.076 H200.152 Cr7 F8 N3 Ni O37.192 -","- C428.304 H800.608 Cr28 F32 N12 Ni4 O148.768 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.7749","synchrotron","","0.0871","0.0843","","","0.2063","0.2089","","","","","","1.127","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103424","16.5354","0.0004","31.3895","0.0006","28.3451","0.0007","90","","94.254","0.001","90","","14671.7","0.6","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C105 H196 Cr7 F8 Fe N3 O38 -","- C105 H196 Cr7 F8 Fe N3 O38 -","- C420 H784 Cr28 F32 Fe4 N12 O152 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.1955","0.1107","","","0.2499","0.2862","","","","","","1.244","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103425","16.4713","0.0002","31.6375","0.0004","28.1919","0.0005","90","","94.54","0.001","90","","14645","0.4","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C110.5 H207.5 Cr7 F8 Mn N3 O37 -","- C110.7 H207.4 Cr7.04 F8 Mn1.04 N3 O37.019 -","- C442.8 H829.6 Cr28.16 F32 Mn4.16 N12 O148.076 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.1405","0.0854","","","0.1962","0.2346","","","","","","1.007","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103426","16.8601","0.0002","32.0521","0.0004","28.403","0.0005","90","","94.249","0.001","90","","15306.8","0.4","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C106.5 H200.5 Cr7 Cu F8 N3 O36.5 -","- C106.5 H199 Cr7 Cu F8 N3 O36.5 -","- C426 H796 Cr28 Cu4 F32 N12 O146 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.15","0.091","","","0.2052","0.2423","","","","","","1.062","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103427","16.5125","0.0002","31.3755","0.0004","28.3801","0.0004","90","","94.644","0.001","90","","14655.1","0.3","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C107.25 H200.5 Cr7 F8 N3 O36.5 Zn -","- C108.036 H202.072 Cr7.04 F8 N3 O36.738 Zn1.04 -","- C432.144 H808.288 Cr28.16 F32 N12 O146.952 Zn4.16 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.1105","0.0926","","","0.217","0.2306","","","","","","1.096","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103428","16.8642","0.0002","32.2599","0.0004","28.2099","0.0005","90","","93.79","0.001","90","","15313.7","0.4","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C106.5 H199 Cd Cr7 F8 N3 O36 -","- C106.5 H199 Cd Cr7 F8 N3 O36 -","- C426 H796 Cd4 Cr28 F32 N12 O144 -","4","1","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","x-ray","0.71073","MoKα","","0.1422","0.0877","","","0.2014","0.2391","","","","","","1.081","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103429","70.178","0.004","31.5931","0.0018","31.206","0.002","90","","90","","90","","69188","7","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C133 H235 Co Cr7 F8 N2 O38 -","- C133 H235 Co1.04 Cr7.04 F8 N2 O38 -","- C2128 H3760 Co16.64 Cr112.64 F128 N32 O608 -","16","2","","Beatriz Ballesteros; Thomas B. Faust; Chin-Fa Lee; David A. Leigh; Christopher A. Muryn; Robin G. Pritchard; David Schultz; Simon J. Teat; Grigore A. Timco; Richard E. P. Winpenny","Synthesis, Structure, and Dynamic Properties of Hybrid Organic-Inorganic Rotaxanes","Journal of the American Chemical Society","2010","132","","15435","15444","10.1021/ja1074773","","","0.71073","MoKα","","0.2248","0.1447","","","0.348","0.4002","","","","","","1.261","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103430","14.294","0.0008","13.8238","0.0007","35.2329","0.0017","90","","90","","90","","6961.9","0.6","103","2","103","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H25 N O W -","- C19 H25 N O W -","- C304 H400 N16 O16 W16 -","16","2","","Rhett A. Baillie; Tommy Tran; Michelle E. Thibault; Peter Legzdins","A Beneficial Kinetic Effect of an η5-C5Me4H Ligand","Journal of the American Chemical Society","2010","132","","15160","15161","10.1021/ja107834g","","","0.71073","MoKα","","0.0287","0.0253","","","0.0499","0.0508","","","","","","1.287","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103431","8.4341","0.0009","8.4965","0.0009","14.4435","0.0015","85.138","0.005","88.498","0.005","61.891","0.004","909.55","0.17","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H27 N O W -","- C20 H27 N O W -","- C40 H54 N2 O2 W2 -","2","1","","Rhett A. Baillie; Tommy Tran; Michelle E. Thibault; Peter Legzdins","A Beneficial Kinetic Effect of an η5-C5Me4H Ligand","Journal of the American Chemical Society","2010","132","","15160","15161","10.1021/ja107834g","","","0.71073","MoKα","","0.0397","0.0377","","","0.0872","0.0884","","","","","","1.226","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103432","9.3285","0.0006","15.5488","0.0009","25.2601","0.0016","90","","90","","90","","3663.9","0.4","103","2","103","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H27 N O W -","- C20 H27 N O W -","- C160 H216 N8 O8 W8 -","8","1","","Rhett A. Baillie; Tommy Tran; Michelle E. Thibault; Peter Legzdins","A Beneficial Kinetic Effect of an η5-C5Me4H Ligand","Journal of the American Chemical Society","2010","132","","15160","15161","10.1021/ja107834g","","","0.71073","MoKα","","0.0415","0.027","","","0.0589","0.0646","","","","","","1.01","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103433","6.6773","0.0003","7.5444","0.0003","24.3301","0.001","90","","90","","90","","1225.66","0.09","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Cl N O3 -","- C12 H10 Cl N O3 -","- C48 H40 Cl4 N4 O12 -","4","1","","Yun-Lin Liu; Bo-Lun Wang; Jun-Jie Cao; Long Chen; Yong-Xue Zhang; Chao Wang; Jian Zhou","Organocatalytic Asymmetric Synthesis of Substituted 3-Hydroxy-2-oxindoles via Morita-Baylis-Hillman Reaction","Journal of the American Chemical Society","2010","132","","15176","15178","10.1021/ja107858z","","","0.71073","MoKα","","0.04","0.0384","","","0.0942","0.0958","","","","","","1.051","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103434","11.2466","0.0002","21.7748","0.0003","13.4453","0.0002","90","","105.571","0.0009","90","","3171.8","0.09","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C76 H104 Si2 -","- C76 H104 Si2 -","- C152 H208 Si4 -","2","0.5","","Megumi Kobayashi; Tsukasa Matsuo; Takeo Fukunaga; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","Air-Stable, Room-Temperature Emissive Disilenes with π-Extended Aromatic Groups","Journal of the American Chemical Society","2010","132","","15162","15163","10.1021/ja108094m","","","0.71073","MoKα","","0.0754","0.0669","","","0.1612","0.1681","","","","","","1.028","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103435","10.937","0.003","11.205","0.003","14.946","0.004","81.849","0.009","78.313","0.01","86.656","0.012","1774.7","0.8","90","","90","","","","","","","","","3","P -1","-P 1","2","","","","- C86 H116 Si2 -","- C86 H116 Si2 -","- C86 H116 Si2 -","1","0.5","","Megumi Kobayashi; Tsukasa Matsuo; Takeo Fukunaga; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","Air-Stable, Room-Temperature Emissive Disilenes with π-Extended Aromatic Groups","Journal of the American Chemical Society","2010","132","","15162","15163","10.1021/ja108094m","","","0.71073","MoKα","","0.1168","0.0801","","","0.1709","0.1926","","","","","","1.105","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103436","11.4032","0.0011","15.5339","0.0016","21.616","0.002","102.01","0.005","94.551","0.005","109.412","0.006","3486.2","0.6","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C76 H62 Cl4 O12 P2 -","- C76 H62 Cl4 O12 P2 -","- C152 H124 Cl8 O24 P4 -","2","1","","Steven Harthong; Béatrice Dubessy; Jérôme Vachon; Christophe Aronica; Jean-Christophe Mulatier; Jean-Pierre Dutasta","Restricted Guest Tumbling in Phosphorylated Self-Assembled Capsules","Journal of the American Chemical Society","2010","132","","15637","15643","10.1021/ja104388t","","","0.71073","MoKα","","0.1955","0.1439","","0.1983","0.1486","0.1418","","","","","","1.1131","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103437","14.634","0.005","15.22","0.005","19.417","0.005","108.272","0.005","100.008","0.005","106.075","0.005","3782","2","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C75.5 H67 I0.5 N0.5 O10 P2 -","- C75.5 H67 I0.5 N0.5 O10 P2 -","- C151 H134 I N O20 P4 -","2","1","","Steven Harthong; Béatrice Dubessy; Jérôme Vachon; Christophe Aronica; Jean-Christophe Mulatier; Jean-Pierre Dutasta","Restricted Guest Tumbling in Phosphorylated Self-Assembled Capsules","Journal of the American Chemical Society","2010","132","","15637","15643","10.1021/ja104388t","","","0.71069","MoKα","","0.1734","0.1236","","0.2419","0.1593","0.1593","","","","","","1.1906","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103438","7.4847","0.0016","7.9448","0.0017","23.465","0.005","90","","90","","90","","1395.3","0.5","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H9 Br F6 O2 -","- C13 H9 Br F6 O2 -","- C52 H36 Br4 F24 O8 -","4","1","","Ling Zhou; Chong Kiat Tan; Xiaojian Jiang; Feng Chen; Ying-Yeung Yeung","Asymmetric Bromolactonization Using Amino-thiocarbamate Catalyst","Journal of the American Chemical Society","2010","132","","15474","15476","10.1021/ja1048972","","","0.71073","MoKα","","0.0368","0.0322","","","0.0759","0.0773","","","","","","1.047","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103439","7.0374","0.0013","9.0419","0.0017","15.633","0.003","90","","90","","90","","994.8","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H15 Br O2 -","- C9 H15 Br O2 -","- C36 H60 Br4 O8 -","4","1","","Ling Zhou; Chong Kiat Tan; Xiaojian Jiang; Feng Chen; Ying-Yeung Yeung","Asymmetric Bromolactonization Using Amino-thiocarbamate Catalyst","Journal of the American Chemical Society","2010","132","","15474","15476","10.1021/ja1048972","","","0.71073","MoKα","","0.0256","0.0241","","","0.0558","0.0563","","","","","","1.047","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103440","8.8346","0.0008","16.5865","0.0015","8.8592","0.0008","90","","98.22","0.002","90","","1284.8","0.2","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H31 N3 O3 S -","- C28 H31 N3 O3 S -","- C56 H62 N6 O6 S2 -","2","1","","Ling Zhou; Chong Kiat Tan; Xiaojian Jiang; Feng Chen; Ying-Yeung Yeung","Asymmetric Bromolactonization Using Amino-thiocarbamate Catalyst","Journal of the American Chemical Society","2010","132","","15474","15476","10.1021/ja1048972","","","0.71073","MoKα","","0.0623","0.0587","","","0.1502","0.1536","","","","","","1.093","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103441","6.121","0.002","14.951","0.005","23.343","0.005","90","","90","","90","","2136.2","1.1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H0.25 O7.5 -","- C21 H26 O8 -","- C84 H104 O32 -","4","1","","Mélissa Boultadakis-Arapinis; Pascale Lemoine; Serge Turcaud; Laurent Micouin; Thomas Lecourt","Rh(II) Carbene-Promoted Activation of the Anomeric C-H Bond of Carbohydrates: A Stereospecific Entry toward α- and β-Ketopyranosides","Journal of the American Chemical Society","2010","132","","15477","15479","10.1021/ja1054065","","","0.71073","MoKα","","0.1628","0.0411","","","0.0776","0.1038","","","","","","0.899","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103442","10.8813","0.0015","9.4783","0.001","13.659","0.004","90","","111.143","0.015","90","","1313.9","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H34 O10 -","- C25 H34 O10 -","- C50 H68 O20 -","2","1","","Mélissa Boultadakis-Arapinis; Pascale Lemoine; Serge Turcaud; Laurent Micouin; Thomas Lecourt","Rh(II) Carbene-Promoted Activation of the Anomeric C-H Bond of Carbohydrates: A Stereospecific Entry toward α- and β-Ketopyranosides","Journal of the American Chemical Society","2010","132","","15477","15479","10.1021/ja1054065","","","0.71073","MoKα","","0.1376","0.0571","","","0.1167","0.1403","","","","","","0.938","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103443","9.6889","0.0004","10.0184","0.0003","11.8966","0.0004","90","","90","","90","","1154.77","0.07","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- Be2 Na5 O57 Si18 -","- Be2.64 Na5.272 O52.5 Si17.364 -","- Be2.64 Na5.272 O52.5 Si17.364 -","1","0.25","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0819","0.075","","","0.2103","0.2191","","","","","","1.091","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103444","9.6631","0.0004","12.2031","0.0004","9.9913","0.0004","90","","90","","90","","1178.17","0.08","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- Be0.25 K0.5 O3.75 Si -","- Be2 K4 O26 Si8 -","- Be4 K8 O52 Si16 -","2","0.25","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0346","0.0325","","","0.0818","0.0833","","","","","","1.137","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103445","13.3184","0.0002","13.3184","0.0002","13.3184","0.0002","90","","90","","90","","2362.41","0.06","293","2","293","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Be Na2 O14 Si5 -","- Be3.144 Na4.336 O28 Si8.856 -","- Be12.576 Na17.344 O112 Si35.424 -","4","0.0833333","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0304","0.0274","","","0.0621","0.0638","","","","","","1.138","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103446","9.8276","0.0004","9.8276","0.0004","9.6372","0.0007","90","","90","","90","","930.78","0.09","293","2","293","2","","","","","","","","4","I -4","I -4","82","","","","- Be12 Na4 O4 Si4 -","- Be6.036 Na4 O16 Si5.964 -","- Be12.072 Na8 O32 Si11.928 -","2","0.25","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0777","0.0723","","","0.189","0.1944","","","","","","1.118","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103447","13.8256","0.0003","13.8256","0.0003","9.7767","0.0002","90","","90","","90","","1868.79","0.07","293","2","293","2","","","","","","","","6","P 42/n m c :2","-P 4ac 2a","137","","","","- C0 H0 Be2 K2 O24 Si6 -","- C7 Be2.30933 K2.66667 O25.3467 Si8.35733 -","- C21 Be6.928 K8 O76.04 Si25.072 -","3","0.1875","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0693","0.0618","","","","0.1665","","","","","","0.961","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103448","8.4812","0.0008","13.7542","0.0007","8.5138","0.0007","90","","109.015","0.003","90","","938.96","0.13","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C0 Be2 K2 Na0 O12 Si4 -","- Be1.34 K2.274 O16 Si6.66 -","- Be2.68 K4.548 O32 Si13.32 -","2","0.5","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.1037","0.0866","","","0.2402","0.2626","","","","","","1.041","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103449","12.7069","0.0009","13.2309","0.0007","13.9362","0.0008","90","","90","","90","","2343","0.2","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C0.4 Be1.6 K3.2 N0.4 O12 Si6.4 -","- C2.864 Be1.6 K3.128 N0.672 O16.768 Si6.4 -","- C14.32 Be8 K15.64 N3.36 O83.84 Si32 -","5","0.625","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0973","0.1266","","","0.1574","0.1315","","","","","","1.112","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103450","7.1255","0.0006","7.13","0.0006","15.5209","0.0009","90.315","0.005","90.117","0.005","90.006","0.004","788.52","0.1","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C0 H4 Be K O8 Si4 -","- C1.16667 Be0.666667 K1.11 O11.2333 Si4 -","- C3.5 Be2 K3.33 O33.7 Si12 -","3","3","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.1184","0.0981","","","","0.1509","","","","","","1.115","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103451","12.1773","0.0005","7.0903","0.0003","12.8804","0.0004","90","","104.209","0.002","90","","1078.08","0.07","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- Be H2 K2 O8 Si4 -","- Be2.624 H4 K6 O22 Si7.376 -","- Be5.248 H8 K12 O44 Si14.752 -","2","0.5","","Jennifer A. Armstrong; Mark T. Weller","Beryllosilicate Frameworks and Zeolites","Journal of the American Chemical Society","2010","132","","15679","15686","10.1021/ja106313p","","","0.71073","MoKα","","0.0644","0.0574","","","0.1282","0.1346","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103452","7.888","0.0012","8.9681","0.0012","13.264","0.002","87.389","0.007","77.692","0.008","85.503","0.007","913.5","0.2","103","0.1","103","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H16 Cl Ga N4 O8 -","- C16 H16 Cl Ga N4 O8 -","- C32 H32 Cl2 Ga2 N8 O16 -","2","1","","Eszter Boros; Cara L. Ferreira; Jacqueline F. Cawthray; Eric W. Price; Brian O. Patrick; Dennis W. Wester; Michael J. Adam; Chris Orvig","Acyclic Chelate with Ideal Properties for 68Ga PET Imaging Agent Elaboration","Journal of the American Chemical Society","2010","132","","15726","15733","10.1021/ja106399h","","","0.71073","MoKα","","0.0256","0.0214","","","0.0675","0.0875","","","","","","1.3","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103453","20.317","0.002","14.0298","0.0017","24.06","0.003","90","","98.966","0.002","90","","6774.3","1.4","90","0.1","90","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H30 Cl Ga N6 O13 -","- C31 H30 Cl Ga N6 O13 -","- C248 H240 Cl8 Ga8 N48 O104 -","8","2","","Eszter Boros; Cara L. Ferreira; Jacqueline F. Cawthray; Eric W. Price; Brian O. Patrick; Dennis W. Wester; Michael J. Adam; Chris Orvig","Acyclic Chelate with Ideal Properties for 68Ga PET Imaging Agent Elaboration","Journal of the American Chemical Society","2010","132","","15726","15733","10.1021/ja106399h","","","0.71073","MoKα","","0.1073","0.0588","","","0.1478","0.167","","","","","","0.958","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103454","24.6269","0.0002","14.3093","0.0002","26.7863","0.0002","90","","91.598","0.001","90","","9435.65","0.17","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C82 H149 Mn Mo6 N4 O24 -","- C56 H86.6 Mn Mo6 N4 O24 -","- C224 H346.4 Mn4 Mo24 N16 O96 -","4","1","","Mali H. Rosnes; Chiara Musumeci; Chullikkattil P. Pradeep; Jennifer S. Mathieson; De-Liang Long; Yu-Fei Song; Bruno Pignataro; Richard Cogdell; Leroy Cronin","Assembly of Modular Asymmetric Organic-Inorganic Polyoxometalate Hybrids into Anisotropic Nanostructures","Journal of the American Chemical Society","2010","132","","15490","15492","10.1021/ja1066338","","","1.54184","CuKα","","0.1011","0.0766","","","0.247","0.263","","","","","","1.063","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103455","23.9788","0.0003","16.1403","0.0003","25.4293","0.0003","90","","99.83","0.002","90","","9697.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C78 H160 Mn Mo6 N5 O24 -","- C75.8 H146.6 Mn Mo6 N4.2 O24 -","- C303.2 H586.4 Mn4 Mo24 N16.8 O96 -","4","1","","Mali H. Rosnes; Chiara Musumeci; Chullikkattil P. Pradeep; Jennifer S. Mathieson; De-Liang Long; Yu-Fei Song; Bruno Pignataro; Richard Cogdell; Leroy Cronin","Assembly of Modular Asymmetric Organic-Inorganic Polyoxometalate Hybrids into Anisotropic Nanostructures","Journal of the American Chemical Society","2010","132","","15490","15492","10.1021/ja1066338","","","1.54184","CuKα","","0.0802","0.0539","","","0.1406","0.1584","","","","","","1.04","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103456","51.168","0.005","10.0144","0.001","25.099","0.003","90","","90","","90","","12861","2","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C47 H39.5 Cl6 O6.75 -","- C47 H38 Cl6 O6.75 -","- C564 H456 Cl72 O81 -","12","1.5","","Robert M. Fairchild; Akil I. Joseph; K. Travis Holman; Heather A. Fogarty; Thierry Brotin; Jean-Pierre Dutasta; Céline Boutin; Gaspard Huber; Patrick Berthault","A Water-Soluble Xe@cryptophane-111 Complex Exhibits Very High Thermodynamic Stability and a Peculiar 129Xe NMR Chemical Shift","Journal of the American Chemical Society","2010","132","","15505","15507","10.1021/ja1071515","","x-ray","0.71073","MoKα","","0.0702","0.0462","","","0.1074","0.1162","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103457","51.168","0.005","10.0144","0.001","25.099","0.003","90","","90","","90","","12861","2","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C47 H38 Cl6 O6 -","- C47 H38 Cl6 O6 -","- C564 H456 Cl72 O72 -","12","1.5","","Robert M. Fairchild; Akil I. Joseph; K. Travis Holman; Heather A. Fogarty; Thierry Brotin; Jean-Pierre Dutasta; Céline Boutin; Gaspard Huber; Patrick Berthault","A Water-Soluble Xe@cryptophane-111 Complex Exhibits Very High Thermodynamic Stability and a Peculiar 129Xe NMR Chemical Shift","Journal of the American Chemical Society","2010","132","","15505","15507","10.1021/ja1071515","","x-ray","0.71073","MoKα","","0.0676","0.0468","","","0.1006","0.1087","","","","","","1.063","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103458","25.8474","0.0012","18.9252","0.0009","17.7103","0.0016","90","","125.01","","90","","7095.7","0.8","100","2","100","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C129 H158 F18 N9 O45 Ru6 S6 -","- C113 H128 F18 O27 Ru6 S6 -","- C226 H256 F36 O54 Ru12 S12 -","2","0.25","","Robert M. Fairchild; Akil I. Joseph; K. Travis Holman; Heather A. Fogarty; Thierry Brotin; Jean-Pierre Dutasta; Céline Boutin; Gaspard Huber; Patrick Berthault","A Water-Soluble Xe@cryptophane-111 Complex Exhibits Very High Thermodynamic Stability and a Peculiar 129Xe NMR Chemical Shift","Journal of the American Chemical Society","2010","132","","15505","15507","10.1021/ja1071515","","","0.71073","MoKα","","0.065","0.0587","","","0.1654","0.1717","","","","","","1.049","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103459","30.5806","0.0007","30.5806","0.0007","68.5594","0.0015","90","","90","","90","","64115","3","120","2","120","2","","","","","","","synthesis as described","4","I 41/a :2","-I 4ad","88","","CpFeMe5C60MeAr5","","- C181 H198 Fe Si5 -","- C146 H111 Fe Si5 -","- C2336 H1776 Fe16 Si80 -","16","1","","Chang-Zhi Li; Yutaka Matsuo; Eiichi Nakamura","Octupole-like Supramolecular Aggregates of Conical Iron Fullerene Complexes into a Three-Dimensional Liquid Crystalline Lattice","Journal of the American Chemical Society","2010","132","","15514","15515","10.1021/ja1073933","","","0.71075","MoKα","","0.2529","0.1418","","","0.3524","0.3835","","","","","","1.815","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103460","8.9439","0.0003","8.9439","0.0003","18.6755","0.0006","90","","90","","90","","1493.92","0.09","123","2","123","2","","","","","","","synthesis as described","5","I 4/m m m","-I 4 2","139","NiTetI2","","","- C24 H32 I2 N8 Ni -","- C24 I2 N8 Ni -","- C48 I4 N16 Ni2 -","2","0.0625","","Neil J. Findlay; Stuart R. Park; Franziska Schoenebeck; Elise Cahard; Sheng-ze Zhou; Leonard E. A. Berlouis; Mark D. Spicer; Tell Tuttle; John A. Murphy","Reductions of Challenging Organic Substrates by a Nickel Complex of a Noninnocent Crown Carbene Ligand","Journal of the American Chemical Society","2010","132","","15462","15464","10.1021/ja107703n","","x-ray","0.71073","MoKα","","0.0315","0.029","","","0.081","0.0824","","","","","","1.166","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103461","7.112","0.0001","12.9684","0.001","16.4161","0.0002","90","","90","","90","","1514.08","0.12","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 N2 O5 -","- C15 H18 N2 O5 -","- C60 H72 N8 O20 -","4","1","","Yuan-Qing Fang; Matthew M. Bio; Karl B. Hansen; Matthew S. Potter; Andrew Clausen","Magnesium Coordination-Directed N-Selective Stereospecific Alkylation of 2-Pyridones, Carbamates, and Amides Using α-Halocarboxylic Acids","Journal of the American Chemical Society","2010","132","","15525","15527","10.1021/ja107709w","","x-ray","1.54178","CuKα","","0.0262","0.0255","","","0.0626","0.0629","","","","","","0.983","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103462","5.4414","0.0002","9.7195","0.0005","16.8074","0.0006","90","","90","","90","","888.9","0.06","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H8 Br N O3 -","- C8 H8 Br N O3 -","- C32 H32 Br4 N4 O12 -","4","1","","Yuan-Qing Fang; Matthew M. Bio; Karl B. Hansen; Matthew S. Potter; Andrew Clausen","Magnesium Coordination-Directed N-Selective Stereospecific Alkylation of 2-Pyridones, Carbamates, and Amides Using α-Halocarboxylic Acids","Journal of the American Chemical Society","2010","132","","15525","15527","10.1021/ja107709w","","x-ray","1.54178","CuKα","","0.0267","0.0264","","","0.0688","0.0689","","","","","","1.071","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103463","10.0655","0.0007","10.9316","0.0008","23.7249","0.0017","90","","90","","90","","2610.5","0.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H24 Br N O3 -","- C33 H24 Br N O3 -","- C132 H96 Br4 N4 O12 -","4","1","","Barry M. Trost; Lara C. Czabaniuk","Palladium-Catalyzed Asymmetric Benzylation of 3-Aryl Oxindoles","Journal of the American Chemical Society","2010","132","","15534","15536","10.1021/ja1079755","","","0.71073","MoKα","","0.0325","0.0258","","","0.0562","0.0579","","","","","","1.027","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103464","8.3125","0.0017","8.8541","0.0018","15.564","0.003","84.9","0.03","86.31","0.03","81.66","0.03","1127.4","0.4","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H35 B10 Li N2 O2 -","- C13 H35 B10 Li N2 O2 -","- C26 H70 B20 Li2 N4 O4 -","2","1","","Peter Dröse; Cristian G. Hrib; Frank T. Edelmann","Carboranylamidinates","Journal of the American Chemical Society","2010","132","","15540","15541","10.1021/ja108051u","","","0.71073","MoKα","","0.0615","0.045","","","0.1012","0.1084","","","","","","1.043","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103465","6.9667","0.0014","15.763","0.003","15.394","0.003","90","","99.95","0.03","90","","1665.1","0.6","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H26 B10 N2 -","- C9 H26 B10 N2 -","- C36 H104 B40 N8 -","4","1","","Peter Dröse; Cristian G. Hrib; Frank T. Edelmann","Carboranylamidinates","Journal of the American Chemical Society","2010","132","","15540","15541","10.1021/ja108051u","","","0.71073","MoKα","","0.1007","0.0729","","","0.1315","0.14","","","","","","1.184","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103466","22.79","0.005","7.8311","0.0016","19.215","0.004","90","","101.3","0.03","90","","3362.8","1.3","133","2","133","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H48 B20 N4 Sn -","- C18 H50 B20 N4 Sn -","- C72 H200 B80 N16 Sn4 -","4","0.5","","Peter Dröse; Cristian G. Hrib; Frank T. Edelmann","Carboranylamidinates","Journal of the American Chemical Society","2010","132","","15540","15541","10.1021/ja108051u","","","0.71073","MoKα","","0.0493","0.0386","","","0.078","0.0806","","","","","","1.085","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103467","13.749","0.003","8.1504","0.0016","15.296","0.003","90","","103.1","0.03","90","","1669.5","0.6","133","2","133","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C18 H50 B20 Cr N4 -","- C18 H50 B20 Cr N4 -","- C36 H100 B40 Cr2 N8 -","2","0.5","","Peter Dröse; Cristian G. Hrib; Frank T. Edelmann","Carboranylamidinates","Journal of the American Chemical Society","2010","132","","15540","15541","10.1021/ja108051u","","","0.71073","MoKα","","0.082","0.0621","","","0.128","0.136","","","","","","1.104","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103468","10.378","0.002","11.887","0.002","15.418","0.003","90","","103.29","0.03","90","","1851.1","0.6","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H50 B20 Cl2 Cr2 N4 -","- C18 H50 B20 Cl2 Cr2 N4 -","- C36 H100 B40 Cl4 Cr4 N8 -","2","0.5","","Peter Dröse; Cristian G. Hrib; Frank T. Edelmann","Carboranylamidinates","Journal of the American Chemical Society","2010","132","","15540","15541","10.1021/ja108051u","","","0.71073","MoKα","","0.049","0.0414","","","0.0896","0.0924","","","","","","1.208","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103469","18.571","0.009","30.944","0.016","47.85","0.02","83.515","0.006","87.051","0.006","89.237","0.006","27285","2","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C366 H438 Au18 N97.5 O189.5 Pd12 -","- C366 H438 Au18 N97.626 O188.373 Pd12 -","- C732 H876 Au36 N195.252 O376.746 Pd24 -","2","1","","Takafumi Osuga; Takashi Murase; Kosuke Ono; Yoshihiro Yamauchi; Makoto Fujita","[mxn] Metal Ion Arrays Templated by Coordination Cages","Journal of the American Chemical Society","2010","132","","15553","15555","10.1021/ja108367j","","","0.71073","MoKα","","0.241","0.1331","","","0.2875","0.3523","","","","","","1.027","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103470","14.5849","0.0011","16.2575","0.0012","18.6167","0.0014","83.672","0.001","77.027","0.001","67.087","0.001","3960.9","0.5","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C76 H74 B3 K N6 O18 -","- C76 H74 B3 K N6 O18 -","- C152 H148 B6 K2 N12 O36 -","2","1","","Hiroshi Danjo; Kadzuya Hirata; Masanori Noda; Susumu Uchiyama; Kiichi Fukui; Masatoshi Kawahata; Isao Azumaya; Kentaro Yamaguchi; Toshifumi Miyazawa","Assembly Modulation by Adjusting Countercharges of Heterobimetallic Supramolecular Polymers Composed of Tris(spiroborate) Twin Bowls","Journal of the American Chemical Society","2010","132","","15556","15558","10.1021/ja1084964","","","0.71073","MoKα","","0.1845","0.1471","","","0.4174","0.4483","","","","","","1.792","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103471","14.1442","0.001","15.7549","0.0011","18.3915","0.0013","84.767","0.001","79.563","0.001","70.997","0.001","3808.6","0.5","150","","150","","","","","","","","","6","P 1","P 1","1","","","","- C157 H153 B6 Ba2 N13 O35 -","- C157 H153 B6 Ba2 N13 O35 -","- C157 H153 B6 Ba2 N13 O35 -","1","1","","Hiroshi Danjo; Kadzuya Hirata; Masanori Noda; Susumu Uchiyama; Kiichi Fukui; Masatoshi Kawahata; Isao Azumaya; Kentaro Yamaguchi; Toshifumi Miyazawa","Assembly Modulation by Adjusting Countercharges of Heterobimetallic Supramolecular Polymers Composed of Tris(spiroborate) Twin Bowls","Journal of the American Chemical Society","2010","132","","15556","15558","10.1021/ja1084964","","","0.71073","MoKα","","0.0653","0.0605","","","0.1792","0.1867","","","","","","1.034","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103472","14.907","0.003","22.538","0.005","33.355","0.007","90","","92.36","0.03","90","","11197","4","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C127 H131 B3 Fe K N9 O16 -","- C127 H131 B3 Fe K N9 O16 -","- C508 H524 B12 Fe4 K4 N36 O64 -","4","1","","Hiroshi Danjo; Kadzuya Hirata; Masanori Noda; Susumu Uchiyama; Kiichi Fukui; Masatoshi Kawahata; Isao Azumaya; Kentaro Yamaguchi; Toshifumi Miyazawa","Assembly Modulation by Adjusting Countercharges of Heterobimetallic Supramolecular Polymers Composed of Tris(spiroborate) Twin Bowls","Journal of the American Chemical Society","2010","132","","15556","15558","10.1021/ja1084964","","","0.7","synchrotron","","0.0868","0.0744","","","0.24","0.2501","","","","","","1.958","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103473","11.4466","0.0019","5.1362","0.0009","15.956","0.003","90","","108.778","0.002","90","","888.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O8 V2 -","- C18 H18 O8 V2 -","- C36 H36 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.0543","0.0386","","","0.1056","0.1132","","","","","","1.089","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103474","11.451","0.002","5.152","0.0011","15.93","0.003","90","","108.564","0.002","90","","890.9","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O8 V2 -","- C18 H18 O8 V2 -","- C36 H36 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.0558","0.0401","","","0.1128","0.1237","","","","","","1.021","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103475","11.4291","0.0008","5.1473","0.0004","15.9034","0.0012","90","","108.513","0.002","90","","887.17","0.11","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O8 V2 -","- C18 H18 O8 V2 -","- C36 H36 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.0533","0.0407","","","0.1181","0.1276","","","","","","1","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103476","11.4179","0.0017","5.1652","0.0008","15.935","0.002","90","","108.046","0.004","90","","893.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O8 V2 -","- C18 H16 O8 V2 -","- C36 H32 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.0891","0.062","","","0.1655","0.1866","","","","","","1.336","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103477","11.4247","0.0015","5.1604","0.0007","15.958","0.002","90","","108.061","0.004","90","","894.5","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O8 V2 -","- C18 H16 O8 V2 -","- C36 H32 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.0871","0.0667","","","0.1831","0.1967","","","","","","1.492","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103478","11.4308","0.0016","5.1524","0.0008","15.995","0.002","90","","108.073","0.004","90","","895.6","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O8 V2 -","- C18 H16 O8 V2 -","- C36 H32 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.1194","0.0893","","","0.2746","0.311","","","","","","1.092","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103479","11.4295","0.0014","5.1454","0.0006","16.0003","0.0019","90","","108.084","0.003","90","","894.49","0.19","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O8 V2 -","- C18 H16 O8 V2 -","- C36 H32 O16 V4 -","2","0.5","","Pabitra Baran Chatterjee; Anandalok Audhya; Subhajit Bhattacharya; Sk Md Towsif Abtab; Kisholoy Bhattacharya; Muktimoy Chaudhury","Single Crystal-to-Single Crystal Irreversible Transformation from a Discrete Vanadium(V)-Alcoholate to an Aldehydic-Vanadium(IV) Oligomer","Journal of the American Chemical Society","2010","132","","15842","15845","10.1021/ja103451j","","","0.71073","MoKα","","0.1166","0.0924","","","0.2796","0.3185","","","","","","1.061","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103480","24.538","0.003","28.186","0.003","18.9595","0.0019","90","","129.526","0.001","90","","10114.5","1.9","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C110 H76 Cl4 Cu F6 N4 P -","- C110 H76 Cl4 Cu F6 N4 P -","- C440 H304 Cl16 Cu4 F24 N16 P4 -","4","0.5","","Sanaz Kabehie; Mei Xue; Adam Z. Stieg; Monty Liong; Kang L. Wang; Jeffrey I. Zink","Heteroleptic Copper Switches","Journal of the American Chemical Society","2010","132","","15987","15996","10.1021/ja103937v","","","0.71073","MoKα","","0.0822","0.0574","","","0.1683","0.1807","","","","","","1.034","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103481","17.387","0.0004","10.5216","0.0002","17.295","0.0004","90","","96.608","0.001","90","","3142.91","0.12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","GdDdtc3Bipy","","","- C25 H38 Gd N5 S6 -","- C25 H38 Gd N5 S6 -","- C100 H152 Gd4 N20 S24 -","4","1","","Rachel S. Selinsky; Jae Hyo Han; Elvin A. Morales Pérez; Ilia A. Guzei; Song Jin","Synthesis and Magnetic Properties of Gd Doped EuS Nanocrystals with Enhanced Curie Temperatures","Journal of the American Chemical Society","2010","132","","15997","16005","10.1021/ja104314c","","","1.54178","Cu-Kα","","0.0231","0.0227","","","0.0587","0.059","","","","","","1.076","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103482","18.2696","0.0016","17.3678","0.0015","26.635","0.002","90","","90","","90","","8451.4","1.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","EuPytc3Bipy","","","- C28 H35 Cl9 Eu N5 S6 -","- C28 H35 Cl9 Eu N5 S6 -","- C224 H280 Cl72 Eu8 N40 S48 -","8","1","","Rachel S. Selinsky; Jae Hyo Han; Elvin A. Morales Pérez; Ilia A. Guzei; Song Jin","Synthesis and Magnetic Properties of Gd Doped EuS Nanocrystals with Enhanced Curie Temperatures","Journal of the American Chemical Society","2010","132","","15997","16005","10.1021/ja104314c","","","0.71073","Mo-Kα","","0.0626","0.0363","","","0.0903","0.1093","","","","","","0.962","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103483","17.4375","0.0005","15.3706","0.0004","13.7483","0.0003","90","","92.703","0.002","90","","3680.79","0.16","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","EuPipdc3Bipy","","","- C29 H39 Cl3 Eu N5 S6 -","- C29 H39 Cl3 Eu N5 S6 -","- C116 H156 Cl12 Eu4 N20 S24 -","4","1","","Rachel S. Selinsky; Jae Hyo Han; Elvin A. Morales Pérez; Ilia A. Guzei; Song Jin","Synthesis and Magnetic Properties of Gd Doped EuS Nanocrystals with Enhanced Curie Temperatures","Journal of the American Chemical Society","2010","132","","15997","16005","10.1021/ja104314c","","","1.54178","Cu-Kα","","0.0612","0.0511","","","0.1232","0.1356","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103484","10.9505","0.0003","13.0006","0.0004","18.4281","0.0005","99.158","0.002","95.478","0.002","103.997","0.002","2488.44","0.13","103","2","103","2","","","","","","","","6","P -1","-P 1","2","EuMpipdc3Phen","","","- C36 H47 Cl9 Eu N5 S6 -","- C35.999 H46.999 Cl8.997 Eu N5 S6 -","- C71.998 H93.998 Cl17.994 Eu2 N10 S12 -","2","1","","Rachel S. Selinsky; Jae Hyo Han; Elvin A. Morales Pérez; Ilia A. Guzei; Song Jin","Synthesis and Magnetic Properties of Gd Doped EuS Nanocrystals with Enhanced Curie Temperatures","Journal of the American Chemical Society","2010","132","","15997","16005","10.1021/ja104314c","","","1.54178","CuKα","","0.0629","0.0573","","","0.1497","0.1548","","","","","","1.09","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103485","18.2665","0.0013","17.3854","0.0012","26.6725","0.0019","90","","90","","90","","8470.4","1","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","GdPytc3Bipy","","- C28 H35 Cl9 Gd N5 S6 -","- C28 H35 Cl9 Gd N5 S6 -","- C224 H280 Cl72 Gd8 N40 S48 -","8","1","","Rachel S. Selinsky; Jae Hyo Han; Elvin A. Morales Pérez; Ilia A. Guzei; Song Jin","Synthesis and Magnetic Properties of Gd Doped EuS Nanocrystals with Enhanced Curie Temperatures","Journal of the American Chemical Society","2010","132","","15997","16005","10.1021/ja104314c","","","0.71073","Mo-Kα","","0.0357","0.0264","","","0.0642","0.0749","","","","","","0.947","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103486","9.0725","0.0009","14.2346","0.0013","14.3882","0.0013","90","","102.88","0.007","90","","1811.4","0.3","223.1","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C15 H13 F6 Ir N3 O3 P -","- C15 H13 F6 Ir N3 O3 P -","- C60 H52 F24 Ir4 N12 O12 P4 -","4","2","","James D. Blakemore; Nathan D. Schley; David Balcells; Jonathan F. Hull; Gerard W. Olack; Christopher D. Incarvito; Odile Eisenstein; Gary W. Brudvig; Robert H. Crabtree","Half-Sandwich Iridium Complexes for Homogeneous Water-Oxidation Catalysis","Journal of the American Chemical Society","2010","132","","16017","16029","10.1021/ja104775j","","","0.71075","MoKα","","","0.0504","","","","0.0823","","","","","","1.081","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103487","12.516","0.005","12.003","0.005","7.566","0.003","90","","90","","90","","1136.6","0.8","223.1","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C7 H11 I2 Ir O S -","- C7 H11 I2 Ir O S -","- C28 H44 I8 Ir4 O4 S4 -","4","1","","James D. Blakemore; Nathan D. Schley; David Balcells; Jonathan F. Hull; Gerard W. Olack; Christopher D. Incarvito; Odile Eisenstein; Gary W. Brudvig; Robert H. Crabtree","Half-Sandwich Iridium Complexes for Homogeneous Water-Oxidation Catalysis","Journal of the American Chemical Society","2010","132","","16017","16029","10.1021/ja104775j","","","0.71075","MoKα","","","0.0201","","","","0.04","","","","","","0.963","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103488","9.195","0.002","14.501","0.004","15.944","0.004","87.066","0.006","86.709","0.005","82.824","0.006","2103.7","0.9","223.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H35 Cl2 Ir N2 O2 -","- C16 H35 Cl2 Ir N2 O2 -","- C64 H140 Cl8 Ir4 N8 O8 -","4","2","","James D. Blakemore; Nathan D. Schley; David Balcells; Jonathan F. Hull; Gerard W. Olack; Christopher D. Incarvito; Odile Eisenstein; Gary W. Brudvig; Robert H. Crabtree","Half-Sandwich Iridium Complexes for Homogeneous Water-Oxidation Catalysis","Journal of the American Chemical Society","2010","132","","16017","16029","10.1021/ja104775j","","","0.71075","MoKα","","","0.0344","","","","0.066","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103489","10.7369","0.0007","12.7746","0.0009","13.1044","0.0009","108.229","0.0014","104.709","0.0015","94.1493","0.0015","1628.55","0.19","223.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C15 H13 I Ir N3 O3 -","- C15 H13 I Ir N3 O3 -","- C60 H52 I4 Ir4 N12 O12 -","4","2","","James D. Blakemore; Nathan D. Schley; David Balcells; Jonathan F. Hull; Gerard W. Olack; Christopher D. Incarvito; Odile Eisenstein; Gary W. Brudvig; Robert H. Crabtree","Half-Sandwich Iridium Complexes for Homogeneous Water-Oxidation Catalysis","Journal of the American Chemical Society","2010","132","","16017","16029","10.1021/ja104775j","","","0.71075","MoKα","","","0.0396","","","","0.0734","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103490","11.4329","0.0014","16.816","0.002","32.393","0.004","90","","90","","90","","6227.7","1.3","223","2","223","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C65 H72 Br2 Cl2 N4 O4 S2 -","- C65 H72 Br2 Cl2 N4 O4 S2 -","- C260 H288 Br8 Cl8 N16 O16 S8 -","4","1","","Tomoya Miura; Masao Morimoto; Masahiro Murakami","Enantioselective [2 + 2 + 2] Cycloaddition Reaction of Isocyanates and Allenes Catalyzed by Nickel","Journal of the American Chemical Society","2010","132","","15836","15838","10.1021/ja105541r","","","0.71075","MoKα","","0.1013","0.0785","","","0.1947","0.2101","","","","","","1.077","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103491","21.7968","0.0012","13.1593","0.0007","13.3171","0.0007","90","","99.185","0.003","90","","3770.8","0.4","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H36 Cu2 N6 -","- C48 H36 Cu2 N6 -","- C192 H144 Cu8 N24 -","4","0.5","","Ramesh Giri; John F. Hartwig","Cu(I)-Amido Complexes in the Ullmann Reaction: Reactions of Cu(I)-Amido Complexes with Iodoarenes with and without Autocatalysis by CuI","Journal of the American Chemical Society","2010","132","","15860","15863","10.1021/ja105695s","","","0.71073","MoKα","","0.0512","0.0304","","","0.0688","0.0778","","","","","","1.056","","","","has coordinates,has disorder","178780","2020-10-21","18:00:00","" "4103492","10.4811","0.0009","25.167","0.002","18.0748","0.0014","90","","100.536","0.003","90","","4687.3","0.7","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H44 Cu K N8 -","- C60 H44 Cu K N8 -","- C240 H176 Cu4 K4 N32 -","4","1","","Ramesh Giri; John F. Hartwig","Cu(I)-Amido Complexes in the Ullmann Reaction: Reactions of Cu(I)-Amido Complexes with Iodoarenes with and without Autocatalysis by CuI","Journal of the American Chemical Society","2010","132","","15860","15863","10.1021/ja105695s","","","0.71073","MoKα","","0.0594","0.0412","","","0.1041","0.1124","","","","","","1.098","","","","has coordinates","271475","2021-12-16","11:44:43","" "4103493","6.0303","0.0012","6.5098","0.0013","8.3072","0.0016","112.082","0.002","96.667","0.003","108.792","0.003","275.42","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C4 H6 Cl4 O4 Tc2 -","- C4 H6 Cl4 O4 Tc2 -","- C4 H6 Cl4 O4 Tc2 -","1","0.5","","Frederic Poineau; Erik V. Johnstone; Philippe F. Weck; Eunja Kim; Paul M. Forster; Brian L. Scott; Alfred P. Sattelberger; Kenneth R. Czerwinski","Synthesis and Structure of Technetium Trichloride","Journal of the American Chemical Society","2010","132","","15864","15865","10.1021/ja105730e","","","0.71073","MoKα","","0.0279","0.0256","","","0.0689","0.0699","","","","","","1.079","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103494","10.1035","0.0019","10.1035","0.0019","20.12","0.008","90","","90","","120","","1778.7","0.9","140","1","140","1","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Cl3 Tc -","- Cl3 Tc -","- Cl54 Tc18 -","18","0.5","","Frederic Poineau; Erik V. Johnstone; Philippe F. Weck; Eunja Kim; Paul M. Forster; Brian L. Scott; Alfred P. Sattelberger; Kenneth R. Czerwinski","Synthesis and Structure of Technetium Trichloride","Journal of the American Chemical Society","2010","132","","15864","15865","10.1021/ja105730e","","","0.71073","MoKα","","0.0397","0.0365","","","0.1446","0.1477","","","","","","1.375","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103495","9.626","0.006","17.645","0.012","12.048","0.008","90","","111.742","0.01","90","","1901","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H30 B10 -","- C14 H30 B10 -","- C56 H120 B40 -","4","1","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.1418","0.0746","","","0.1613","0.1993","","","","","","1.044","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103496","17.164","0.015","9.756","0.009","12.097","0.011","90","","90","","90","","2026","3","296","2","296","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C15 H32 B10 -","- C15 H32 B10 -","- C60 H128 B40 -","4","1","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.0838","0.0484","","","0.1062","0.1257","","","","","","1.082","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103497","9.771","0.003","14.55","0.005","16.814","0.006","90","","90","","90","","2390.4","1.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H38 B10 Si -","- C17 H38 B10 Si -","- C68 H152 B40 Si4 -","4","1","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.0457","0.039","","","0.1079","0.1144","","","","","","1.049","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103498","38.9899","0.0014","38.9899","0.0014","12.1613","0.0004","90","","90","","120","","16010.9","1","173","2","173","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C31 H32 B10 -","- C31 H32 B10 -","- C558 H576 B180 -","18","1","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.1075","0.0687","","","0.2047","0.2274","","","","","","1.056","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103499","12.6407","0.001","8.9507","0.0008","22.2876","0.0017","90","","98.526","0.002","90","","2493.8","0.4","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H32 B10 -","- C23 H32 B10 -","- C92 H128 B40 -","4","2","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.1397","0.0515","","","0.1027","0.1455","","","","","","1.001","","","","has coordinates","178780","2020-10-21","18:00:00","" "4103500","8.9391","0.0011","17.6712","0.0019","16.0679","0.0017","90","","91.454","0.002","90","","2537.3","0.5","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H32 B10 -","- C23 H32 B10 -","- C92 H128 B40 -","4","1","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.1269","0.0817","","","0.2479","0.296","","","","","","1.094","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103501","9.311","0.006","7.728","0.005","24.422","0.016","90","","91.05","0.012","90","","1757","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H22 B10 -","- C13 H22 B10 -","- C52 H88 B40 -","4","1","","Zaozao Qiu; Zuowei Xie","Palladium/Nickel-Cocatalyzed Cycloaddition of 1,3-Dehydro-o-Carborane with Alkynes. Facile Synthesis of C,B-Substituted Carboranes","Journal of the American Chemical Society","2010","132","","16085","16093","10.1021/ja1058789","","","0.71073","MoKα","","0.138","0.0899","","","0.2508","0.3104","","","","","","1.035","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103502","10.724","0.003","15.122","0.005","11.474","0.004","90","","97.422","0.004","90","","1845.1","1","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","10075","","","- C40 H50 Cu N4 O2 -","- C40 H50 Cu N4 O2 -","- C80 H100 Cu2 N8 O4 -","2","1","","Patrick J. Donoghue; Aalo K. Gupta; David W. Boyce; Christopher J. Cramer; William B. Tolman","An Anionic, tetragonal Copper(II) Superoxide Complex","Journal of the American Chemical Society","2010","132","","15869","15871","10.1021/ja106244k","","","0.71073","MoKα","","0.0618","0.0435","","","0.0938","0.1002","","","","","","1","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103503","36.805","0.003","5.7499","0.0004","7.9908","0.0005","90","","99.837","0.003","90","","1666.2","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","JJ-2-30","zuckermann01","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","0.5","","Hannah K. Murnen; Adrianne M. Rosales; Jonathan N. Jaworski; Rachel A. Segalman; Ronald N. Zuckermann","Hierarchical Self-Assembly of a Biomimetic Diblock Copolypeptoid into Homochiral Superhelices","Journal of the American Chemical Society","2010","132","","16112","16119","10.1021/ja106340f","","","1.54178","CuKα","","0.0551","0.053","","","0.1452","0.146","","","","","","1.302","","","","has coordinates","204147","2020-10-21","18:00:00","" "4103504","9.8776","0.0008","12.953","0.0011","15.5488","0.0013","81.634","0.007","83.316","0.007","82.826","0.007","1943","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.31.8 (release 12-01-2007 CrysAlis171 .NET) (compiled Jan 12 2007,17:49:11)","","- C38 H58 N4 Ni O Si2 -","- C38 H58 N4 Ni O Si2 -","- C76 H116 N8 Ni2 O2 Si4 -","2","1","","Wenyuan Wang; Shigeyoshi Inoue; Shenglai Yao; Matthias Driess","An Isolable Bis-Silylene Oxide (""Disilylenoxane"") and Its Metal Coordination","Journal of the American Chemical Society","2010","132","","15890","15892","10.1021/ja106458p","","","0.71073","MoKα","","0.0605","0.0386","","","0.0807","0.0853","","","","","","0.948","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103505","31.188","0.002","39.12","0.003","10.262","0.0006","90","","90","","90","","12520.4","1.4","150","2","150","2","","","","","","","","5","F d d 2","F 2 -2d","43","","CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.31.8 (release 12-01-2007 CrysAlis171 .NET) (compiled Jan 12 2007,17:49:11)","","- C30 H46 N4 O Si2 -","- C30 H46 N4 O Si2 -","- C480 H736 N64 O16 Si32 -","16","1","","Wenyuan Wang; Shigeyoshi Inoue; Shenglai Yao; Matthias Driess","An Isolable Bis-Silylene Oxide (""Disilylenoxane"") and Its Metal Coordination","Journal of the American Chemical Society","2010","132","","15890","15892","10.1021/ja106458p","","","0.71073","MoKα","","0.0754","0.0488","","","0.0604","0.065","","","","","","0.897","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103506","12.1593","0.0005","16.2045","0.0006","17.1248","0.0007","90","","98.177","0.004","90","","3339.9","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","CrysAlis RED, Oxford Diffraction Ltd., Version 1.171.31.8 (release 12-01-2007 CrysAlis171 .NET) (compiled Jan 12 2007,17:49:11)","","- C30 H48 Cl2 N4 O Si2 -","- C30 H48 Cl2 N4 O Si2 -","- C120 H192 Cl8 N16 O4 Si8 -","4","1","","Wenyuan Wang; Shigeyoshi Inoue; Shenglai Yao; Matthias Driess","An Isolable Bis-Silylene Oxide (""Disilylenoxane"") and Its Metal Coordination","Journal of the American Chemical Society","2010","132","","15890","15892","10.1021/ja106458p","","","0.71073","MoKα","","0.0905","0.0543","","","0.108","0.1194","","","","","","1.035","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103507","9.3855","0.0003","15.6669","0.0008","20.7398","0.0011","90","","95.827","0.003","90","","3033.9","0.2","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","6","P 1 21/n 1","-P 2yn","14","(NEt4)2[Fe2(mu-NtBu)(mu-S)Cl2]","","","- C20 H49 Cl4 Fe2 N3 S -","- C20 H49 Cl4 Fe2 N3 S -","- C80 H196 Cl16 Fe8 N12 S4 -","4","1","","Xu-Dong Chen; Jeremiah S. Duncan; Atul K. Verma; Sonny C. Lee","Selective Syntheses of Iron-Imide-Sulfide Cubanes, Including a Partial Representation of the Fe-S-X Environment in the FeMo Cofactor","Journal of the American Chemical Society","2010","132","","15884","15886","10.1021/ja106478k","","","0.71073","MoKα","","0.1004","0.0534","","0.1618","0.1331","","","","1.031","1.082","1.082","","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103508","16.4939","0.0008","9.0249","0.0005","23.5935","0.0013","90","","101.945","0.002","90","","3436","0.3","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","6","P 1 21/n 1","-P 2yn","14","Fe2(mu-NHtBu)(mu-S)[N(TMS)2]2","","","- C20 H56 Fe2 N4 S Si4 -","- C20 H56 Fe2 N4 S Si4 -","- C80 H224 Fe8 N16 S4 Si16 -","4","1","","Xu-Dong Chen; Jeremiah S. Duncan; Atul K. Verma; Sonny C. Lee","Selective Syntheses of Iron-Imide-Sulfide Cubanes, Including a Partial Representation of the Fe-S-X Environment in the FeMo Cofactor","Journal of the American Chemical Society","2010","132","","15884","15886","10.1021/ja106478k","","","0.71073","MoKα","","0.1409","0.0604","","0.1301","0.1053","","","","1.027","1.144","1.144","","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103509","23.4155","0.001","20.7305","0.0009","17.8411","0.0013","90","","130.166","0.001","90","","6618","0.6","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(Et4N)[Fe4(mu3-NtBu)3(mu3-S)Cl4]","(Et4N)[Fe4(mu3-NtBu)3(mu3-S)Cl4]","","- C20 H47 Cl4 Fe4 N4 S -","- C20 H47 Cl4 Fe4 N4 S -","- C160 H376 Cl32 Fe32 N32 S8 -","8","1","","Xu-Dong Chen; Jeremiah S. Duncan; Atul K. Verma; Sonny C. Lee","Selective Syntheses of Iron-Imide-Sulfide Cubanes, Including a Partial Representation of the Fe-S-X Environment in the FeMo Cofactor","Journal of the American Chemical Society","2010","132","","15884","15886","10.1021/ja106478k","","","0.71073","MoKα","","0.0488","0.033","","","0.0722","0.0804","","","","","","1.023","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103510","17.8185","0.0012","11.3121","0.0007","22.1301","0.0014","90","","108.795","0.001","90","","4222.8","0.5","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Et4N)2[Fe4(mu3-NtBu)2(mu3-S)2Cl4]","(Et4N)2[Fe4(mu3-NtBu)2(mu3-S)2Cl4]","","- C24 H58 Cl4 Fe4 N4 S2 -","- C24 H58 Cl4 Fe4 N4 S2 -","- C96 H232 Cl16 Fe16 N16 S8 -","4","1","","Xu-Dong Chen; Jeremiah S. Duncan; Atul K. Verma; Sonny C. Lee","Selective Syntheses of Iron-Imide-Sulfide Cubanes, Including a Partial Representation of the Fe-S-X Environment in the FeMo Cofactor","Journal of the American Chemical Society","2010","132","","15884","15886","10.1021/ja106478k","","","0.71073","MoKα","","0.0895","0.0498","","","0.102","0.1188","","","","","","0.978","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103511","26.4805","0.0011","10.7835","0.0004","12.7847","0.0005","90","","90","","90","","3650.7","0.2","200","2","200","2","","","","","","","","6","P c a 21","P 2c -2ac","29","(Et4N)2[Fe4(mu3-NtBu)(mu3-S)3Cl4].(CH3CN)","(Et4N)2[Fe4(mu3-NtBu)(mu3-S)3Cl4].(CH3CN)","","- C22 H52 Cl4 Fe4 N4 S3 -","- C22 H52 Cl4 Fe4 N4 S3 -","- C88 H208 Cl16 Fe16 N16 S12 -","4","1","","Xu-Dong Chen; Jeremiah S. Duncan; Atul K. Verma; Sonny C. Lee","Selective Syntheses of Iron-Imide-Sulfide Cubanes, Including a Partial Representation of the Fe-S-X Environment in the FeMo Cofactor","Journal of the American Chemical Society","2010","132","","15884","15886","10.1021/ja106478k","","","0.71073","MoKα","","0.0469","0.0379","","","0.0805","0.0889","","","","","","1.072","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103512","25.0996","0.0005","25.0996","0.0005","70.9292","0.0016","90","","90","","90","","44684.7","1.6","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C216 H359.2 Mn40 N8 Na4 O169.6 -","- C216 H340 Mn40 N8 Na4 O169.6 -","- C864 H1360 Mn160 N32 Na16 O678.4 -","4","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","Inducing Single-Molecule Magnetism in a Family of Loop-of-Loops Aggregates: Heterometallic Mn40Na4 Clusters and the Homometallic Mn44 Analogue","Journal of the American Chemical Society","2010","132","","16146","16155","10.1021/ja106666h","","","0.71073","MoKα","","0.114","0.0545","","","0.1537","0.1723","","","","","","0.906","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103513","25.8279","0.0004","25.8279","0.0004","33.8254","0.0011","90","","90","","90","","22564.3","0.9","100","2","100","2","","","","","","","","7","P -4 21 c","P -4 2n","114","","","","- C226 H360 Cl20 Mn40 N8 Na4 O160 -","- C226 H360 Cl20 Mn40 N8 Na4 O160 -","- C452 H720 Cl40 Mn80 N16 Na8 O320 -","2","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","Inducing Single-Molecule Magnetism in a Family of Loop-of-Loops Aggregates: Heterometallic Mn40Na4 Clusters and the Homometallic Mn44 Analogue","Journal of the American Chemical Society","2010","132","","16146","16155","10.1021/ja106666h","","","0.71073","MoKα","","0.1591","0.0679","","","0.1517","0.1667","","","","","","0.961","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103514","34.5332","0.0004","34.5332","0.0004","100.3812","0.0017","90","","90","","90","","119709","3","100","2","100","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C236 H436 Mn40 N4 Na4 O182 -","- C236 H400 Mn40 N4 Na4 O182 -","- C1888 H3200 Mn320 N32 Na32 O1456 -","8","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","Inducing Single-Molecule Magnetism in a Family of Loop-of-Loops Aggregates: Heterometallic Mn40Na4 Clusters and the Homometallic Mn44 Analogue","Journal of the American Chemical Society","2010","132","","16146","16155","10.1021/ja106666h","","","0.71073","MoKα","","0.1915","0.0954","","","0.2547","0.3078","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103515","23.9377","0.0003","23.9377","0.0003","70.072","0.0016","90","","90","","90","","40152.2","1.2","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C216 H355 Cl Mn44 N8 O173 -","- C216 H340 Cl Mn44 N8 O173 -","- C864 H1360 Cl4 Mn176 N32 O692 -","4","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","Inducing Single-Molecule Magnetism in a Family of Loop-of-Loops Aggregates: Heterometallic Mn40Na4 Clusters and the Homometallic Mn44 Analogue","Journal of the American Chemical Society","2010","132","","16146","16155","10.1021/ja106666h","","","0.71073","MoKα","","0.1262","0.0664","","","0.1597","0.1714","","","","","","1.01","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103516","15.8542","0.0007","15.8542","0.0007","4.1273","0.0003","90","","90","","90","","1037.42","0.1","296","2","296","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C7 H5 F N3 S4 -","- C7 H5 F N3 S4 -","- C28 H20 F4 N12 S16 -","4","0.5","","Kristina Lekin; Stephen M. Winter; Laura E. Downie; Xuezhao Bao; John S. Tse; Serge Desgreniers; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Hysteretic Spin Crossover between a Bisdithiazolyl Radical and Its Hypervalent σ-Dimer","Journal of the American Chemical Society","2010","132","","16212","16224","10.1021/ja106768z","","","0.71073","MoKα","","0.033","0.0309","","","0.0714","0.073","","","","","","1.158","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103517","5.3256","0.0003","11.3951","0.0007","17.3934","0.001","90","","105.105","0.002","90","","1019.06","0.1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","FBPEt_dimer","","","- C14 H10 F2 N6 S8 -","- C14 H10 F2 N6 S8 -","- C28 H20 F4 N12 S16 -","2","0.5","","Kristina Lekin; Stephen M. Winter; Laura E. Downie; Xuezhao Bao; John S. Tse; Serge Desgreniers; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Hysteretic Spin Crossover between a Bisdithiazolyl Radical and Its Hypervalent σ-Dimer","Journal of the American Chemical Society","2010","132","","16212","16224","10.1021/ja106768z","","","0.71073","MoKα","","0.0504","0.0364","","","0.0835","0.0942","","","","","","1.077","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103518","5.3225","0.0006","11.091","0.001","17.1492","0.0015","90","","105.095","0.008","90","","977.42","0.17","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","FBPEt","","","- C7 H5 F N3 S4 -","- C7 H5 F N3 S4 -","- C28 H20 F4 N12 S16 -","4","1","","Kristina Lekin; Stephen M. Winter; Laura E. Downie; Xuezhao Bao; John S. Tse; Serge Desgreniers; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Hysteretic Spin Crossover between a Bisdithiazolyl Radical and Its Hypervalent σ-Dimer","Journal of the American Chemical Society","2010","132","","16212","16224","10.1021/ja106768z","powder diffraction","x-ray","0.50918","","","","","","","","","0.18362","","0.5","","","","","","","has coordinates,has Fobs","178781","2020-10-21","18:00:00","" "4103519","5.1026","0.0005","11.0754","0.0009","17.1529","0.0016","90","","104.824","0.008","90","","937.1","0.15","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","FBPEt","","","- C7 H5 F N3 S4 -","- C7 H5 F N3 S4 -","- C28 H20 F4 N12 S16 -","4","1","","Kristina Lekin; Stephen M. Winter; Laura E. Downie; Xuezhao Bao; John S. Tse; Serge Desgreniers; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Hysteretic Spin Crossover between a Bisdithiazolyl Radical and Its Hypervalent σ-Dimer","Journal of the American Chemical Society","2010","132","","16212","16224","10.1021/ja106768z","powder diffraction","x-ray","0.50918","","","","","","","","","0.15847","","0.58","","","","","","","has coordinates,has Fobs","178781","2020-10-21","18:00:00","" "4103520","5.2038","0.00035","11.6317","0.0004","17.7657","0.0009","90","","105.746","0.005","90","","1034.99","0.1","393","","393","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","FBPEt","","","- C7 H5 F N3 S4 -","- C7 H5 F N3 S4 -","- C28 H20 F4 N12 S16 -","4","1","","Kristina Lekin; Stephen M. Winter; Laura E. Downie; Xuezhao Bao; John S. Tse; Serge Desgreniers; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Hysteretic Spin Crossover between a Bisdithiazolyl Radical and Its Hypervalent σ-Dimer","Journal of the American Chemical Society","2010","132","","16212","16224","10.1021/ja106768z","powder diffraction","x-ray","1.5405","CuKα","","","","","","","","0.61512","","1151.95","","","","","","","has coordinates,has Fobs","178781","2020-10-21","18:00:00","" "4103521","19.6727","0.0004","7.742","0.0001","10.7323","0.0002","90","","91.791","0.001","90","","1633.8","0.05","103","2","103","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C18 H18 Cl In O2 -","- C18 H18 Cl In O2 -","- C72 H72 Cl4 In4 O8 -","4","1","","Zhi-Liang Shen; Kelvin Kau Kiat Goh; Hao-Lun Cheong; Colin Hong An Wong; Yin-Chang Lai; Yong-Sheng Yang; Teck-Peng Loh","Synthesis of Water-Tolerant Indium Homoenolate in Aqueous Media and Its Application in the Synthesis of 1,4-Dicarbonyl Compounds via Palladium-Catalyzed Coupling with Acid Chloride","Journal of the American Chemical Society","2010","132","","15852","15855","10.1021/ja106925f","","","0.71073","MoKα","","0.03","0.0268","","","0.0621","0.0637","","","","","","1.018","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103522","20.38","0.004","20.556","0.004","35.192","0.007","90.28","0.03","92.8","0.03","109.91","0.03","13842","5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","Ga4L6 supramolecular cluster","","","- C214.5 H216.5 Ga4 K3 N13 O44.25 P5 -","- C214.497 H149 Ga4 K3 N13 O44.25 P5 -","- C428.994 H298 Ga8 K6 N26 O88.5 P10 -","2","1","","Jeffrey S. Mugridge; Géza Szigethy; Robert G. Bergman; Kenneth N. Raymond","Encapsulated Guest-Host Dynamics: Guest Rotational Barriers and Tumbling as a Probe of Host Interior Cavity Space","Journal of the American Chemical Society","2010","132","","16256","16264","10.1021/ja107656g","","","1.54178","CuKα","","0.1248","0.1038","","","0.2784","0.3028","","","","","","1.097","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103523","34.674","0.002","34.674","0.002","6.0958","0.0004","90","","90","","120","","6347","0.7","170","2","170","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C11 H21 N3 O3 -","- C11 H21 N3 O3 -","- C198 H378 N54 O54 -","18","1","","Shuichi Suzuki; Takanori Furui; Masato Kuratsu; Masatoshi Kozaki; Daisuke Shiomi; Kazunobu Sato; Takeji Takui; Keiji Okada","Nitroxide-Substituted Nitronyl Nitroxide and Iminonitroxide","Journal of the American Chemical Society","2010","132","","15908","15910","10.1021/ja107769z","","","0.7107","MoKα","","0.0807","0.0756","","","0.184","0.1868","","","","","","1.172","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103524","6.118","0.002","17.652","0.006","12.494","0.004","90","","109.434","0.006","90","","1272.4","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H21 N3 O2 -","- C11 H21 N3 O2 -","- C44 H84 N12 O8 -","4","1","","Shuichi Suzuki; Takanori Furui; Masato Kuratsu; Masatoshi Kozaki; Daisuke Shiomi; Kazunobu Sato; Takeji Takui; Keiji Okada","Nitroxide-Substituted Nitronyl Nitroxide and Iminonitroxide","Journal of the American Chemical Society","2010","132","","15908","15910","10.1021/ja107769z","","","0.7107","MoKα","","0.0923","0.0793","","","0.1235","0.1287","","","","","","1.153","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103525","15.631","0.004","12.413","0.003","18.049","0.004","90","","90","","90","","3502","1.5","100","0.1","100","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","jonme10","","","- C15 H26 Br N P Rh -","- C15 H26 Br N P Rh -","- C120 H208 Br8 N8 P8 Rh8 -","8","1","","Meagan E. Evans; Ting Li; William D. Jones","C-H vs C-C Bond Activation of Acetonitrile and Benzonitrile via Oxidative Addition: Rhodium vs Nickel and Cp* vs Tp' (Tp' = Hydrotris(3,5-dimethylpyrazol-1-yl)borate, Cp* = η5-Pentamethylcyclopentadienyl)","Journal of the American Chemical Society","2010","132","","16278","16284","10.1021/ja107927b","","","0.71073","MoKα","","0.1083","0.0507","","","0.0984","0.1154","","","","","","1.046","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103526","16.447","0.002","12.741","0.0018","7.6738","0.0011","90","","90","","90","","1608.1","0.4","100","0.1","100","0.1","","","","","","","","5","P n m a","-P 2ac 2n","62","jonme07","","","- C15 H27 N P Rh -","- C15 H27 N P Rh -","- C60 H108 N4 P4 Rh4 -","4","0.5","","Meagan E. Evans; Ting Li; William D. Jones","C-H vs C-C Bond Activation of Acetonitrile and Benzonitrile via Oxidative Addition: Rhodium vs Nickel and Cp* vs Tp' (Tp' = Hydrotris(3,5-dimethylpyrazol-1-yl)borate, Cp* = η5-Pentamethylcyclopentadienyl)","Journal of the American Chemical Society","2010","132","","16278","16284","10.1021/ja107927b","","","0.71073","MoKα","","0.0299","0.0272","","","0.0698","0.0705","","","","","","1.423","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103527","8.1053","0.0013","8.7271","0.0013","15.88","0.002","89.287","0.003","76.682","0.003","67.204","0.003","1004","0.3","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","jonme12","","","- C20 H30 N O0.5 P Rh -","- C20 H30 N O0.5 P Rh -","- C40 H60 N2 O P2 Rh2 -","2","1","","Meagan E. Evans; Ting Li; William D. Jones","C-H vs C-C Bond Activation of Acetonitrile and Benzonitrile via Oxidative Addition: Rhodium vs Nickel and Cp* vs Tp' (Tp' = Hydrotris(3,5-dimethylpyrazol-1-yl)borate, Cp* = η5-Pentamethylcyclopentadienyl)","Journal of the American Chemical Society","2010","132","","16278","16284","10.1021/ja107927b","","","0.71073","MoKα","","0.0356","0.0289","","","0.0663","0.0697","","","","","","1.05","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103528","17.6562","0.0004","17.6562","0.0004","4.5121","0.0001","90","","90","","90","","1406.61","0.05","100","2","100","2","","","","","","","","4","P -4 n 2","P -4 -2n","118","2,2'-diisocyano-1,1',3,3'-tetraethoxycarbonyl-6,6'-biazulenyl","","","- C34 H28 N2 O8 -","- C34 H28 N2 O8 -","- C68 H56 N4 O16 -","2","0.25","","Tiffany R. Maher; Andrew D. Spaeth; Brad M. Neal; Cindy L. Berrie; Ward H. Thompson; Victor W. Day; Mikhail V. Barybin","Linear 6,6'-Biazulenyl Framework Featuring Isocyanide Termini: Synthesis, Structure, Redox Behavior, Complexation, and Self-Assembly on Au(111)","Journal of the American Chemical Society","2010","132","","15924","15926","10.1021/ja108202d","","","1.54178","CuKα","","0.0314","0.03","","","0.0784","0.0794","","","","","","1.096","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103529","7.661","0.0015","10.065","0.002","16.229","0.003","90","","91.179","0.011","90","","1251.1","0.4","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C6 H8 N2 O -","- C6 H8 N2 O -","- C48 H64 N16 O8 -","8","4","","Zhenfeng Zhang; Fang Xie; Jia Jia; Wanbin Zhang","Chiral Bicycle Imidazole Nucleophilic Catalysts: Rational Design, Facile Synthesis, and Successful Application in Asymmetric Steglich Rearrangement","Journal of the American Chemical Society","2010","132","","15939","15941","10.1021/ja109069k","","","1.54178","CuKα","","0.0485","0.0389","","","0.1026","0.1176","","","","","","1.15","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103530","15.3654","0.0008","17.7225","0.0009","21.0786","0.001","100.623","0.003","93.62","0.002","94.919","0.003","5602.5","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C119 H129 Cl2 Co2 N15 O5 -","- C119 H129 Cl2 Co2 N15 O5 -","- C238 H258 Cl4 Co4 N30 O10 -","2","1","","Renee M. Thomas; Peter C. B. Widger; Syud M. Ahmed; Ryan C. Jeske; Wataru Hirahata; Emil B. Lobkovsky; Geoffrey W. Coates","Enantioselective Epoxide Polymerization Using a Bimetallic Cobalt Catalyst","Journal of the American Chemical Society","2010","132","","16520","16525","10.1021/ja1058422","","","0.71073","MoKα","","0.0974","0.0574","","","0.1471","0.1641","","","","","","1.028","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103531","8.4136","0.0006","13.2172","0.0007","37.7991","0.0016","90.22","0.004","91.244","0.005","90.444","0.005","4202.3","0.4","110","2","110","2","","","","","","","","6","P -1","-P 1","2","Bis(ethylenedithio)tetrathiafulvalene tetrakis(trifluoromethyl)argentate(III) 1,1,2-trichloroethane","","","- C26 H19 Ag Cl3 F12 S16 -","- C26 H19 Ag Cl3 F12 S16 -","- C104 H76 Ag4 Cl12 F48 S64 -","4","2","","John A. Schlueter; Leonore Wiehl; Hyunsoo Park; Mariano de Souza; Michael Lang; Hyun-Joo Koo; Myung-Hwan Whangbo","Enhanced Critical Temperature in a Dual-Layered Molecular Superconductor","Journal of the American Chemical Society","2010","132","","16308","16310","10.1021/ja105854m","","","0.71073","MoKα","","0.0786","0.0645","","","0.1272","0.1335","","","","","","1.095","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103532","16.8961","0.0019","11.5086","0.0014","17.34","0.002","90","","102.729","0.002","90","","3288.9","0.7","153","2","153","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C24 H40 Cl F6 N4 O6 P S2 -","- C24 H40 Cl F6 N4 O6 P S2 -","- C96 H160 Cl4 F24 N16 O24 P4 S8 -","4","1","","Jan J. Weigand; Kai-Oliver Feldmann; Florian D. Henne","Carbene-Stabilized Phosphorus(III)-Centered Cations [LPX~2~]^+^ and [L~2~PX]^2+^ (L = NHC; X = Cl, CN, N~3~)","Journal of the American Chemical Society","2010","132","","16321","16323","10.1021/ja106172d","","","0.71073","MoKα","","0.0649","0.0562","","","0.1552","0.1632","","","","","","1.025","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103533","9.2133","0.0003","13.2202","0.0004","15.7172","0.0005","90","","93.999","0.002","90","","1909.72","0.1","153","2","153","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 F3 N4 O3 P S -","- C14 H20 F3 N4 O3 P S -","- C56 H80 F12 N16 O12 P4 S4 -","4","1","","Jan J. Weigand; Kai-Oliver Feldmann; Florian D. Henne","Carbene-Stabilized Phosphorus(III)-Centered Cations [LPX~2~]^+^ and [L~2~PX]^2+^ (L = NHC; X = Cl, CN, N~3~)","Journal of the American Chemical Society","2010","132","","16321","16323","10.1021/ja106172d","","","1.54178","CuKα","","0.0384","0.0362","","","0.0964","0.0981","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103534","9.1924","0.0004","21.2386","0.0007","20.6522","0.0008","90","","90.117","0.003","90","","4032","0.3","153","2","153","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 F3 N8 O3 P S -","- C12 H20 F3 N8 O3 P S -","- C96 H160 F24 N64 O24 P8 S8 -","8","2","","Jan J. Weigand; Kai-Oliver Feldmann; Florian D. Henne","Carbene-Stabilized Phosphorus(III)-Centered Cations [LPX~2~]^+^ and [L~2~PX]^2+^ (L = NHC; X = Cl, CN, N~3~)","Journal of the American Chemical Society","2010","132","","16321","16323","10.1021/ja106172d","","","1.54178","CuKα","","0.0582","0.0464","","","0.1213","0.1292","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103535","15.8923","0.0009","9.1889","0.0005","23.6454","0.0011","90","","106.187","0.004","90","","3316.1","0.3","153","2","153","1","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H40 F6 N5 O6 P S2 -","- C25 H40 F6 N5 O6 P S2 -","- C100 H160 F24 N20 O24 P4 S8 -","4","2","","Jan J. Weigand; Kai-Oliver Feldmann; Florian D. Henne","Carbene-Stabilized Phosphorus(III)-Centered Cations [LPX~2~]^+^ and [L~2~PX]^2+^ (L = NHC; X = Cl, CN, N~3~)","Journal of the American Chemical Society","2010","132","","16321","16323","10.1021/ja106172d","","","1.54178","CuKα","","0.0629","0.0575","","","0.1513","0.1562","","","","","","1.037","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103536","10.1689","0.0003","10.577","0.0004","17.9056","0.0005","82.943","0.002","85.659","0.002","79.724","0.002","1877.76","0.11","153","1","153","1","","","","","","","","8","P -1","-P 1","2","","","","- C25 H42 Cl2 F6 N7 O6 P S2 -","- C25 H42 Cl2 F6 N7 O6 P S2 -","- C50 H84 Cl4 F12 N14 O12 P2 S4 -","2","1","","Jan J. Weigand; Kai-Oliver Feldmann; Florian D. Henne","Carbene-Stabilized Phosphorus(III)-Centered Cations [LPX~2~]^+^ and [L~2~PX]^2+^ (L = NHC; X = Cl, CN, N~3~)","Journal of the American Chemical Society","2010","132","","16321","16323","10.1021/ja106172d","","","1.54178","CuKα","","0.0807","0.0621","","","0.1558","0.1676","","","","","","0.956","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103537","19.6804","0.0003","30.5202","0.0005","27.2342","0.0004","90","","101.268","0.001","90","","16042.9","0.4","293","2","293","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C130 H143.2 B2 F12 N8 O16.6 P4 Pt2 S4 -","- C130 H118 B2 F12 N8 O16.6 P4 Pt2 S4 -","- C520 H472 B8 F48 N32 O66.4 P16 Pt8 S16 -","4","0.5","","Antonia Kaloudi-Chantzea; Nikolaos Karakostas; Catherine P. Raptopoulou; Vassilis Psycharis; Emmanuel Saridakis; Jan Griebel; Ralf Hermann; George Pistolis","Coordination-Driven Self Assembly of a Brilliantly Fluorescent Rhomboid Cavitand Composed of Bodipy-Dye Subunits","Journal of the American Chemical Society","2010","132","","16327","16329","10.1021/ja1064679","","","1.54178","CuKα","","0.0698","0.0554","","","0.1598","0.1758","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103538","7.589","0.002","13.823","0.004","20.128","0.005","90","","96.519","0.005","90","","2097.8","1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H12 N4 -","- C28 H12 N4 -","- C112 H48 N16 -","4","1","","Fang Lin; Hai-Yan Peng; Jing-Xing Chen; David T. W. Chik; Zongwei Cai; Keith M. C. Wong; Vivian W. W. Yam; Henry N. C. Wong","Synthesis and Photophysical Studies of Chiral Helical Macrocyclic Scaffolds via Coordination-Driven Self-Assembly of 1,8,9,16-Tetraethynyltetraphenylene. Formation of Monometallic Platinum(II) and Dimetallic Platinum(II)-Ruthenium(II) Complexes","Journal of the American Chemical Society","2010","132","","16383","16392","10.1021/ja106599j","","","0.71073","MoKα","","0.0895","0.0748","","","0.1908","0.203","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103539","27.3035","0.0019","12.9231","0.0009","14.0208","0.001","90","","90","","90","","4947.2","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C44 H68 Cl2 P4 Pt2 -","- C44 H67 Cl2 P4 Pt2 -","- C176 H268 Cl8 P16 Pt8 -","4","1","","Fang Lin; Hai-Yan Peng; Jing-Xing Chen; David T. W. Chik; Zongwei Cai; Keith M. C. Wong; Vivian W. W. Yam; Henry N. C. Wong","Synthesis and Photophysical Studies of Chiral Helical Macrocyclic Scaffolds via Coordination-Driven Self-Assembly of 1,8,9,16-Tetraethynyltetraphenylene. Formation of Monometallic Platinum(II) and Dimetallic Platinum(II)-Ruthenium(II) Complexes","Journal of the American Chemical Society","2010","132","","16383","16392","10.1021/ja106599j","","","0.71073","MoKα","","0.1127","0.0723","","","0.1595","0.1738","","","","","","0.877","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103540","17.236","0.002","14.499","0.0017","20.923","0.002","90","","113.719","0.002","90","","4787.1","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H68 Cl2 P4 Pt2 -","- C40 H68 Cl2 P4 Pt2 -","- C160 H272 Cl8 P16 Pt8 -","4","0.5","","Fang Lin; Hai-Yan Peng; Jing-Xing Chen; David T. W. Chik; Zongwei Cai; Keith M. C. Wong; Vivian W. W. Yam; Henry N. C. Wong","Synthesis and Photophysical Studies of Chiral Helical Macrocyclic Scaffolds via Coordination-Driven Self-Assembly of 1,8,9,16-Tetraethynyltetraphenylene. Formation of Monometallic Platinum(II) and Dimetallic Platinum(II)-Ruthenium(II) Complexes","Journal of the American Chemical Society","2010","132","","16383","16392","10.1021/ja106599j","","","0.71073","MoKα","","0.0831","0.06","","","0.1206","0.129","","","","","","0.916","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103541","17.096","0.002","17.193","0.002","23.436","0.003","92.103","0.0018","93.6893","0.0018","98.6202","0.0018","6789.1","1.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C62.5 H60.5 Cl3.5 F8 Ir2 O8 P4 S2 -","- C62.5 H60.5 Cl3.5 F8 Ir2 O8 P4 S2 -","- C250 H242 Cl14 F32 Ir8 O32 P16 S8 -","4","2","","Michael E. Slaney; D. Jason Anderson; Michael J. Ferguson; Robert McDonald; Martin Cowie","The Bridged Binding Mode as a New, Versatile Template for the Selective Activation of Carbon-Fluorine Bonds in Fluoroolefins: Activation of Trifluoroethylene","Journal of the American Chemical Society","2010","132","","16544","16558","10.1021/ja106723u","","","0.71073","MoKα","","0.1117","0.0783","","","0.1768","0.1939","","","","","","1.062","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103542","13.0038","0.0004","24.7743","0.0008","18.3417","0.0006","90","","94.3755","0.0004","90","","5891.7","0.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C59 H56 Cl2 F5 Ir2 O6.5 P4 S -","- C59 H56 Cl2 F5 Ir2 O6.5 P4 S -","- C236 H224 Cl8 F20 Ir8 O26 P16 S4 -","4","1","","Michael E. Slaney; D. Jason Anderson; Michael J. Ferguson; Robert McDonald; Martin Cowie","The Bridged Binding Mode as a New, Versatile Template for the Selective Activation of Carbon-Fluorine Bonds in Fluoroolefins: Activation of Trifluoroethylene","Journal of the American Chemical Society","2010","132","","16544","16558","10.1021/ja106723u","","","0.71073","MoKα","","0.027","0.0225","","","0.0585","0.0611","","","","","","1.017","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103543","20.9533","0.001","23.2733","0.0011","54.433","0.003","90","","90","","90","","26544","2","173","2","173","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C58 H50 Cl4 F6 Ir2 O9 P4 S2 -","- C56.5 H47 Cl F6 Ir2 O9 P4 S2 -","- C904 H752 Cl16 F96 Ir32 O144 P64 S32 -","16","2","","Michael E. Slaney; D. Jason Anderson; Michael J. Ferguson; Robert McDonald; Martin Cowie","The Bridged Binding Mode as a New, Versatile Template for the Selective Activation of Carbon-Fluorine Bonds in Fluoroolefins: Activation of Trifluoroethylene","Journal of the American Chemical Society","2010","132","","16544","16558","10.1021/ja106723u","","","0.71073","MoKα","","0.0893","0.058","","","0.1075","0.1165","","","","","","1.088","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103544","7.546","0.003","7.959","0.003","16.748","0.006","78.581","0.006","89.392","0.006","79.341","0.007","968.6","0.6","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H52 N2 Si2 -","- C42 H52 N2 Si2 -","- C42 H52 N2 Si2 -","1","0.5","","Yi-Yang Liu; Cheng-Li Song; Wei-Jing Zeng; Kai-Ge Zhou; Zi-Fa Shi; Chong-Bo Ma; Feng Yang; Hao-Li Zhang; Xiong Gong","High and Balanced Hole and Electron Mobilities from Ambipolar Thin-Film Transistors Based on Nitrogen-Containing Oligoacences","Journal of the American Chemical Society","2010","132","","16349","16351","10.1021/ja107046s","","","0.71073","MoKα","","0.1678","0.0742","","","0.1075","0.1165","","","","","","1.904","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103545","7.6749","0.0009","7.832","0.001","17.134","0.002","77.434","0.005","88.437","0.005","84.073","0.005","999.9","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H49 F4 N Si2 -","- C43 H49 F4 N Si2 -","- C43 H49 F4 N Si2 -","1","0.5","","Yi-Yang Liu; Cheng-Li Song; Wei-Jing Zeng; Kai-Ge Zhou; Zi-Fa Shi; Chong-Bo Ma; Feng Yang; Hao-Li Zhang; Xiong Gong","High and Balanced Hole and Electron Mobilities from Ambipolar Thin-Film Transistors Based on Nitrogen-Containing Oligoacences","Journal of the American Chemical Society","2010","132","","16349","16351","10.1021/ja107046s","","","0.71073","MoKα","","0.1772","0.0964","","","0.2181","0.2661","","","","","","1.194","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103546","13.6155","0.0012","17.7814","0.0016","16.1138","0.0014","90","","103.206","0.004","90","","3798","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H47 Co N6 -","- C43 H47 Co N6 -","- C172 H188 Co4 N24 -","4","1","","Crisita Carmen Hojilla Atienza; Amanda C. Bowman; Emil Lobkovsky; Paul J. Chirik","Photolysis and Thermolysis of Bis(imino)pyridine Cobalt Azides: C-H Activation from Putative Cobalt Nitrido Complexes","Journal of the American Chemical Society","2010","132","","16343","16345","10.1021/ja107288x","","","0.71073","MoKα","","0.0574","0.0355","","","0.0825","0.0927","","","","","","1.011","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103547","9.464","0.0003","11.5509","0.0003","32.3652","0.0008","90","","92.12","0.001","90","","3535.67","0.17","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H47 Co N4 -","- C43 H47 Co N4 -","- C172 H188 Co4 N16 -","4","1","","Crisita Carmen Hojilla Atienza; Amanda C. Bowman; Emil Lobkovsky; Paul J. Chirik","Photolysis and Thermolysis of Bis(imino)pyridine Cobalt Azides: C-H Activation from Putative Cobalt Nitrido Complexes","Journal of the American Chemical Society","2010","132","","16343","16345","10.1021/ja107288x","","","0.71073","MoKα","","0.0615","0.04","","","0.0879","0.0974","","","","","","1.029","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103548","9.898","0.0006","13.3037","0.0008","13.829","0.0008","101.844","0.003","101.392","0.003","103.947","0.003","1670.19","0.18","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H35 Co N4 -","- C37 H35 Co N4 -","- C74 H70 Co2 N8 -","2","1","","Crisita Carmen Hojilla Atienza; Amanda C. Bowman; Emil Lobkovsky; Paul J. Chirik","Photolysis and Thermolysis of Bis(imino)pyridine Cobalt Azides: C-H Activation from Putative Cobalt Nitrido Complexes","Journal of the American Chemical Society","2010","132","","16343","16345","10.1021/ja107288x","","","0.71073","MoKα","","0.0714","0.0474","","","0.1287","0.1373","","","","","","1.056","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103549","7.961","0.002","8.703","0.003","9.587","0.003","80.769","0.005","75.052","0.005","68.094","0.004","593.9","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H17 B N2 O -","- C12 H17 B N2 O -","- C24 H34 B2 N4 O2 -","2","1","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Electrophilic Aromatic Substitution of a BN Indole","Journal of the American Chemical Society","2010","132","","16340","16342","10.1021/ja107312u","","","0.71073","MoKα","","0.0673","0.0477","","","0.108","0.1206","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103550","17.5388","0.0017","17.3342","0.0017","18.8857","0.0018","90","","90","","90","","5741.7","1","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C27 H38 B3 N5 O -","- C27 H38 B3 N5 O -","- C216 H304 B24 N40 O8 -","8","1","","Eric R. Abbey; Lev N. Zakharov; Shih-Yuan Liu","Electrophilic Aromatic Substitution of a BN Indole","Journal of the American Chemical Society","2010","132","","16340","16342","10.1021/ja107312u","","","0.71073","MoKα","","0.0745","0.0465","","","0.1025","0.1188","","","","","","1.025","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103551","25.6572","0.0005","25.6572","0.0005","25.6572","0.0005","90","","90","","90","","16889.9","0.6","100","2","100","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C24 H12 O13 Zn4 -","- C24 H12 O13 Zn4 -","- C192 H96 O104 Zn32 -","8","0.0416667","","Shuangbing Han; Yanhu Wei; Cory Valente; István Lagzi; Jeremiah J. Gassensmith; Ali Coskun; J. Fraser Stoddart; Bartosz A. Grzybowski","Chromatography in a Single Metal-Organic Framework (MOF) Crystal","Journal of the American Chemical Society","2010","132","","16358","16361","10.1021/ja1074322","","","0.71073","MoKα","","0.0669","0.0469","","","0.1516","0.1582","","","","","","1.009","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103552","14.6257","0.0008","11.8318","0.0004","17.3191","0.0009","90","","98.201","0.004","90","","2966.4","0.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C54 H66 Cl2 Na2 O14 P2 Pd2 S2 -","- C54 H66 Cl2 Na2 O14 P2 Pd2 S2 -","- C108 H132 Cl4 Na4 O28 P4 Pd4 S4 -","2","0.5","","Thomas Rünzi; Damien Guironnet; Inigo Göttker-Schnetmann; Stefan Mecking","Reactivity of Methacrylates in Insertion Polymerization","Journal of the American Chemical Society","2010","132","","16623","16630","10.1021/ja107538r","","","0.71073","MoKα","","0.0622","0.0396","","","0.0696","0.0737","","","","","","1.095","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103553","9.319","0.003","14.771","0.004","23.304","0.002","90","","90","","90","","3207.8","1.4","293.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C35 H42 N2 O5 Ru S -","- C35 H41 N2 O5 Ru S -","- C140 H164 N8 O20 Ru4 S4 -","4","1","","Ilya D. Gridnev; Masahito Watanabe; Hui Wang; Takao Ikariya","Mechanism of Enantioselective C-C Bond Formation with Bifunctional Chiral Ru Catalysts: NMR and DFT Study","Journal of the American Chemical Society","2010","132","","16637","16650","10.1021/ja107597w","","","0.7107","MoKα","","","0.086","","","","0.214","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103554","7.3861","0.0002","16.9714","0.0003","22.9921","0.0004","90","","90","","90","","2882.12","0.11","200","","200","","","","","","","","Synthesized by the authors. See text","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H18 O2 -","- C19 H18 O2 -","- C152 H144 O16 -","8","2","","Diem H. T. Phan; Kevin G. M. Kou; Vy M. Dong","Enantioselective Desymmetrization of Cyclopropenes by Hydroacylation","Journal of the American Chemical Society","2010","132","","16354","16355","10.1021/ja107738a","","","1.54178","CuKα","","0.0558","0.0437","","","0.1109","0.1196","","","","","","1.042","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103555","5.7293","0.0003","22.6204","0.0015","22.0844","0.0011","90","","90.022","0.003","90","","2862.1","0.3","150","1","150","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H15 Cl O2 -","- C17 H15 Cl O2 -","- C136 H120 Cl8 O16 -","8","4","","Diem H. T. Phan; Kevin G. M. Kou; Vy M. Dong","Enantioselective Desymmetrization of Cyclopropenes by Hydroacylation","Journal of the American Chemical Society","2010","132","","16354","16355","10.1021/ja107738a","","","0.71073","MoKα","","0.1229","0.0644","","","0.1469","0.1803","","","","","","1.018","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103556","6.3628","0.0002","37.8917","0.0009","6.4301","0.0002","90","","110.406","0.001","90","","1452.99","0.07","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 1 21 1","P 2yb","4","","","","- C18 H18 O2 -","- C18 H18 O2 -","- C72 H72 O8 -","4","2","","Diem H. T. Phan; Kevin G. M. Kou; Vy M. Dong","Enantioselective Desymmetrization of Cyclopropenes by Hydroacylation","Journal of the American Chemical Society","2010","132","","16354","16355","10.1021/ja107738a","","","1.54178","CuKα","","0.0486","0.0401","","","0.1048","0.1118","","","","","","1.042","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103557","9.19214","0.00018","11.003","0.0002","15.9731","0.0003","87.8746","0.0009","77.9145","0.0009","89.7102","0.0008","1578.64","0.05","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 1","P 1","1","TP-B6-90-trans","","","- C21 H18 O2 -","- C21 H18 O2 -","- C84 H72 O8 -","4","4","","Diem H. T. Phan; Kevin G. M. Kou; Vy M. Dong","Enantioselective Desymmetrization of Cyclopropenes by Hydroacylation","Journal of the American Chemical Society","2010","132","","16354","16355","10.1021/ja107738a","","","1.54178","CuKα","","0.0399","0.0371","","","0.1004","0.1039","","","","","","1.073","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103558","5.7856","0.0001","12.5864","0.0002","22.2215","0.0004","90","","90","","90","","1618.17","0.05","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H18 O2 -","- C21 H18 O2 -","- C84 H72 O8 -","4","1","","Diem H. T. Phan; Kevin G. M. Kou; Vy M. Dong","Enantioselective Desymmetrization of Cyclopropenes by Hydroacylation","Journal of the American Chemical Society","2010","132","","16354","16355","10.1021/ja107738a","","","1.54178","CuKα","","0.0341","0.0324","","","0.0875","0.0898","","","","","","1.05","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103559","17.517","0.002","21.513","0.002","22.412","0.003","93.557","0.002","111.81","0.002","109.403","0.002","7228.1","1.4","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C294.89 H322.38 Cl29.11 N24 Ni4 O13.3 -","- C294.894 H322.384 Cl29.106 N24 Ni4 O13.298 -","- C294.894 H322.384 Cl29.106 N24 Ni4 O13.298 -","1","0.5","","Jianxin Song; Naoki Aratani; Hiroshi Shinokubo; Atsuhiro Osuka","A Porphyrin Nanobarrel That Encapsulates C60","Journal of the American Chemical Society","2010","132","","16356","16357","10.1021/ja107814s","","","0.71073","MoKα","","0.1305","0.0792","","","0.2037","0.2386","","","","","","1.027","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103560","26.506","0.003","27.945","0.003","26.552","0.003","90","","90.049","0.003","90","","19667","4","90","2","90","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C416 H216 Cl12 N24 Ni4 -","- C416 H216 Cl12 N24 Ni4 -","- C832 H432 Cl24 N48 Ni8 -","2","0.5","","Jianxin Song; Naoki Aratani; Hiroshi Shinokubo; Atsuhiro Osuka","A Porphyrin Nanobarrel That Encapsulates C60","Journal of the American Chemical Society","2010","132","","16356","16357","10.1021/ja107814s","","","0.71069","MoKα","","0.1698","0.0844","","","0.1934","0.2242","","","","","","0.794","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103561","25.306","","15.147","","19.763","","90","","95.27","","90","","7543.33","","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C126 H53 N5 Ni Sc3 -","- C126 H53 N5 Ni Sc3 -","- C504 H212 N20 Ni4 Sc12 -","4","0.5","","Tai-Shan Wang; Lai Feng; Jing-Yi Wu; Wei Xu; Jun-Feng Xiang; Kai Tan; Yi-Han Ma; Jun-Peng Zheng; Li Jiang; Xin Lu; Chun-Ying Shu; Chun-Ru Wang","Planar Quinary Cluster inside a Fullerene Cage: Synthesis and Structural Characterizations of Sc3NC@C80-Ih","Journal of the American Chemical Society","2010","132","","16362","16364","10.1021/ja107843b","","","0.71073","MoKα","","0.1498","0.1436","","","0.4338","0.442","","","","","","1.905","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103562","4.1295","0.0008","6.9199","0.0014","36.035","0.0072","90","","90","","90","","1029.7","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H11 Br O3 -","- C11 H11 Br O3 -","- C44 H44 Br4 O12 -","4","1","","Shou-Fei Zhu; Xiao-Guang Song; Yu Li; Yan Cai; Qi-Lin Zhou","Enantioselective Copper-Catalyzed Intramolecular O-H Insertion: An Efficient Approach to Chiral 2-Carboxy Cyclic Ethers","Journal of the American Chemical Society","2010","132","","16374","16376","10.1021/ja1078464","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103563","6.4289","0.0002","9.9793","0.0003","12.8331","0.0004","81.995","0.002","85.672","0.002","74.704","0.002","785.77","0.04","120","2","120","2","","","","","","","","3","P 1","P 1","1","compound RRRR14b","","","- C19 H24 O2 -","- C19 H24 O2 -","- C38 H48 O4 -","2","2","","W. Christopher Boyd; Mark R. Crimmin; Lauren E. Rosebrugh; Jennifer M. Schomaker; Robert G. Bergman; F. Dean Toste","Cobalt-Mediated, Enantioselective Synthesis of C2 and C1 Dienes","Journal of the American Chemical Society","2010","132","","16365","16367","10.1021/ja107968c","","","1.54178","CuKα","","0.0318","0.0293","","","0.0737","0.0804","","","","","","1.071","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103564","20.398","0.007","5.6912","0.0019","26.77","0.009","90","","112.062","0.004","90","","2880.2","1.7","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 O2 -","- C16 H26 O2 -","- C128 H208 O16 -","8","2","","Bin Wang; Armando P. Ramirez; Justin J. Slade; James P. Morken","Enantioselective Synthesis of (-)-Sclerophytin A by a Stereoconvergent Epoxide Hydrolysis","Journal of the American Chemical Society","2010","132","","16380","16382","10.1021/ja108185z","","","0.71073","MoKα","","0.0579","0.0463","","","0.1126","0.1209","","","","","","1.035","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103565","11.642","0.006","7.337","0.004","20.65","0.01","90","","104.046","0.007","90","","1711.1","1.5","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 O3 -","- C19 H28 O3 -","- C76 H112 O12 -","4","1","","Bin Wang; Armando P. Ramirez; Justin J. Slade; James P. Morken","Enantioselective Synthesis of (-)-Sclerophytin A by a Stereoconvergent Epoxide Hydrolysis","Journal of the American Chemical Society","2010","132","","16380","16382","10.1021/ja108185z","","","0.71073","MoKα","","0.1139","0.0634","","","0.1085","0.1245","","","","","","1.042","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103566","9.7581","0.0016","19.351","0.003","19.541","0.003","90","","90","","90","","3689.9","1","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H30 O4 -","- C19 H30 O4 -","- C152 H240 O32 -","8","1","","Bin Wang; Armando P. Ramirez; Justin J. Slade; James P. Morken","Enantioselective Synthesis of (-)-Sclerophytin A by a Stereoconvergent Epoxide Hydrolysis","Journal of the American Chemical Society","2010","132","","16380","16382","10.1021/ja108185z","","","0.71073","MoKα","","0.0757","0.0581","","","0.1438","0.1524","","","","","","1.053","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103567","10.1403","0.001","7.1864","0.0007","13.9617","0.0014","90","","90","","90","","1017.42","0.17","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C9 H12 N6 O3 -","- C9 H12 N6 O3 -","- C36 H48 N24 O12 -","4","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0266","0.0261","","","0.0675","0.0681","","","","","","1.063","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103568","4.6631","0.0003","9.9982","0.0006","12.2965","0.0007","70.93","0.004","81.342","0.003","77.812","0.004","527.55","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H12 N6 O3 -","- C8 H12 N6 O3 -","- C16 H24 N12 O6 -","2","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0439","0.038","","","0.1047","0.1094","","","","","","1.077","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103569","24.617","0.014","6.42","0.004","14.466","0.008","90","","113.892","0.008","90","","2090","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C9 H12 N6 O2 -","- C9 H12 N6 O2 -","- C72 H96 N48 O16 -","8","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0573","0.0432","","","0.1103","0.1196","","","","","","1.035","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103570","4.576","0.002","13.064","0.006","20.128","0.009","90","","90.429","0.007","90","","1203.2","0.9","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 N6 O3 -","- C10 H14 N6 O3 -","- C40 H56 N24 O12 -","4","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0913","0.0603","","","0.1269","0.1375","","","","","","1.076","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103571","7.749","0.0002","11.1967","0.0003","14.0827","0.0004","90","","90","","90","","1221.86","0.06","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 N6 O4 -","- C10 H14 N6 O4 -","- C40 H56 N24 O16 -","4","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0305","0.0302","","","0.0779","0.0781","","","","","","1.021","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103572","4.4783","0.0015","18.704","0.006","14.171","0.005","90","","98.611","0.006","90","","1173.6","0.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 N6 O4 -","- C10 H14 N6 O4 -","- C40 H56 N24 O16 -","4","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0972","0.0481","","","0.0893","0.1038","","","","","","1.049","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103573","21.777","0.003","7.1528","0.0011","19.562","0.003","90","","111.419","0.002","90","","2836.7","0.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H14 D22 N14 O11 -","- C22 H14 D22 N14 O11 -","- C88 H56 D88 N56 O44 -","4","0.5","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0461","0.0369","","","0.0963","0.1031","","","","","","1.027","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103574","6.8414","0.0019","25.756","0.007","10.444","0.003","90","","90","","90","","1840.3","0.9","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C16 H17 Cl N12 O2 -","- C16 H17 Cl N12 O2 -","- C64 H68 Cl4 N48 O8 -","4","0.5","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.1007","0.0716","","","0.1784","0.1952","","","","","","1.068","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103575","14.87","0.003","7.1093","0.0012","14.467","0.002","90","","114.471","0.002","90","","1392","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H16 D16 N14 O9 -","- C24 H16 D16 N14 O9 -","- C48 H32 D32 N28 O18 -","2","0.5","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0598","0.0479","","","0.122","0.133","","","","","","1.055","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103576","4.853","0.0003","9.2338","0.0006","16.2177","0.0011","78.939","0.003","84.916","0.004","81.822","0.004","704.58","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13.5 H15 N7 O2.5 -","- C13.5 H15 N7 O2.5 -","- C27 H30 N14 O5 -","2","1","","Matthew W. Powner; John D. Sutherland; Jack W. Szostak","Chemoselective Multicomponent One-Pot Assembly of Purine Precursors in Water","Journal of the American Chemical Society","2010","132","","16677","16688","10.1021/ja108197s","","","0.71073","MoKα","","0.0436","0.0397","","","0.103","0.1066","","","","","","1.039","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103577","9.6826","0.0002","16.0482","0.0004","19.6919","0.0005","90","","90","","90","","3059.89","0.13","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H41 N3 O8 -","- C30 H41 N3 O8 -","- C120 H164 N12 O32 -","4","1","","Lisa A. Marcaurelle; Eamon Comer; Sivaraman Dandapani; Jeremy R. Duvall; Baudouin Gerard; Sarathy Kesavan; Maurice D. Lee; Haibo Liu; Jason T. Lowe; Jean-Charles Marie; Carol A. Mulrooney; Bhaumik A. Pandya; Ann Rowley; Troy D. Ryba; Byung-Chul Suh; Jingqiang Wei; Damian W. Young; Lakshmi B. Akella; Nathan T. Ross; Yan-Ling Zhang; Daniel M. Fass; Surya A. Reis; Wen-Ning Zhao; Stephen J. Haggarty; Michelle Palmer; Michael A. Foley","An Aldol-Based Build/Couple/Pair Strategy for the Synthesis of Medium- and Large-Sized Rings: Discovery of Macrocyclic Histone Deacetylase Inhibitors","Journal of the American Chemical Society","2010","132","","16962","16976","10.1021/ja105119r","","","1.54178","CuKα","","0.0267","0.0264","","","0.0687","0.069","","","","","","1.059","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103578","9.4979","0.0002","14.121","0.0003","25.283","0.0004","90","","90","","90","","3390.95","0.11","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C35 H49 N3 O9 -","- C35 H49 N3 O9 -","- C140 H196 N12 O36 -","4","1","","Lisa A. Marcaurelle; Eamon Comer; Sivaraman Dandapani; Jeremy R. Duvall; Baudouin Gerard; Sarathy Kesavan; Maurice D. Lee; Haibo Liu; Jason T. Lowe; Jean-Charles Marie; Carol A. Mulrooney; Bhaumik A. Pandya; Ann Rowley; Troy D. Ryba; Byung-Chul Suh; Jingqiang Wei; Damian W. Young; Lakshmi B. Akella; Nathan T. Ross; Yan-Ling Zhang; Daniel M. Fass; Surya A. Reis; Wen-Ning Zhao; Stephen J. Haggarty; Michelle Palmer; Michael A. Foley","An Aldol-Based Build/Couple/Pair Strategy for the Synthesis of Medium- and Large-Sized Rings: Discovery of Macrocyclic Histone Deacetylase Inhibitors","Journal of the American Chemical Society","2010","132","","16962","16976","10.1021/ja105119r","","","1.54178","CuKα","","0.0268","0.0267","","","0.0677","0.0677","","","","","","1.061","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103579","10.7412","0.0003","9.4434","0.0002","14.6583","0.0004","90","","92.428","0.001","90","","1485.51","0.07","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H45 N5 O6 -","- C29 H45 N5 O6 -","- C58 H90 N10 O12 -","2","1","","Lisa A. Marcaurelle; Eamon Comer; Sivaraman Dandapani; Jeremy R. Duvall; Baudouin Gerard; Sarathy Kesavan; Maurice D. Lee; Haibo Liu; Jason T. Lowe; Jean-Charles Marie; Carol A. Mulrooney; Bhaumik A. Pandya; Ann Rowley; Troy D. Ryba; Byung-Chul Suh; Jingqiang Wei; Damian W. Young; Lakshmi B. Akella; Nathan T. Ross; Yan-Ling Zhang; Daniel M. Fass; Surya A. Reis; Wen-Ning Zhao; Stephen J. Haggarty; Michelle Palmer; Michael A. Foley","An Aldol-Based Build/Couple/Pair Strategy for the Synthesis of Medium- and Large-Sized Rings: Discovery of Macrocyclic Histone Deacetylase Inhibitors","Journal of the American Chemical Society","2010","132","","16962","16976","10.1021/ja105119r","","","1.54178","CuKα","","0.0249","0.0248","","","0.0636","0.0637","","","","","","1.029","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103580","15.6441","0.0009","12.0357","0.0007","19.9182","0.0012","90","","90","","90","","3750.4","0.4","153","2","153","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H26 N2 O4 Pd -","- C16 H26 N2 O4 Pd -","- C128 H208 N16 O32 Pd8 -","8","1","","Peter Hauwert; Romilda Boerleider; Stefan Warsink; Jan J. Weigand; Cornelis J. Elsevier","Mechanism of Pd(NHC)-Catalyzed Transfer Hydrogenation of Alkynes","Journal of the American Chemical Society","2010","132","","16900","16910","10.1021/ja1062407","","","0.71073","MoKα","","0.0312","0.0224","","","0.0506","0.0544","","","","","","1.024","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103581","14.718","0.002","8.9472","0.0012","17.545","0.002","90","","90","","90","","2310.4","0.5","298","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H0 Cl2 Co N5 O8 -","- C14 Cl2 Co N5 O8 -","- C56 Cl8 Co4 N20 O32 -","4","0.5","","Jaeheung Cho; Ritimukta Sarangi; Hye Yeon Kang; Jung Yoon Lee; Minoru Kubo; Takashi Ogura; Edward I. Solomon; Wonwoo Nam","Synthesis, Structural, and Spectroscopic Characterization and Reactivities of Mononuclear Cobalt(III)-Peroxo Complexes","Journal of the American Chemical Society","2010","132","","16977","16986","10.1021/ja107177m","","","0.71073","MoKα","","0.1098","0.0794","","","0.2227","0.2324","","","","","","1.03","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103582","12.2417","0.0015","27.912","0.003","11.1477","0.0013","90","","110.063","0.002","90","","3577.9","0.7","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H51 B Co N5 O2 -","- C38 H51 B Co N5 O2 -","- C152 H204 B4 Co4 N20 O8 -","4","1","","Jaeheung Cho; Ritimukta Sarangi; Hye Yeon Kang; Jung Yoon Lee; Minoru Kubo; Takashi Ogura; Edward I. Solomon; Wonwoo Nam","Synthesis, Structural, and Spectroscopic Characterization and Reactivities of Mononuclear Cobalt(III)-Peroxo Complexes","Journal of the American Chemical Society","2010","132","","16977","16986","10.1021/ja107177m","","","0.71073","MoKα","","0.103","0.0365","","","0.0481","0.0523","","","","","","0.96","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103583","9.2584","0.0006","9.2584","0.0006","14.1473","0.0017","90","","90","","90","","1212.68","0.18","298","2","298","2","","","","","","","","6","P 4/n m m :2","-P 4a 2a","129","","","","- C15 H0 Cl2 Co N5 O8 -","- C15 Cl2 Co N5 O8 -","- C30 Cl4 Co2 N10 O16 -","2","0.125","","Jaeheung Cho; Ritimukta Sarangi; Hye Yeon Kang; Jung Yoon Lee; Minoru Kubo; Takashi Ogura; Edward I. Solomon; Wonwoo Nam","Synthesis, Structural, and Spectroscopic Characterization and Reactivities of Mononuclear Cobalt(III)-Peroxo Complexes","Journal of the American Chemical Society","2010","132","","16977","16986","10.1021/ja107177m","","","0.71073","MoKα","","0.0846","0.0673","","","0.1745","0.1807","","","","","","1.065","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103584","12.789","0.003","9.5673","0.0018","17.218","0.003","90","","90","","90","","2106.7","0.7","170","2","170","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C15 H33 Cl Co N5 O6 -","- C15 H33 Cl Co N5 O6 -","- C60 H132 Cl4 Co4 N20 O24 -","4","1","","Jaeheung Cho; Ritimukta Sarangi; Hye Yeon Kang; Jung Yoon Lee; Minoru Kubo; Takashi Ogura; Edward I. Solomon; Wonwoo Nam","Synthesis, Structural, and Spectroscopic Characterization and Reactivities of Mononuclear Cobalt(III)-Peroxo Complexes","Journal of the American Chemical Society","2010","132","","16977","16986","10.1021/ja107177m","","","0.71073","MoKα","","0.038","0.0345","","","0.1101","0.1164","","","","","","1.003","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103585","14.405","0.0006","11.3697","0.0005","15.8982","0.0006","90","","110.767","0.002","90","","2434.65","0.18","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H19 Fe O4 P S -","- C28 H19 Fe O4 P S -","- C112 H76 Fe4 O16 P4 S4 -","4","1","","Aaron M. Royer; Marco Salomone-Stagni; Thomas B. Rauchfuss; Wolfram Meyer-Klaucke","Iron Acyl Thiolato Carbonyls: Structural Models for the Active Site of the [Fe]-Hydrogenase (Hmd)","Journal of the American Chemical Society","2010","132","","16997","17003","10.1021/ja1072228","","","0.71073","MoKα","","0.0403","0.0289","","","0.0735","0.0778","","","","","","1.027","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103586","8.138","0.0002","14.3161","0.0002","17.5802","0.0003","90","","92.253","0.001","90","","2046.59","0.07","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 Cl N2 O P Ru -","- C20 H28 Cl N2 O P Ru -","- C80 H112 Cl4 N8 O4 P4 Ru4 -","4","1","","Ekambaram Balaraman; Boopathy Gnanaprakasam; Linda J. W. Shimon; David Milstein","Direct Hydrogenation of Amides to Alcohols and Amines under Mild Conditions","Journal of the American Chemical Society","2010","132","","16756","16758","10.1021/ja1080019","","","0.71073","MoKα","","0.0435","0.0326","","","0.0781","0.0834","","","","","","0.994","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103587","9.6642","0.0007","16.121","0.0011","29.301","0.002","90","","90","","90","","4565","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C57 H52 Fe N2 -","- C57 H52 Fe N2 -","- C228 H208 Fe4 N8 -","4","1","","Bin Hu; Meng Meng; Zheng Wang; Wenting Du; John S. Fossey; Xinquan Hu; Wei-Ping Deng","A Highly Selective Ferrocene-Based Planar Chiral PIP (Fc-PIP) Acyl Transfer Catalyst for the Kinetic Resolution of Alcohols","Journal of the American Chemical Society","2010","132","","17041","17044","10.1021/ja108238a","","","0.71073","MoKα","","0.0818","0.0605","","","0.153","0.1629","","","","","","1.017","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103588","12.1421","0.0003","12.9364","0.0003","19.6945","0.0006","89.147","0.002","72.124","0.001","86.319","0.001","2938.06","0.13","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H47 B F24 O P Rh -","- C60 H47 B F24 O P Rh -","- C120 H94 B2 F48 O2 P2 Rh2 -","2","1","","Jesús Campos; Ana C. Esqueda; Joaquín López-Serrano; Luis Sánchez; Fernando P. Cossio; Abel de Cozar; Eleuterio Álvarez; Celia Maya; Ernesto Carmona","A Cationic Rh(III) Complex That Efficiently Catalyzes Hydrogen Isotope Exchange in Hydrosilanes","Journal of the American Chemical Society","2010","132","","16765","16767","10.1021/ja108521b","","","0.71073","MoKα","","0.0593","0.0459","","","0.1164","0.1273","","","","","","1.05","","","","has coordinates,has disorder","178781","2020-10-21","18:00:00","" "4103589","25.6591","0.0013","7.8808","0.0004","13.9773","0.0008","90","","90","","90","","2826.4","0.3","173","2","173","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C27 H35 F6 P Rh Sb -","- C27 H35 F6 P Rh Sb -","- C108 H140 F24 P4 Rh4 Sb4 -","4","1","","Jesús Campos; Ana C. Esqueda; Joaquín López-Serrano; Luis Sánchez; Fernando P. Cossio; Abel de Cozar; Eleuterio Álvarez; Celia Maya; Ernesto Carmona","A Cationic Rh(III) Complex That Efficiently Catalyzes Hydrogen Isotope Exchange in Hydrosilanes","Journal of the American Chemical Society","2010","132","","16765","16767","10.1021/ja108521b","","","0.71073","MoKα","","0.0606","0.0333","","","0.0608","0.07","","","","","","1.055","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103590","10.922","0.002","15.497","0.003","21.965","0.004","90","","90","","90","","3717.8","1.2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C21 H24 O6 -","- C21 H24 O6 -","- C168 H192 O48 -","8","1","","Jianxian Gong; Guang Lin; Wenbo Sun; Chuang-Chuang Li; Zhen Yang","Total Synthesis of (\±) Maoecrystal V","Journal of the American Chemical Society","2010","132","","16745","16746","10.1021/ja108907x","","","0.71073","MoKα","","0.0966","0.0396","","","0.0649","0.0854","","","","","","0.779","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103591","10.9153","0.0018","16.404","0.003","18.292","0.003","105.255","0.002","104.71","0.002","109.116","0.002","2770","0.8","150","0.1","150","0.1","","","","","","","","3","P -1","-P 1","2","","1,1,4,4-Tetrakis[bis(trimethylsilyl)methyl]- 1-(2,2-dimethylpropyl)-4-isopropyl-2-tetrasilyne","","- C36 H94 Si12 -","- C36 H94 Si12 -","- C72 H188 Si24 -","2","1","","Yoshitaka Murata; Masaaki Ichinohe; Akira Sekiguchi","Unsymmetrically Substituted Disilyne Dsi2iPrSi-Si\τbSi-SiNpDsi2 (Np = CH2tBu): Synthesis and Characterization","Journal of the American Chemical Society","2010","132","","16768","16770","10.1021/ja1091744","","","0.71073","MoKα","","0.0931","0.0508","","","0.1212","0.1376","","","","","","1.04","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103592","8.8119","0.0014","12.913","0.002","24.946","0.004","90","","90","","90","","2838.6","0.8","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","09046b","","","- C26 H42 Fe N4 O4 S2 -","- C26 H42 Fe N4 O4 S2 -","- C104 H168 Fe4 N16 O16 S8 -","4","1","","Aidan R. McDonald; Michael R. Bukowski; Erik R. Farquhar; Timothy A. Jackson; Kevin D. Koehntop; Mi Sook Seo; Raymond F. De Hont; Audria Stubna; Jason A. Halfen; Eckard Münck; Wonwoo Nam; Lawrence Que","Sulfur versus Iron Oxidation in an Iron-Thiolate Model Complex","Journal of the American Chemical Society","2010","132","","17118","17129","10.1021/ja1045428","","","0.71073","MoKα","","0.0487","0.0382","","","0.0765","0.0798","","","","","","1.068","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103593","7.638","0.004","12.046","0.006","17.893","0.009","90","","100.166","0.009","90","","1620.4","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H17 Cl6 O4 P -","- C8 H17 Cl6 O4 P -","- C32 H68 Cl24 O16 P4 -","4","1","","Zin-Min Tun; Matthew J. Panzner; Vincenzo Scionti; Douglas Medvetz; Chrys Wesdemiotis; Wiley J. Youngs; Claire Tessier","Crown Ether Complexes of HPCl6","Journal of the American Chemical Society","2010","132","","17059","17061","10.1021/ja1064697","","","0.71073","MoKα","","0.0611","0.0414","","","0.0947","0.0992","","","","","","0.973","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103594","8.8731","0.0007","11.6179","0.0009","18.3623","0.0014","92.626","0.001","96.303","0.001","109.978","0.001","1761.2","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H49 Cl6 O12 P -","- C24 H49 Cl6 O12 P -","- C48 H98 Cl12 O24 P2 -","2","1","","Zin-Min Tun; Matthew J. Panzner; Vincenzo Scionti; Douglas Medvetz; Chrys Wesdemiotis; Wiley J. Youngs; Claire Tessier","Crown Ether Complexes of HPCl6","Journal of the American Chemical Society","2010","132","","17059","17061","10.1021/ja1064697","","","0.71073","MoKα","","0.0431","0.0347","","","0.0901","0.0924","","","","","","1.084","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103595","6.3748","0.0003","8.6854","0.0003","14.2983","0.0006","90","","92.48","0.003","90","","790.92","0.06","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H20 O2 Si -","- C16 H20 O2 Si -","- C32 H40 O4 Si2 -","2","1","","John F. Briones; Jørn Hansen; Kenneth I. Hardcastle; Jochen Autschbach; Huw M. L. Davies","Highly Enantioselective Rh2(S-DOSP)4- Catalyzed Cyclopropenation of Alkynes with Styryldiazoacetates","Journal of the American Chemical Society","2010","132","","17211","17215","10.1021/ja106509b","","","1.54178","CuKα","","0.0387","0.0373","","","0.1038","0.105","","","","","","1.071","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103596","8.4047","0.0004","5.5397","0.0003","17.0558","0.0007","90","","91.048","0.003","90","","793.98","0.07","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H20 O2 -","- C20 H20 O2 -","- C40 H40 O4 -","2","1","","John F. Briones; Jørn Hansen; Kenneth I. Hardcastle; Jochen Autschbach; Huw M. L. Davies","Highly Enantioselective Rh2(S-DOSP)4- Catalyzed Cyclopropenation of Alkynes with Styryldiazoacetates","Journal of the American Chemical Society","2010","132","","17211","17215","10.1021/ja106509b","","","1.54178","CuKα","","0.043","0.0338","","","0.091","0.1016","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103597","7.9946","0.0006","9.1402","0.0006","6.2269","0.0004","90","","99.584","0.006","90","","448.66","0.05","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","2-hydroxy-5-Nitrotetrazole","5-nitro-2H-tetrazol-2-ol","","- C H N5 O3 -","- C H N5 O3 -","- C4 H4 N20 O12 -","4","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.027","0.022","","","0.0428","0.0437","","","","","","0.921","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103598","8.489","0.005","12.341","0.005","5.626","0.005","90","0.005","91.221","0.005","90","0.005","589.3","0.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","HNTX","hydroxylammonium 5-nitro-2H-tetrazol-2-olate","","- C H4 N6 O4 -","- C H4 N6 O4 -","- C4 H16 N24 O16 -","4","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.0349","0.0246","","","0.0571","0.0592","","","","","","0.928","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103599","10.267","0.003","12.622","0.002","7.37","0.003","90","","93.724","0.005","90","","953.1","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","TAGNTX","triaminoguanidinium 5-nitro-2H-tetrazol-2-olate","","- C2 H9 N11 O3 -","- C2 H9 N11 O3 -","- C8 H36 N44 O12 -","4","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.0607","0.0332","","","0.0699","0.0753","","","","","","0.88","","","","has coordinates","178781","2020-10-21","18:00:00","" "4103600","7.812","0.003","15.783","0.002","6.619","0.003","90","","100.194","0.005","90","","803.2","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","AGNTX","aminoguanidinium 5-nitro-2H-tetrazol-2-olate","","- C2 H7 N9 O3 -","- C2 H7 N9 O3 -","- C8 H28 N36 O12 -","4","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.0795","0.0359","","","0.0538","0.0582","","","","","","0.842","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103601","6.061","0.0008","7.5528","0.0009","8.2886","0.0009","79.36","0.01","89.576","0.01","85.918","0.011","371.96","0.08","173","2","173","2","","","","","","","","4","P -1","-P 1","2","GNTX","guanidinium 5-nitro-2H-tetrazol-2-olate","","- C2 H6 N8 O3 -","- C2 H6 N8 O3 -","- C4 H12 N16 O6 -","2","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.1166","0.076","","","0.1943","0.2089","","","","","","0.906","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103602","9.3989","0.0004","7.9263","0.0003","15.2618","0.0006","90","","90","","90","","1136.98","0.08","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","ANTX","ammonium 5-nitro-2H-tetrazol-2-olate","","- C H4 N6 O3 -","- C H4 N6 O3 -","- C8 H32 N48 O24 -","8","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.0336","0.0259","","","0.0638","0.0659","","","","","","0.958","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103603","6.4344","0.0006","8.0055","0.0007","8.516","0.0008","90.218","0.007","94.461","0.007","97.519","0.007","433.53","0.07","173","2","173","","","","","","","","","4","P -1","-P 1","2","1,3-diaminoguanidinium 5-nitrotetrazolate-N-oxide","1,3-diaminoguanidinium 5-nitrotetrazolate-N-oxide","","- C2 H8 N10 O3 -","- C2 H8 N10 O3 -","- C4 H16 N20 O6 -","2","1","","Michael Göbel; Konstantin Karaghiosoff; Thomas M. Klapötke; Davin G. Piercey; Jörg Stierstorfer","Nitrotetrazolate-2N-oxides and the Strategy of N-Oxide Introduction","Journal of the American Chemical Society","2010","132","","17216","17226","10.1021/ja106892a","","","0.71073","MoKα","","0.081","0.0409","","","0.0932","0.1035","","","","","","0.885","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103604","25.714","0.0013","25.714","0.0013","25.714","0.0013","90","","90","","90","","17002.3","1.5","296","2","296","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C74 H42 In9 N O56 -","- C74.04 H24 In9 N1.03 O56 -","- C296.16 H96 In36 N4.12 O224 -","4","0.0833333","","Shou-Tian Zheng; Julia T. Bu; Yufei Li; Tao Wu; Fan Zuo; Pingyun Feng; Xianhui Bu","Pore Space Partition and Charge Separation in Cage-within-Cage Indium-Organic Frameworks with High CO2 Uptake","Journal of the American Chemical Society","2010","132","","17062","17064","10.1021/ja106903p","","","0.71073","MoKα","","0.0988","0.0906","","","0.2488","0.2565","","","","","","1.203","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103605","25.182","0.005","25.182","0.005","26.944","0.01","90","","90","","90","","17086","8","296","2","296","2","","","","","","","","5","I -4 2 m","I -4 2","121","","","","- C74 H46 In9 N O58 -","- C74 H30 In9 N O58 -","- C296 H120 In36 N4 O232 -","4","0.25","","Shou-Tian Zheng; Julia T. Bu; Yufei Li; Tao Wu; Fan Zuo; Pingyun Feng; Xianhui Bu","Pore Space Partition and Charge Separation in Cage-within-Cage Indium-Organic Frameworks with High CO2 Uptake","Journal of the American Chemical Society","2010","132","","17062","17064","10.1021/ja106903p","","","0.71073","MoKα","","0.1388","0.1247","","","0.2799","0.2891","","","","","","1.091","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103606","25.8066","0.0011","25.8066","0.0011","25.8066","0.0011","90","","90","","90","","17186.7","1.3","296","2","296","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C48.67 H28 In6 N0.67 O37.33 -","- C48.64 In6 N0.64 O37.3333 -","- C291.84 In36 N3.84 O224 -","6","0.125","","Shou-Tian Zheng; Julia T. Bu; Yufei Li; Tao Wu; Fan Zuo; Pingyun Feng; Xianhui Bu","Pore Space Partition and Charge Separation in Cage-within-Cage Indium-Organic Frameworks with High CO2 Uptake","Journal of the American Chemical Society","2010","132","","17062","17064","10.1021/ja106903p","","","0.71073","MoKα","","0.1179","0.0982","","","0.2765","0.315","","","","","","1.087","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103607","8.9362","0.0014","12.1541","0.0019","23.537","0.004","90","","100.913","0.003","90","","2510.2","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0794","0.0443","","","0.1005","0.1194","","","","","","1.012","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103608","8.9723","0.0004","12.1679","0.0005","23.6779","0.001","90","","100.79","0.001","90","","2539.31","0.19","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0873","0.0432","","","0.0962","0.1157","","","","","","1.009","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103609","8.9994","0.0004","12.1797","0.0005","23.7616","0.0011","90","","100.794","0.001","90","","2558.4","0.2","250","2","250","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0889","0.0449","","","0.0957","0.1178","","","","","","1.033","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103610","9.0255","0.0005","12.1959","0.0007","23.8577","0.0014","90","","100.903","0.001","90","","2578.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0759","0.0374","","","0.0905","0.1073","","","","","","1.037","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103611","9.0436","0.0005","12.2062","0.0006","23.8971","0.0012","90","","100.55","0.0007","90","","2593.4","0.2","310","2","310","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0867","0.0475","","","0.106","0.1258","","","","","","1.003","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103612","9.0564","0.0005","12.2219","0.0007","23.9314","0.0013","90","","100.435","0.0008","90","","2605.1","0.3","320","2","320","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0852","0.0464","","","0.1042","0.1241","","","","","","1.001","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103613","9.0665","0.0005","12.236","0.0007","23.9586","0.0014","90","","100.298","0.0009","90","","2615.1","0.3","330","2","330","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0821","0.0458","","","0.1051","0.1242","","","","","","1.024","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103614","9.0734","0.0006","12.2494","0.0008","23.9794","0.0015","90","","100.139","0.001","90","","2623.5","0.3","340","2","340","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0854","0.0472","","","0.1051","0.1256","","","","","","1.016","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103615","9.0481","0.0018","12.551","0.003","23.981","0.005","90","","96.258","0.002","90","","2707.1","1","350","2","350","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.1051","0.0549","","","0.1373","0.1698","","","","","","1.008","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103616","9.076","0.003","12.584","0.004","24.054","0.008","90","","96.268","0.004","90","","2730.8","1.5","360","2","360","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.1091","0.0546","","","0.137","0.1702","","","","","","1.03","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103617","9.049","0.003","12.555","0.005","24.019","0.009","90","","96.053","0.005","90","","2713.6","1.7","340","2","340","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0701","0.0407","","","0.0989","0.1224","","","","","","1.047","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103618","9.038","0.003","12.546","0.004","23.977","0.008","90","","95.987","0.004","90","","2703.9","1.5","330","2","330","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0884","0.0425","","","0.1089","0.1387","","","","","","1.029","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103619","9.0505","0.0005","12.2165","0.0006","23.9182","0.0012","90","","100.45","0.0008","90","","2600.7","0.2","320","2","320","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 B N2 O2 -","- C34 H32 B N2 O2 -","- C136 H128 B4 N8 O8 -","4","1","","Sushanta K. Pal; Pradip Bag; Arindam Sarkar; Xiaoliu Chi; Mikhail E. Itkis; Fook S. Tham; Bruno Donnadieu; Robert C. Haddon","Hysteretic Spin and Charge Delocalization in a Phenalenyl-Based Molecular Conductor","Journal of the American Chemical Society","2010","132","","17258","17264","10.1021/ja107201d","","","0.71073","MoKα","","0.0835","0.0453","","","0.103","0.1221","","","","","","1.01","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103620","7.972","0.002","7.973","0.002","22.773","0.006","85.259","0.005","85.096","0.005","89.96","0.005","1437.2","0.6","173","2","173","2","","","101.3","","","","","4","P -1","-P 1","2","4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole","4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole","","- C6 F4 N2 Te -","- C6 F4 N2 Te -","- C48 F32 N16 Te8 -","8","4","","Anthony F. Cozzolino; Pamela S. Whitfield; Ignacio Vargas-Baca","Supramolecular Chromotropism of the Crystalline Phases of 4,5,6,7-Tetrafluorobenzo-2,1,3-telluradiazole","Journal of the American Chemical Society","2010","132","","17265","17270","10.1021/ja107252f","","x-ray","0.71073","MoKα","","0.1512","0.0732","","","0.1388","0.1699","","","","","","0.985","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103621","5.423","0.002","10.807","0.004","20.081","0.007","90","","92.644","0.008","90","","1175.6","0.7","173","2","173","2","","","101.3","","","","","5","P 1 21/c 1","-P 2ybc","14","4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole pyridine solvate","4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole pyridine solvate","","- C11 H5 F4 N3 Te -","- C11 H5 F4 N3 Te -","- C44 H20 F16 N12 Te4 -","4","1","","Anthony F. Cozzolino; Pamela S. Whitfield; Ignacio Vargas-Baca","Supramolecular Chromotropism of the Crystalline Phases of 4,5,6,7-Tetrafluorobenzo-2,1,3-telluradiazole","Journal of the American Chemical Society","2010","132","","17265","17270","10.1021/ja107252f","","x-ray","0.71073","MoKα","","0.0844","0.0433","","","0.0791","0.0912","","","","","","0.993","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103622","11.2007","0.0009","11.5746","0.0009","14.1492","0.0012","89.986","0.002","84.365","0.002","68.284","0.001","1694.6","0.2","273","2","273","2","","","","","","","","9","P -1","-P 1","2","","","","- C20 H29 B F3 N8 O5 P S W -","- C22 H31 B F3 N9 O7.878 P S2 W -","- C44 H62 B2 F6 N18 O15.756 P2 S4 W2 -","2","1","","Daniel P. Harrison; Michal Sabat; William H. Myers; W. Dean Harman","Polarization of the Pyridine Ring: Highly Functionalized Piperidines from Tungsten-Pyridine Complex","Journal of the American Chemical Society","2010","132","","17282","17295","10.1021/ja107536w","","","0.71073","MoKα","","0.0496","0.0431","","","0.1102","0.1152","","","","","","1.026","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103623","16.5913","0.0006","23.588","0.0009","16.1339","0.0006","90","","94.488","0.001","90","","6294.7","0.4","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H37 B N9 O4 P W -","- C25 H37 B N9 O4 P W -","- C200 H296 B8 N72 O32 P8 W8 -","8","2","","Daniel P. Harrison; Michal Sabat; William H. Myers; W. Dean Harman","Polarization of the Pyridine Ring: Highly Functionalized Piperidines from Tungsten-Pyridine Complex","Journal of the American Chemical Society","2010","132","","17282","17295","10.1021/ja107536w","","","0.71073","MoKα","","0.0505","0.0364","","","0.0996","0.113","","","","","","0.836","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103624","15.38356","0.00008","16.80979","0.00009","37.8732","0.0002","90","","100.227","0.0005","90","","9638.19","0.09","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(para-Fluorophenyl)-1,2,2-(2',4',6'-triisopropylphenyl)disilene","","- C51 H73 F Si2 -","- C51 H73 F Si2 -","- C408 H584 F8 Si16 -","8","4","","Jonathan Jeck; Iulia Bejan; Andrew J. P. White; Dominik Nied; Frank Breher; David Scheschkewitz","Transfer of a Disilenyl Moiety to Aromatic Substrates and Lateral Functional Group Transformation in Aryl Disilenes","Journal of the American Chemical Society","2010","132","","17306","17315","10.1021/ja107547s","","","1.54184","CuKα","","0.0519","0.047","","","0.1245","0.1272","","","","","","1.045","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103625","18.55902","0.00009","12.81965","0.00005","21.65869","0.00009","90","","109.634","0.0005","90","","4853.43","0.04","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(para-Chlorophenyl)-1,2,2-(2',4',6'-triisopropylphenyl)disilene","","- C51 H73 Cl Si2 -","- C51 H73 Cl Si2 -","- C204 H292 Cl4 Si8 -","4","1","","Jonathan Jeck; Iulia Bejan; Andrew J. P. White; Dominik Nied; Frank Breher; David Scheschkewitz","Transfer of a Disilenyl Moiety to Aromatic Substrates and Lateral Functional Group Transformation in Aryl Disilenes","Journal of the American Chemical Society","2010","132","","17306","17315","10.1021/ja107547s","","","1.54184","CuKα","","0.0434","0.0375","","","0.105","0.1081","","","","","","1.086","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103626","18.5602","0.0003","12.8496","0.00016","21.6993","0.0003","90","","109.514","0.0016","90","","4877.84","0.13","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(para-Bromophenyl)-1,2,2-(2',4',6'-triisopropylphenyl)disilene","","- C51 H73 Br Si2 -","- C51 H73 Br Si2 -","- C204 H292 Br4 Si8 -","4","1","","Jonathan Jeck; Iulia Bejan; Andrew J. P. White; Dominik Nied; Frank Breher; David Scheschkewitz","Transfer of a Disilenyl Moiety to Aromatic Substrates and Lateral Functional Group Transformation in Aryl Disilenes","Journal of the American Chemical Society","2010","132","","17306","17315","10.1021/ja107547s","","","0.71073","MoKα","","0.0712","0.0357","","","0.0856","0.0895","","","","","","0.909","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103627","10.2487","0.0007","21.606","0.0015","26.9115","0.0019","68.187","0.002","81.34","0.002","82.16","0.002","5448.3","0.7","173","2","173","2","","","","","","","","3","P -1","-P 1","2","meta-Phenylene-tetrasiladiene","1,3-Bis[1',2',2'-Tris(2'',4'',6''-triisopropylphenyl)disilenyl]benzene","","- C117 H163 Si4 -","- C117 H163 Si4 -","- C234 H326 Si8 -","2","1","","Jonathan Jeck; Iulia Bejan; Andrew J. P. White; Dominik Nied; Frank Breher; David Scheschkewitz","Transfer of a Disilenyl Moiety to Aromatic Substrates and Lateral Functional Group Transformation in Aryl Disilenes","Journal of the American Chemical Society","2010","132","","17306","17315","10.1021/ja107547s","","","0.71073","MoKα","","0.0824","0.0656","","","0.1484","0.1585","","","","","","1.107","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103628","9.7794","0.0005","11.7808","0.0006","14.9206","0.0007","106.794","0.002","98.093","0.002","112.487","0.002","1457.9","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H45 Cr N2 -","- C33 H45 Cr N2 -","- C66 H90 Cr2 N4 -","2","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0502","0.0381","","","0.0969","0.1043","","","","","","1.048","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103629","10.6913","0.0017","12.361","0.002","13.55","0.002","70.63","0.005","84.409","0.006","82.845","0.006","1673.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H45 Cr N2 O3 S -","- C37 H45 Cr N2 O3 S -","- C74 H90 Cr2 N4 O6 S2 -","2","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.038","0.0323","","","0.0854","0.0896","","","","","","1.018","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103630","11.3105","0.0007","16.418","0.001","17.7673","0.0011","90","","106.56","0.002","90","","3162.5","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H41 Cr N2 O3 S -","- C35 H41 Cr N2 O3 S -","- C140 H164 Cr4 N8 O12 S4 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.049","0.0376","","","0.0959","0.1032","","","","","","1.038","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103631","10.656","0.003","11.407","0.003","14.526","0.004","109.825","0.006","90.183","0.007","110.206","0.007","1544.3","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H48 Cr N2 Si -","- C33 H48 Cr N2 Si -","- C66 H96 Cr2 N4 Si2 -","2","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0388","0.0327","","","0.0888","0.0937","","","","","","1.049","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103632","16.7572","0.0004","10.4447","0.0002","19.8127","0.0004","90","","90.835","0.001","90","","3467.33","0.13","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H57 Cr N2 Si -","- C38 H57 Cr N2 Si -","- C152 H228 Cr4 N8 Si4 -","4","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0401","0.036","","","0.0895","0.0926","","","","","","1.019","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103633","10.8474","0.0011","15.7337","0.0014","18.6138","0.0019","90","","90.495","0.004","90","","3176.7","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H49 Cr N2 Si -","- C34 H49 Cr N2 Si -","- C136 H196 Cr4 N8 Si4 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0494","0.0358","","","0.091","0.099","","","","","","1.035","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103634","10.3499","0.001","11.364","0.0011","14.9073","0.0015","100.74","0.005","104.78","0.005","112.521","0.005","1484.7","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H45 Cr N2 Si -","- C32 H45 Cr N2 Si -","- C64 H90 Cr2 N4 Si2 -","2","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0507","0.0393","","","0.1058","0.1138","","","","","","1.039","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103635","7.831","0.001","10.996","0.002","14.697","0.003","90.296","0.007","86.824","0.007","73.539","0.007","1211.5","0.4","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C28 H35 Cr N2 -","- C28 H35 Cr N2 -","- C56 H70 Cr2 N4 -","2","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0641","0.0458","","","0.1204","0.1505","","","","","","0.966","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103636","11.2229","0.0011","14.2255","0.0015","18.1967","0.0019","110.825","0.003","94.326","0.004","95.051","0.004","2687","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H37 Cr N2 -","- C31 H37 Cr N2 -","- C124 H148 Cr4 N8 -","4","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0837","0.0584","","","0.1518","0.1687","","","","","","1.072","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103637","16.8366","0.0012","20.2245","0.0012","9.8941","0.0008","90","","90","","90","","3369.1","0.4","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C38 H53 Cr N2 O -","- C38 H53 Cr N2 O -","- C152 H212 Cr4 N8 O4 -","4","0.5","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71069","MoKα","","0.0897","0.0605","","","0.162","0.1796","","","","","","1.027","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103638","20.291","0.0005","9.54","0.0004","29.399","0.001","90","","90","","90","","5690.9","0.3","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C34 H34 Cl0 Cr N2 O0 -","- C33.12 H38.01 Cl0.11 Cr N2 -","- C264.96 H304.08 Cl0.88 Cr8 N16 -","8","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0642","0.0472","","","0.1193","0.128","","","","","","1.038","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103639","14.176","0.0013","13.2281","0.0012","28.386","0.003","90","","90","","90","","5323","0.9","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C30 H39 Cr N2 -","- C30 H39 Cr N2 -","- C240 H312 Cr8 N16 -","8","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0674","0.0582","","","0.1506","0.1565","","","","","","1.15","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103640","32.4301","0.0013","20.398","0.0009","10.0444","0.0004","90","","90","","90","","6644.5","0.5","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C38 H55 Cr N2 -","- C38 H55 Cr N2 -","- C304 H440 Cr8 N16 -","8","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0453","0.0331","","","0.0776","0.0835","","","","","","1.063","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103641","9.1543","0.0007","11.2955","0.001","13.0131","0.0011","114.359","0.005","95.866","0.005","90.008","0.005","1218.05","0.18","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 Cr N3 -","- C28 H32 Cr N3 -","- C56 H64 Cr2 N6 -","2","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0684","0.041","","","0.0899","0.1026","","","","","","1.032","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103642","10.1851","0.0003","15.689","0.0005","17.1502","0.0005","90","","95.328","0.002","90","","2728.66","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H37 Cr N2 -","- C33 H37 Cr N2 -","- C132 H148 Cr4 N8 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0455","0.0355","","","0.0942","0.1014","","","","","","1.023","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103643","19.3249","0.0005","9.0312","0.0002","20.0983","0.0005","90","","98.613","0.001","90","","3468.14","0.15","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H53 Cr N2 -","- C41 H53 Cr N2 -","- C164 H212 Cr4 N8 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0373","0.0316","","","0.0837","0.0874","","","","","","1.039","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103644","8.6214","0.0014","19.146","0.003","9.5494","0.0015","90","","102.381","0.007","90","","1539.6","0.4","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C37 H45 Cr N2 -","- C37 H45 Cr N2 -","- C74 H90 Cr2 N4 -","2","0.5","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0458","0.0369","","","0.0975","0.103","","","","","","1.054","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103645","16.038","0.005","16.383","0.005","11.162","0.004","90","","100.889","0.014","90","","2880","1.6","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C35 H41 Cr N2 -","- C35 H41 Cr N2 -","- C140 H164 Cr4 N8 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.036","0.0314","","","0.0751","0.0776","","","","","","1.032","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103646","11.1582","0.0004","16.9822","0.0007","15.2142","0.0006","90","","101.161","0.002","90","","2828.43","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H39 Cr N2 -","- C34 H39 Cr N2 -","- C136 H156 Cr4 N8 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.105","0.0646","","","0.1467","0.1665","","","","","","1.084","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103647","9.3624","0.0011","12.2408","0.0014","12.6542","0.0015","65.485","0.003","89.588","0.003","87.589","0.003","1318.2","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H35 Cr N2 -","- C32 H35 Cr N2 -","- C64 H70 Cr2 N4 -","2","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0489","0.0402","","","0.1121","0.1187","","","","","","1.061","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103648","13.9048","0.0003","13.1968","0.0003","28.0798","0.0006","90","","90","","90","","5152.6","0.2","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C30 H37 Cr N2 -","- C30 H37 Cr N2 -","- C240 H296 Cr8 N16 -","8","2","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0873","0.0512","","","0.1087","0.1244","","","","","","1.013","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103649","7.853","0.005","13.783","0.005","22.07","0.005","90","0.005","90.8","0.005","90","0.005","2388.6","1.8","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H31 Cr N2 -","- C28 H31 Cr N2 -","- C112 H124 Cr4 N8 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71069","MoKα","","0.0673","0.0467","","","0.1004","0.1119","","","","","","1.064","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103650","9.8834","0.0013","15.9186","0.0019","17.127","0.002","90","","92.837","0.003","90","","2691.3","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H35 Cr N2 S -","- C32 H35 Cr N2 S -","- C128 H140 Cr4 N8 S4 -","4","1","","K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith","Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes","Journal of the American Chemical Society","2010","132","","17325","17334","10.1021/ja1083392","","","0.71073","MoKα","","0.0586","0.0445","","","0.1181","0.1248","","","","","","1.077","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103651","20.376","0.006","16.9","0.005","10.96","0.003","90","","90","","90","","3774.1","1.9","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C73 Cl4 S2 -","- C73 Cl4 S2 -","- C292 Cl16 S8 -","4","0.5","","Karolin Ziegler; Andreas Mueller; Konstantin Yu. Amsharov; Martin Jansen","Disclosure of the Elusive C2v-C72 Carbon Cage","Journal of the American Chemical Society","2010","132","","17099","17101","10.1021/ja108470p","","","0.71073","MoKα","","0.1035","0.0839","","","0.2529","0.2761","","","","","","1.23","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103652","20.377","0.004","16.863","0.003","10.972","0.002","90","","90","","90","","3770.2","1.2","173","2","173","2","","","","","","","","3","P n m a","-P 2ac 2n","62","C72Cl4","","","- C73 Cl4 S2 -","- C73 Cl4 S2 -","- C292 Cl16 S8 -","4","0.5","","Yuan-Zhi Tan; Ting Zhou; Jian Bao; Gui-Juan Shan; Su-Yuan Xie; Rong-Bin Huang; Lan-Sun Zheng","C72Cl4: A Pristine Fullerene with Favorable Pentagon-Adjacent Structure","Journal of the American Chemical Society","2010","132","","17102","17104","10.1021/ja108860y","","","0.71073","MoKα","","0.0842","0.0783","","","0.2211","0.2277","","","","","","1.079","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103653","3.966833","0.000086","11.54303","0.00061","7.99022","0.0004","90.2089","0.0078","89.8747","0.0062","90.0009","0.0022","365.86","0.03","","","84","","","","101.3","","","","","4","P -1","-P 1","2","4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole","4,5,6,7-tetrafluorobenzo-2,1,3-telluradiazole","","- C6 F4 N2 Te -","- C6 F4 N2 Te -","- C12 F8 N4 Te2 -","2","1","","Anthony F. Cozzolino; Pamela S. Whitfield; Ignacio Vargas-Baca","Supramolecular Chromotropism of the Crystalline Phases of 4,5,6,7-Tetrafluorobenzo-2,1,3-telluradiazole","Journal of the American Chemical Society","2010","132","","17265","17270","10.1021/ja107252f","","x-ray","1.54056","CuKα","","","","","","","","","","","","","","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103654","5.8081","0.0003","12.9504","0.0005","45.9633","0.002","90","","90","","90","","3457.2","0.3","93.1","","93.1","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C39 H43 N O8 -","- C39 H43 N O8 -","- C156 H172 N4 O32 -","4","1","","Yasuhiro Ishida; Ammathnadu S. Achalkumar; Shun-ya Kato; Yukiko Kai; Aya Misawa; Yumi Hayashi; Kuniyo Yamada; Yuki Matsuoka; Motoo Shiro; Kazuhiko Saigo","Tunable Chiral Reaction Media Based on Two-Component Liquid Crystals: Regio-, Diastereo-, and Enantiocontrolled Photodimerization of Anthracenecarboxylic Acids","Journal of the American Chemical Society","2010","132","","17435","17446","10.1021/ja105221u","","","1.54187","CuKα","","","0.0997","","","","0.2928","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103655","15.924","0.002","16.524","0.003","20.318","0.003","90","","90","","90","","5346.2","1.4","125.2","","125.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C31 H40 N2 Yb -","- C31 H40 N2 Yb -","- C248 H320 N16 Yb8 -","8","1","","Corwin H. Booth; Daniel Kazhdan; Evan L. Werkema; Marc D. Walter; Wayne W. Lukens; Eric D. Bauer; Yung-Jin Hu; Laurent Maron; Odile Eisenstein; Martin Head-Gordon; Richard A. Andersen","Intermediate-Valence Tautomerism in Decamethylytterbocene Complexes of Methyl-Substituted Bipyridines","Journal of the American Chemical Society","2010","132","","17537","17549","10.1021/ja106902s","","","0.7107","MoKα","","0.0883","0.037","","0.0488","","0.0395","","","","","","1.461","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103656","14.127","0.001","15.283","0.001","15.312","0.001","90","","92.18","0.002","90","","3303.5","0.4","154.2","","154.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H48 N2 Yb -","- C38 H48 N2 Yb -","- C152 H192 N8 Yb4 -","4","1","","Corwin H. Booth; Daniel Kazhdan; Evan L. Werkema; Marc D. Walter; Wayne W. Lukens; Eric D. Bauer; Yung-Jin Hu; Laurent Maron; Odile Eisenstein; Martin Head-Gordon; Richard A. Andersen","Intermediate-Valence Tautomerism in Decamethylytterbocene Complexes of Methyl-Substituted Bipyridines","Journal of the American Chemical Society","2010","132","","17537","17549","10.1021/ja106902s","","","0.7107","MoKα","","0.0637","0.037","","0.0497","","0.0432","","","","","","1.229","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103657","18.0976","0.0018","15.994","0.0016","19.676","0.002","90","","90","","90","","5695.3","1","156","2","156","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","cyb5dmb","cyb5","","- C32 H42 N2 Yb -","- C32 H42 N2 Yb -","- C256 H336 N16 Yb8 -","8","1","","Corwin H. Booth; Daniel Kazhdan; Evan L. Werkema; Marc D. Walter; Wayne W. Lukens; Eric D. Bauer; Yung-Jin Hu; Laurent Maron; Odile Eisenstein; Martin Head-Gordon; Richard A. Andersen","Intermediate-Valence Tautomerism in Decamethylytterbocene Complexes of Methyl-Substituted Bipyridines","Journal of the American Chemical Society","2010","132","","17537","17549","10.1021/ja106902s","","","0.71073","MoKα","","0.0392","0.0266","","","0.0574","0.0628","","","","","","1.016","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103658","23.847","0.002","15.177","0.0015","31.291","0.003","90","","90","","90","","11325","1.8","168","2","168","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H42 N2 Yb -","- C34 H41.5 N2 Yb -","- C544 H664 N32 Yb16 -","16","2","","Corwin H. Booth; Daniel Kazhdan; Evan L. Werkema; Marc D. Walter; Wayne W. Lukens; Eric D. Bauer; Yung-Jin Hu; Laurent Maron; Odile Eisenstein; Martin Head-Gordon; Richard A. Andersen","Intermediate-Valence Tautomerism in Decamethylytterbocene Complexes of Methyl-Substituted Bipyridines","Journal of the American Chemical Society","2010","132","","17537","17549","10.1021/ja106902s","","","0.71073","MoKα","","0.118","0.0507","","","0.1002","0.1205","","","","","","0.98","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103659","6.8236","0.0001","6.8236","0.0001","3.7518","0.0001","90","","90","","90","","174.689","0.006","150","2","150","2","","","","","","","","4","P 4/m b m","-P 4 2ab","127","calcium lithium carbide hydride","calcium lithium carbide hydride","","- C3 H Ca2 Li -","- C3 H Ca2 Li -","- C6 H2 Ca4 Li2 -","2","0.125","","David A. Lang; Julia V. Zaikina; Derek D. Lovingood; Thomas E. Gedris; Susan E. Latturner","Ca2LiC3H: A New Complex Carbide Hydride Phase Grown in Metal Flux","Journal of the American Chemical Society","2010","132","","17523","17530","10.1021/ja107436n","","","0.71073","MoKα","","0.0165","0.0151","","","0.0399","0.0407","","","","","","1.149","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103660","5.9696","0.0012","3.6022","0.0008","6.8336","0.0014","90","","90","","90","","146.95","0.05","150","2","150","2","","","","","","","","2","P n m a","-P 2ac 2n","62","calcium hydride","calcium hydride","","- Ca H2 -","- Ca H2 -","- Ca4 H8 -","4","0.5","","David A. Lang; Julia V. Zaikina; Derek D. Lovingood; Thomas E. Gedris; Susan E. Latturner","Ca2LiC3H: A New Complex Carbide Hydride Phase Grown in Metal Flux","Journal of the American Chemical Society","2010","132","","17523","17530","10.1021/ja107436n","","","0.71073","MoKα","","0.0212","0.0211","","","0.0529","0.053","","","","","","1.215","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103661","12.3235","0.0007","12.3235","0.0007","24.44","0.004","90","","90","","90","","3711.7","0.7","110","2","110","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C38 H22 Mo2 N2 O9 -","- C38 H22 Mo2 N2 O9 -","- C152 H88 Mo8 N8 O36 -","4","0.25","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1493","0.0936","","","0.1864","0.2086","","","","","","1.007","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103662","13.914","0.004","14.263","0.004","17.484","0.005","72.778","0.003","87.742","0.003","67.93","0.003","3061.2","1.5","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C116 H84 Mo4 N4 O20 -","- C116 H84 Mo4 N4 O20 -","- C116 H84 Mo4 N4 O20 -","1","0.5","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.0842","0.049","","","0.1132","0.1249","","","","","","1.016","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103663","21.868","0.016","30.763","0.016","21.215","0.013","90","","90.322","0.011","90","","14272","16","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C124 H124 Mo4 N4 O24 S8 -","- C124 H124 Mo4 N4 O24 S8 -","- C496 H496 Mo16 N16 O96 S32 -","4","0.5","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1009","0.0671","","","0.1518","0.1632","","","","","","1.015","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103664","11.62","0.007","26.165","0.016","52.45","0.03","90","","93.314","0.008","90","","15920","16","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C96 H48 Mo6 O30 -","- C96 H48 Mo6 O30 -","- C384 H192 Mo24 O120 -","4","1","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1359","0.0998","","","0.2103","0.221","","","","","","1.045","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103665","16.956","0.005","42.663","0.012","33.176","0.008","90","","113.312","0.012","90","","22040","11","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C164 H117 Mo6 N5 O30 -","- C164 H117 Mo6 N5 O30 -","- C656 H468 Mo24 N20 O120 -","4","1","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1678","0.0912","","","0.192","0.2029","","","","","","1.013","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103666","35.614","0.004","35.614","0.004","35.614","0.004","90","","90","","90","","45171","9","110","2","110","2","","","","","","","","4","P -4 3 n","P -4n 2 3","218","","","","- C144 H72 Mo6 O30 -","- C144 H72 Mo6 O30 -","- C1152 H576 Mo48 O240 -","8","0.333333","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.2644","0.1061","","","0.1816","0.2097","","","","","","1.05","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103667","25.807","0.002","25.807","0.002","29.78","0.005","90","","90","","120","","17176","3","110","2","110","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C156 H96 Mo6 O42 -","- C156 H96 Mo6 O42 -","- C312 H192 Mo12 O84 -","2","0.166667","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.354","0.0975","","","0.1645","0.1997","","","","","","1.02","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103668","34.997","0.003","34.997","0.003","39.893","0.007","90","","90","","120","","42314","9","110","2","110","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C204 H156 Mo12 N24 O54 -","- C204 H156 Mo12 N24 O54 -","- C612 H468 Mo36 N72 O162 -","3","0.166667","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1099","0.0618","","","0.1327","0.1402","","","","","","1.004","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103669","28.41","0.011","28.674","0.011","45.274","0.017","91.126","0.005","91.473","0.006","105.233","0.006","35561","2","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C312 H180 Mo12 N12 O55 -","- C312 H180 Mo12 N12 O55 -","- C624 H360 Mo24 N24 O110 -","2","1","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1952","0.0632","","","0.1072","0.1225","","","","","","0.683","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103670","26.83","0.03","33.23","0.03","27.88","0.03","90","","91.117","0.014","90","","24852","4","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C312 H336 Mo24 N40 O124 -","- C312 H336 Mo24 N40 O124 -","- C624 H672 Mo48 N80 O248 -","2","0.5","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.2008","0.0812","","","0.1601","0.1893","","","","","","0.804","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103671","31.651","0.008","31.651","0.008","32.246","0.016","90","","90","","90","","32304","2","110","2","110","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C312 H336 Mo24 N40 O152 -","- C312 H336 Mo24 N40 O152 -","- C624 H672 Mo48 N80 O304 -","2","0.125","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1282","0.0754","","","0.1656","0.1805","","","","","","1.012","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103672","25.6486","0.0016","25.682","0.003","29.181","0.003","65.481","0.001","63.982","0.001","86.865","0.001","15524","3","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C288 H288 Mo24 O118 -","- C288 H288 Mo24 O118 -","- C288 H288 Mo24 O118 -","1","0.5","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.1115","0.0618","","","0.1306","0.1404","","","","","","1.027","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103673","33.052","0.002","33.052","0.002","33.833","0.004","90","","90","","120","","32009","5","110","2","110","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C288 H144 Mo24 O120 -","- C288 H144 Mo24 O120 -","- C576 H288 Mo48 O240 -","2","0.166667","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.143","0.0768","","","0.1507","0.166","","","","","","1.018","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103674","15.91","0.001","15.91","0.001","18.953","0.003","90","","90","","120","","4154.8","0.8","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C27 H36 N4 O6 -","- C27 H36 N4 O6 -","- C162 H216 N24 O36 -","6","0.333333","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.0745","0.0446","","","0.1029","0.1184","","","","","","1.02","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103675","8.8739","0.0003","10.2972","0.0004","13.4184","0.0005","105.857","0.001","101.177","0.001","97.514","0.001","1134.95","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H24 Br3 N -","- C24 H24 Br3 N -","- C48 H48 Br6 N2 -","2","1","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.0478","0.0374","","","0.0954","0.0999","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00","" "4103676","10.6831","0.0008","11.753","0.0008","19.2189","0.0014","80.627","0.001","79.368","0.001","83.438","0.001","2331.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H29 Cl2 N O3 -","- C25 H29 Cl2 N O3 -","- C100 H116 Cl8 N4 O12 -","4","2","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.0589","0.045","","","0.1153","0.1256","","","","","","1.027","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103677","8.3253","0.0003","9.258","0.0004","19.6238","0.0008","86.464","0.001","80.668","0.001","70.363","0.001","1405.65","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25.25 H26 Cl2 Mn2 N4 O6.38 -","- C25.25 H26 Cl2 Mn2 N4 O6.375 -","- C50.5 H52 Cl4 Mn4 N8 O12.75 -","2","1","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.0353","0.0298","","","0.0724","0.0754","","","","","","1.036","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103678","15.2562","0.0006","15.2562","0.0006","40.444","0.003","90","","90","","120","","8152.2","0.8","100","2","100","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C42 H66 Cl3 Cu3 F6 N10 O6 P2 -","- C42 H66 Cl3 Cu3 F6 N10 O6 P2 -","- C252 H396 Cl18 Cu18 F36 N60 O36 P12 -","6","0.333333","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.0481","0.0406","","","0.108","0.1131","","","","","","1.079","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103679","15.256","0.003","15.256","0.003","40.393","0.016","90","","90","","120","","8142","4","100","2","100","2","","","","","","","","9","R -3 :H","-R 3","148","","","","- C42 H66 As Cl3 Cu3 F6 N10 O5.75 P -","- C42 H66 As Cl3 Cu3 F6 N10 O5.75 P -","- C252 H396 As6 Cl18 Cu18 F36 N60 O34.5 P6 -","6","0.333333","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.1335","0.0855","","","0.2481","0.2851","","","","","","1.045","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103680","16.081","0.004","17.7073","0.0018","20.483","0.002","113.919","0.002","108.197","0.002","91.932","0.002","4977.9","1.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C104 H213.02 Cl4.34 Mn8 N24 Na4.34 O74.17 P10 -","- C104 H213.018 Cl4.336 Mn8 N24 Na4.3362 O74.1692 P10 -","- C104 H213.018 Cl4.336 Mn8 N24 Na4.3362 O74.1692 P10 -","1","0.5","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.0863","0.0581","","","0.1582","0.1713","","","","","","1.04","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103681","16.2253","0.0009","17.4347","0.0009","18.0696","0.001","66.528","0.001","74.244","0.001","87.945","0.001","4497.3","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C76.75 H87.5 Cl2 Co3 F18 N15.5 O5.5 P4 -","- C76.75 H87.5 Cl2 Co3 F18 N15.5 O5.5 P4 -","- C153.5 H175 Cl4 Co6 F36 N31 O11 P8 -","2","1","","Rui Cao; Peter Müller; Stephen J. Lippard","Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers","Journal of the American Chemical Society","2010","132","","17366","17369","10.1021/ja108212v","","","0.71073","MoKα","","0.071","0.0555","","","0.1441","0.1548","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103682","11.8671","0.0016","14.0629","0.0018","14.0671","0.0017","71.37","0.006","81.391","0.008","87.499","0.01","2199.5","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2K-8-100-dp","","- C58.7 H34.7 Cl1.1 O8 -","- C58.7 H34.7 Cl1.1 O8 -","- C117.4 H69.4 Cl2.2 O16 -","2","1","","Kaiyan Lou; Allan M. Prior; Bernard Wiredu; John Desper; Duy H. Hua","Synthesis of Cyclododeciptycene Quinones","Journal of the American Chemical Society","2010","132","","17635","17641","10.1021/ja1088309","","","0.71073","MoKα","","0.1601","0.0859","","","0.21","0.2528","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103683","33.0333","0.0017","33.0333","0.0017","33.0333","0.0017","90","","90","","90","","36046","3","100","2","100","2","","","","","","","","3","I a -3 d","-I 4bd 2c 3","230","","","","- C90 H53 O13 -","- C89.952 H52.86 O12.996 -","- C1439.23 H845.76 O207.936 -","16","0.166667","","Kaiyan Lou; Allan M. Prior; Bernard Wiredu; John Desper; Duy H. Hua","Synthesis of Cyclododeciptycene Quinones","Journal of the American Chemical Society","2010","132","","17635","17641","10.1021/ja1088309","","","0.71073","MoKα","","0.1561","0.1065","","","0.2727","0.2986","","","","","","1.768","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103684","11.6556","0.0002","12.0214","0.0002","22.0847","0.0004","103.13","0.0014","99.9454","0.0015","91.5909","0.0014","2961.01","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C140 H116 N20 O8 U4 -","- C140 H116 N20 O8 U4 -","- C140 H116 N20 O8 U4 -","1","0.5","","Clément Camp; Victor Mougel; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti","Multielectron Redox Reactions Involving C-C Coupling and Cleavage in Uranium Schiff Base Complexes","Journal of the American Chemical Society","2010","132","","17374","17377","10.1021/ja1089364","","","0.71073","MoKα","","0.0721","0.0459","","","0.1039","0.1083","","","","","","0.853","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103685","11.0533","0.0004","16.159","0.0005","18.3135","0.0006","90","","104.828","0.004","90","","3162.05","0.19","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H28 N4 O4 U -","- C40 H28 N4 O4 U -","- C160 H112 N16 O16 U4 -","4","1","","Clément Camp; Victor Mougel; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti","Multielectron Redox Reactions Involving C-C Coupling and Cleavage in Uranium Schiff Base Complexes","Journal of the American Chemical Society","2010","132","","17374","17377","10.1021/ja1089364","","","0.71073","MoKα","","0.0845","0.0464","","","0.0907","0.0958","","","","","","0.784","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103686","14.019","0.003","45.018","0.009","14.96","0.003","90","","116.62","0.03","90","","8441","4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C87.27 H99.27 N8.65 Na2 O16 U -","- C87.26 H99.26 N8.652 Na2 O16 U -","- C349.04 H397.04 N34.608 Na8 O64 U4 -","4","1","","Clément Camp; Victor Mougel; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti","Multielectron Redox Reactions Involving C-C Coupling and Cleavage in Uranium Schiff Base Complexes","Journal of the American Chemical Society","2010","132","","17374","17377","10.1021/ja1089364","","","0.71073","MoKα","","0.1213","0.0581","","","0.0977","0.1083","","","","","","0.907","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103687","15.209","0.0013","17.2523","0.0014","15.051","0.001","90","","99.689","0.007","90","","3892.9","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H38 F6 N2 O11 S2 U -","- C34 H38 F6 N2 O11 S2 U -","- C136 H152 F24 N8 O44 S8 U4 -","4","1","","Clément Camp; Victor Mougel; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti","Multielectron Redox Reactions Involving C-C Coupling and Cleavage in Uranium Schiff Base Complexes","Journal of the American Chemical Society","2010","132","","17374","17377","10.1021/ja1089364","","","0.71073","MoKα","","0.1297","0.0791","","","0.1866","0.2069","","","","","","0.936","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103688","27.5","0.003","19.024","0.002","19.263","0.002","90","","90","","90","","10077.6","1.9","90","2","90","2","","","","","","","","4","I b a 2","I 2 -2c","45","","","","- C52.75 H74.75 Fe2 O2 -","- C49 H66 Fe2 O2 -","- C392 H528 Fe16 O16 -","8","1","","Hao Lei; Jing-Dong Guo; James C. Fettinger; Shigeru Nagase; Philip P. Power","Two-Coordinate First Row Transition Metal Complexes with Short Unsupported Metal-Metal Bonds","Journal of the American Chemical Society","2010","132","","17399","17401","10.1021/ja1089777","","","0.71073","MoKα","","0.075","0.055","","","0.1257","0.1341","","","","","","0.995","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103689","28.5365","0.0006","18.6658","0.0004","18.8017","0.0004","90","","90","","90","","10014.8","0.4","90","2","90","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C49 H66 Cr Fe O2 -","- C49 H66 Cr Fe O2 -","- C392 H528 Cr8 Fe8 O16 -","8","1","","Hao Lei; Jing-Dong Guo; James C. Fettinger; Shigeru Nagase; Philip P. Power","Two-Coordinate First Row Transition Metal Complexes with Short Unsupported Metal-Metal Bonds","Journal of the American Chemical Society","2010","132","","17399","17401","10.1021/ja1089777","","","1.54178","CuKα","","0.0308","0.0305","","","0.0897","0.09","","","","","","1.102","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103690","27.3962","0.0016","19.0486","0.0011","19.3019","0.0011","90","","90","","90","","10072.9","1","90","2","90","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C52.75 H74.75 Fe Mn O2 -","- C49 H66 Fe Mn O2 -","- C392 H528 Fe8 Mn8 O16 -","8","1","","Hao Lei; Jing-Dong Guo; James C. Fettinger; Shigeru Nagase; Philip P. Power","Two-Coordinate First Row Transition Metal Complexes with Short Unsupported Metal-Metal Bonds","Journal of the American Chemical Society","2010","132","","17399","17401","10.1021/ja1089777","","","0.71073","MoKα","","0.0537","0.0392","","","0.0882","0.0932","","","","","","0.992","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103691","6.2641","0.0015","9.299","0.002","21.269","0.006","90","","90","","90","","1238.9","0.5","143","1","143","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 F N O2 S -","- C12 H14 F N O2 S -","- C48 H56 F4 N4 O8 S4 -","4","1","","Matthew H. Katcher; Abigail G. Doyle","Palladium-Catalyzed Asymmetric Synthesis of Allylic Fluorides","Journal of the American Chemical Society","2010","132","","17402","17404","10.1021/ja109120n","","","0.71073","MoKα","","0.0581","0.045","","","0.1027","0.1112","","","","","","1.041","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103692","11.299","0.002","12.053","0.002","12.362","0.002","115.343","0.003","94.307","0.003","100.069","0.003","1476.7","0.4","123","2","123","2","","","","","","","","7","P -1","-P 1","2","07067c","","","- C50 H43 F12 Fe N11 O8 S2 -","- C40 H28 F12 Fe N6 O8 S2 -","- C40 H28 F12 Fe N6 O8 S2 -","1","0.5","","Paul D. Oldenburg; Yan Feng; Iweta Pryjomska-Ray; Daniel Ness; Lawrence Que","Olefin Cis-Dihydroxylation with Bio-Inspired Iron Catalysts. Evidence for an FeII/FeIV Catalytic Cycle","Journal of the American Chemical Society","2010","132","","17713","17723","10.1021/ja1021014","","","0.71073","MoKα","","0.0588","0.0495","","","0.142","0.1471","","","","","","1.121","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103693","11.2171","0.0012","11.2665","0.0012","11.9035","0.0013","88.168","0.002","83.446","0.002","62.227","0.002","1322","0.2","123","2","123","2","","","","","","","","7","P -1","-P 1","2","07081a","","","- C48 H46 F6 Fe N10 O10 S2 -","- C48 H46 F6 Fe N10 O10 S2 -","- C48 H46 F6 Fe N10 O10 S2 -","1","0.5","","Paul D. Oldenburg; Yan Feng; Iweta Pryjomska-Ray; Daniel Ness; Lawrence Que","Olefin Cis-Dihydroxylation with Bio-Inspired Iron Catalysts. Evidence for an FeII/FeIV Catalytic Cycle","Journal of the American Chemical Society","2010","132","","17713","17723","10.1021/ja1021014","","","0.71073","MoKα","","0.0746","0.0459","","","0.1011","0.1092","","","","","","1.096","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103694","11.9738","0.0013","13.2467","0.0015","19.321","0.002","77.934","0.007","72.938","0.007","69.865","0.007","2730.6","0.5","193","2","193","2","","","","","","","","10","P -1","-P 1","2","","","","- C45 H49 B2 Cl4 F8 Fe2 N2 O3 P3 S2 -","- C45 H49 B2 Cl4 F8 Fe2 N2 O3 P3 S2 -","- C90 H98 B4 Cl8 F16 Fe4 N4 O6 P6 S4 -","2","1","","Matthew T. Olsen; Thomas B. Rauchfuss; Scott R. Wilson","Role of the Azadithiolate Cofactor in Models for [FeFe]-Hydrogenase: Novel Structures and Catalytic Implications","Journal of the American Chemical Society","2010","132","","17733","17740","10.1021/ja103998v","","","0.71073","MoKα","","0.2969","0.0796","","","0.1594","0.2443","","","","","","0.908","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "4103695","16.025","0.003","20.624","0.004","21.736","0.004","92.21","0.02","109.19","0.02","100.89","0.02","6623","2","301","2","301","2","","","","","","","","7","P -1","-P 1","2","","","","- C204 H198 Au18 F36 O2 P24 S6 -","- C204 H198 Au18 F36 O2 P24 S6 -","- C204 H198 Au18 F36 O2 P24 S6 -","1","0.5","","Terence Kwok-Ming Lee; Nianyong Zhu; Vivian Wing-Wah Yam","An Unprecedented Luminescent Polynuclear Gold(I) μ3-Sulfido Cluster With a Thiacrown-like Architecture","Journal of the American Chemical Society","2010","132","","17646","17648","10.1021/ja1055017","","","0.71073","MoKα","","0.09","0.0534","","","0.1552","0.1785","","","","","","1.038","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103696","14.241","0.005","8.419","0.003","15.213","0.005","90","","112.926","0.003","90","","1679.9","1","140","1","140","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 N O6 S2 V -","- C14 H17 N O6 S2 V -","- C56 H68 N4 O24 S8 V4 -","4","1","","Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; L. A. ""Pete"" Silks; David L. Thorn","Mechanism of Alcohol Oxidation by Dipicolinate Vanadium(V): Unexpected Role of Pyridine","Journal of the American Chemical Society","2010","132","","17804","17816","10.1021/ja105739k","","","0.71073","MoKα","","0.0476","0.0372","","","0.0967","0.1023","","","","","","1.331","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103697","17.231","0.01","14.738","0.008","17.25","0.01","90","","96.968","0.007","90","","4348","4","140","1","140","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H20 N4 O6 V -","- C18 H12 N3 O6 V -","- C144 H96 N24 O48 V8 -","8","1","","Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; L. A. ""Pete"" Silks; David L. Thorn","Mechanism of Alcohol Oxidation by Dipicolinate Vanadium(V): Unexpected Role of Pyridine","Journal of the American Chemical Society","2010","132","","17804","17816","10.1021/ja105739k","","","0.71073","MoKα","","0.0836","0.0587","","","0.1522","0.163","","","","","","1.065","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103698","8.9203","0.001","15.9259","0.0019","11.4477","0.0013","90","","92.305","0.013","90","","1625","0.3","140","1","140","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N2 O3 V -","- C15 H15 N2 O6 V -","- C60 H60 N8 O24 V4 -","4","1","","Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; L. A. ""Pete"" Silks; David L. Thorn","Mechanism of Alcohol Oxidation by Dipicolinate Vanadium(V): Unexpected Role of Pyridine","Journal of the American Chemical Society","2010","132","","17804","17816","10.1021/ja105739k","","","0.71073","MoKα","","0.0602","0.0348","","","0.0693","0.0761","","","","","","0.793","","","","has coordinates","178782","2020-10-21","18:00:00","" "4103699","14.097","0.006","14.762","0.007","34.122","0.014","90","","90.415","0.007","90","","7101","5","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C118 H56 La2 Si -","- C118 H56 La2.002 Si -","- C472 H224 La8.008 Si4 -","4","1","","Michio Yamada; Mari Minowa; Satoru Sato; Masahiro Kako; Zdenek Slanina; Naomi Mizorogi; Takahiro Tsuchiya; Yutaka Maeda; Shigeru Nagase; Takeshi Akasaka","Thermal Carbosilylation of Endohedral Dimetallofullerene La2@Ih-C80 with Silirane","Journal of the American Chemical Society","2010","132","","17953","17960","10.1021/ja108671b","","x-ray","0.6889","synchrotron","","0.2287","0.1214","","","0.3428","0.368","","","","","","0.978","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00","" "4103700","20.9194","0.0007","21.4218","0.0004","21.4404","0.0008","91.558","0.002","118.826","0.004","115.036","0.002","7295.9","0.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C132 H316 Ag62 B4 F16 O10 S45 -","- C132 H288 Ag62 B4 F16 O10 S45 -","- C132 H288 Ag62 B4 F16 O10 S45 -","1","0.5","","Gen Li; Zhen Lei; Quan-Ming Wang","Luminescent Molecular Ag-S Nanocluster [Ag62S13(SBut)32](BF4)4","Journal of the American Chemical Society","2010","132","","17678","17679","10.1021/ja108684m","","","0.71073","MoKα","","0.1086","0.0581","","","0.1645","0.1817","","","","","","0.978","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103701","10.8863","0.0005","13.4489","0.0005","16.2121","0.0007","90","","96.366","0.001","90","","2358.96","0.17","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 B Mg N3 O3 -","- C22 H32 B Mg N3 O3 -","- C88 H128 B4 Mg4 N12 O12 -","4","1","","James F. Dunne; D. Bruce Fulton; Arkady Ellern; Aaron D. Sadow","Concerted C-N and C-H Bond Formation in a Magnesium-Catalyzed Hydroamination","Journal of the American Chemical Society","2010","132","","17680","17683","10.1021/ja108881s","","","0.71073","MoKα","","0.0508","0.0368","","","0.0924","0.1011","","","","","","0.959","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103702","10.8305","0.001","16.6235","0.0015","17.299","0.0016","98.553","0.002","103.684","0.002","95.163","0.002","2967","0.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H77 B2 Mg N6 O6 -","- C59 H77 B2 Mg N6 O6 -","- C118 H154 B4 Mg2 N12 O12 -","2","1","","James F. Dunne; D. Bruce Fulton; Arkady Ellern; Aaron D. Sadow","Concerted C-N and C-H Bond Formation in a Magnesium-Catalyzed Hydroamination","Journal of the American Chemical Society","2010","132","","17680","17683","10.1021/ja108881s","","","0.71073","MoKα","","0.1061","0.0814","","","0.2077","0.2254","","","","","","1.245","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103703","4.237","0.0013","15.17","0.005","6.0214","0.0019","90","","90","","90","","387","0.2","296","2","296","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Ba F4 Mn -","- Ba F4 Mn -","- Ba4 F16 Mn4 -","4","0.5","","Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani","Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family","Journal of the American Chemical Society","2010","132","","17684","17685","10.1021/ja108965s","","","0.71073","MoKα","","0.0388","0.0379","","","0.0925","0.0931","","","","","","1.076","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103704","4.2173","0.0004","14.6573","0.0014","5.8656","0.0006","90","","90","","90","","362.58","0.06","296","2","296","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Ba Co F4 -","- Ba Co F4 -","- Ba4 Co4 F16 -","4","0.5","","Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani","Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family","Journal of the American Chemical Society","2010","132","","17684","17685","10.1021/ja108965s","","","0.71073","MoKα","","0.0161","0.016","","","0.0412","0.0413","","","","","","1.158","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103705","4.1591","0.0009","14.492","0.003","5.8078","0.0012","90","","90","","90","","350.06","0.13","296","2","296","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Ba F4 Ni -","- Ba F4 Ni -","- Ba4 F16 Ni4 -","4","0.5","","Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani","Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family","Journal of the American Chemical Society","2010","132","","17684","17685","10.1021/ja108965s","","","0.71073","MoKα","","0.0294","0.0262","","","0.0501","0.051","","","","","","1.126","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103706","6.9146","0.0001","24.6124","0.0004","16.4864","0.0002","90","","111.042","0.001","90","","2618.64","0.07","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 Cl2 N2 O6 -","- C28 H22 Cl2 N2 O6 -","- C112 H88 Cl8 N8 O24 -","4","1","","Chao Feng; Teck-Peng Loh","Palladium-Catalyzed Bisolefination of C-C Triple Bonds: A Facile Method for the Synthesis of Naphthalene Derivatives","Journal of the American Chemical Society","2010","132","","17710","17712","10.1021/ja108998d","","","0.71073","MoKα","","0.1265","0.0931","","","0.2787","0.3216","","","","","","1.037","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103707","13.167","0.015","17.558","0.019","13.564","0.016","90","","90","","90","","3136","6","183","2","296","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C24 H24 Ca N2 O16 Zn2 -","- C24 H24 Ca N2 O16 Zn2 -","- C96 H96 Ca4 N8 O64 Zn8 -","4","0.5","","Ruqiang Zou; Ruiqin Zhong; Songbai Han; Hongwu Xu; Anthony K. Burrell; Neil Henson; Jonathan L. Cape; Donald D. Hickmott; Tatiana V. Timofeeva; Toti E. Larson; Yusheng Zhao","A Porous Metal-Organic Replica of α-PbO2 for Capture of Nerve Agent Surrogate","Journal of the American Chemical Society","2010","132","","17996","17999","10.1021/ja101440z","","","0.71073","MoKα","","0.0658","0.0618","","","0.1569","0.1608","","","","","","1.029","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103708","14.7696","0.0003","14.7696","0.0003","14.7696","0.0003","90","","90","","90","","3221.86","0.11","128","2","128","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","[Na(THF)][tpatBuFe]","","","- C31 H47 Fe N4 Na O -","- C31.02 H39 Fe N4 Na O0.99 -","- C124.08 H156 Fe4 N16 Na4 O3.96 -","4","0.333333","","W. Hill Harman; T. David Harris; Danna E. Freedman; Henry Fong; Alicia Chang; Jeffrey D. Rinehart; Andrew Ozarowski; Moulay T. Sougrati; Fernande Grandjean; Gary J. Long; Jeffrey R. Long; Christopher J. Chang","Slow Magnetic Relaxation in a Family of trigonal Pyramidal Iron(II) Pyrrolide Complexes","Journal of the American Chemical Society","2010","132","","18115","18126","10.1021/ja105291x","","","0.71073","MoKα","","0.0311","0.0284","","","0.0762","0.0775","","","","","","1.103","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103709","11.36","0.0017","12.028","0.0018","17.881","0.003","76.897","0.002","73.871","0.002","69.85","0.002","2180","0.6","123","2","123","2","","","","","","","","6","P -1","-P 1","2","[Na(DME)3][tpaPhFe]","","","- C45 H57 Fe N4 Na O6 -","- C45 H57 Fe N4 Na O6 -","- C90 H114 Fe2 N8 Na2 O12 -","2","1","","W. Hill Harman; T. David Harris; Danna E. Freedman; Henry Fong; Alicia Chang; Jeffrey D. Rinehart; Andrew Ozarowski; Moulay T. Sougrati; Fernande Grandjean; Gary J. Long; Jeffrey R. Long; Christopher J. Chang","Slow Magnetic Relaxation in a Family of trigonal Pyramidal Iron(II) Pyrrolide Complexes","Journal of the American Chemical Society","2010","132","","18115","18126","10.1021/ja105291x","","","0.71073","MoKα","","0.0922","0.0472","","","0.1027","0.125","","","","","","1.015","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103710","13.467","0.002","18.827","0.004","20.082","0.004","90","","90","","90","","5091.7","1.7","153","2","153","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","[K(DME{4)][tpaDFPFe]","","","- C49 H61 F6 Fe K N4 O8 -","- C49 H61 F6 Fe K N4 O8 -","- C196 H244 F24 Fe4 K4 N16 O32 -","4","1","","W. Hill Harman; T. David Harris; Danna E. Freedman; Henry Fong; Alicia Chang; Jeffrey D. Rinehart; Andrew Ozarowski; Moulay T. Sougrati; Fernande Grandjean; Gary J. Long; Jeffrey R. Long; Christopher J. Chang","Slow Magnetic Relaxation in a Family of trigonal Pyramidal Iron(II) Pyrrolide Complexes","Journal of the American Chemical Society","2010","132","","18115","18126","10.1021/ja105291x","","","0.71073","MoKα","","0.0864","0.048","","","0.0922","0.1042","","","","","","0.976","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103711","14.4882","0.0013","14.9346","0.0013","20.8197","0.0018","79.137","0.002","71.719","0.002","86.119","0.002","4200.7","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Fe(OEP-CH2-CH2-OEP)]2OH.I3, 3","","","- C84.6 H112.2 Fe2 I3 N8 O3.65 -","- C84.6 H112.2 Fe2 I3 N8 O3.65 -","- C169.2 H224.4 Fe4 I6 N16 O7.3 -","2","1","","Sudip Kumar Ghosh; Sankar Prasad Rath","A Remarkably Bent Diiron(III)-μ-Hydroxo Bisporphyrin: Unusual Stabilization of Two Spin States of Iron in a Single Molecular Framework","Journal of the American Chemical Society","2010","132","","17983","17985","10.1021/ja107374s","","","0.71073","MoKα","","0.071","0.0533","","","0.1388","0.1558","","","","","","1.039","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4103712","24.806","0.002","9.6651","0.0008","24.423","0.002","90","","106.87","0.02","90","","5603.5","1","110","2","110","2","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- C38 H34 -","- C38 H34 -","- C304 H272 -","8","2","","Enrico Faggi; Rosa M. Sebastián; Roser Pleixats; Adelina Vallribera; Alexandr Shafir; Alejandra Rodríguez-Gimeno; Carmen Ramírez de Arellano","Direct Assembly of Polyarenes via C-C Coupling Using PIFA/BF3.Et2O","Journal of the American Chemical Society","2010","132","","17980","17982","10.1021/ja107467c","","","0.71073","MoKα","","0.0905","0.0426","","","0.0824","0.09","","","","","","0.802","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103713","6.7624","0.0006","11.7215","0.001","13.6347","0.0011","90","","92.367","0.001","90","","1079.84","0.16","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Cl Zr -","- C11 H13 Cl Zr -","- C44 H52 Cl4 Zr4 -","4","1","","Aaron J. Rossini; Ivan Hung; Samuel A. Johnson; Carla Slebodnick; Mike Mensch; Paul A. Deck; Robert W. Schurko","Solid-State 91Zr NMR Spectroscopy Studies of Zirconocene Olefin Polymerization Catalyst Precursors","Journal of the American Chemical Society","2010","132","","18301","18317","10.1021/ja107749b","","","0.71073","MoKα","","0.0262","0.0227","","","0.0513","0.0536","","","","","","1.047","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103714","13.5792","0.0005","8.5955","0.0003","15.3894","0.0005","90","","96.587","0.003","90","","1784.39","0.11","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 Br2 O Si2 Zr -","- C14 H20 Br2 O Si2 Zr -","- C56 H80 Br8 O4 Si8 Zr4 -","4","1","","Aaron J. Rossini; Ivan Hung; Samuel A. Johnson; Carla Slebodnick; Mike Mensch; Paul A. Deck; Robert W. Schurko","Solid-State 91Zr NMR Spectroscopy Studies of Zirconocene Olefin Polymerization Catalyst Precursors","Journal of the American Chemical Society","2010","132","","18301","18317","10.1021/ja107749b","","x-ray","0.71073","MoKα","","0.0459","0.0286","","","0.0537","0.0554","","","","","","0.867","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103715","14.9355","0.0013","14.682","0.003","24.174","0.002","90","","90","","90","","5300.9","1.3","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H30 Br2 O2 Si4 Zr -","- C18 H30 Br2 O2 Si4 Zr -","- C144 H240 Br16 O16 Si32 Zr8 -","8","1","","Aaron J. Rossini; Ivan Hung; Samuel A. Johnson; Carla Slebodnick; Mike Mensch; Paul A. Deck; Robert W. Schurko","Solid-State 91Zr NMR Spectroscopy Studies of Zirconocene Olefin Polymerization Catalyst Precursors","Journal of the American Chemical Society","2010","132","","18301","18317","10.1021/ja107749b","","","0.71073","MoKα","","0.12","0.0508","","","0.0788","0.0966","","","","","","0.993","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103716","16.4797","0.0006","15.5746","0.0005","15.3467","0.0005","90","","90","","90","","3939","0.2","223","2","223","2","","","","","","","","4","P n n a","-P 2a 2bc","52","","","","- C36 H72 Cr N4 -","- C36 H72 Cr N4 -","- C144 H288 Cr4 N16 -","4","0.5","","Rosanna A. D. Soriaga; Jennifer M. Nguyen; Thomas A. Albright; David M. Hoffman","Diamagnetic Group 6 Tetrakis(di-tert-butylketimido)metal(IV) Complexes","Journal of the American Chemical Society","2010","132","","18014","18016","10.1021/ja108265y","","","0.71073","MoKα","","0.0516","0.0415","","","0.114","0.1241","","","","","","1.007","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103717","16.5902","0.0008","15.6242","0.0008","15.5439","0.0008","90","","90","","90","","4029.1","0.4","223","2","223","2","","","","","","","","4","P n n a","-P 2a 2bc","52","","","","- C36 H72 Mo N4 -","- C36 H72 Mo N4 -","- C144 H288 Mo4 N16 -","4","0.5","","Rosanna A. D. Soriaga; Jennifer M. Nguyen; Thomas A. Albright; David M. Hoffman","Diamagnetic Group 6 Tetrakis(di-tert-butylketimido)metal(IV) Complexes","Journal of the American Chemical Society","2010","132","","18014","18016","10.1021/ja108265y","","","0.71073","MoKα","","0.0547","0.0303","","","0.0797","0.0958","","","","","","0.987","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103718","15.4819","0.0007","16.6244","0.0008","15.6247","0.0007","90","","90","","90","","4021.4","0.3","223","2","223","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- C36 H72 N4 W -","- C36 H72 N4 W -","- C144 H288 N16 W4 -","4","0.25","","Rosanna A. D. Soriaga; Jennifer M. Nguyen; Thomas A. Albright; David M. Hoffman","Diamagnetic Group 6 Tetrakis(di-tert-butylketimido)metal(IV) Complexes","Journal of the American Chemical Society","2010","132","","18014","18016","10.1021/ja108265y","","","0.71073","MoKα","","0.0205","0.0194","","","0.0507","0.0516","","","","","","1.068","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103719","4.05171","0.00003","4.05171","0.00003","18.3438","0.0002","90","","90","","90","","301.138","0.005","10","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Co2 La2 O3 Se2 -","- Co2 La2 O3 Se2 -","- Co4 La4 O6 Se4 -","2","0.0625","","Yayoi Fuwa; Takashi Endo; Makoto Wakeshima; Yukio Hinatsu; Kenji Ohoyama","Orthogonal Spin Arrangement in Quasi-Two-Dimensional La2Co2O3Se2","Journal of the American Chemical Society","2010","132","","18020","18022","10.1021/ja109007g","powder diffraction","neutron","1.8449","ConstantWavelengthNeutronDiffraction","","","","","","","","","2.353","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103720","4.06096","0.00005","4.06096","0.00005","18.3843","0.0003","90","","90","","90","","303.183","0.007","300","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Co2 La2 O3 Se2 -","- Co2 La2 O3 Se2 -","- Co4 La4 O6 Se4 -","2","0.0625","","Yayoi Fuwa; Takashi Endo; Makoto Wakeshima; Yukio Hinatsu; Kenji Ohoyama","Orthogonal Spin Arrangement in Quasi-Two-Dimensional La2Co2O3Se2","Journal of the American Chemical Society","2010","132","","18020","18022","10.1021/ja109007g","powder diffraction","neutron","1.8449","ConstantWavelengthNeutronDiffraction","","","","","","","","","4.3311","","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4103721","19.9341","0.0006","10.8494","0.0003","13.9902","0.0004","90","","90","","90","","3025.7","0.15","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C31 H44 Au Cl3 N O P -","- C31 H44 Au Cl3 N O P -","- C124 H176 Au4 Cl12 N4 O4 P4 -","4","1","","Kevin D. Hesp; Mark Stradiotto","Stereo- and Regioselective Gold-Catalyzed Hydroamination of Internal Alkynes with Dialkylamines","Journal of the American Chemical Society","2010","132","","18026","18029","10.1021/ja109192w","","","0.71073","MoKα","","0.0132","0.0128","","","0.0331","0.0332","","","","","","1.043","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103722","12.617","0.0009","12.7549","0.001","18.2237","0.0014","88.5121","0.0008","72.5456","0.0007","80.7996","0.0008","2760.9","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C58 H51 Au B F20 N2 O2 P -","- C58 H51 Au B F20 N2 O2 P -","- C116 H102 Au2 B2 F40 N4 O4 P2 -","2","1","","Kevin D. Hesp; Mark Stradiotto","Stereo- and Regioselective Gold-Catalyzed Hydroamination of Internal Alkynes with Dialkylamines","Journal of the American Chemical Society","2010","132","","18026","18029","10.1021/ja109192w","","","0.71073","MoKα","","0.0159","0.0154","","","0.0409","0.0411","","","","","","1.073","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103723","11.263","0.0002","12.603","0.0002","12.741","0.0002","99.643","0.001","94.862","0.001","104.426","0.001","1711.56","0.05","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H44 N2 O P2 Ru -","- C38 H44 N2 O P2 Ru -","- C76 H88 N4 O2 P4 Ru2 -","2","1","","L. Jonas L. Häller; Michael J. Page; Stefan Erhardt; Stuart A. Macgregor; Mary F. Mahon; M. Abu Naser; Andrea Vélez; Michael K. Whittlesey","Experimental and Computational Investigation of C-N Bond Activation in Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2010","132","","18408","18416","10.1021/ja109702h","","","0.71073","MoKα","","0.0797","0.043","","","0.0837","0.0939","","","","","","0.984","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103724","10.14","0.0001","13.692","0.0002","19.251","0.0003","81.982","0.001","86.649","0.001","84.854","0.001","2633.09","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H60 N2 O P2 Ru -","- C64 H60 N2 O P2 Ru -","- C128 H120 N4 O2 P4 Ru2 -","2","1","","L. Jonas L. Häller; Michael J. Page; Stefan Erhardt; Stuart A. Macgregor; Mary F. Mahon; M. Abu Naser; Andrea Vélez; Michael K. Whittlesey","Experimental and Computational Investigation of C-N Bond Activation in Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2010","132","","18408","18416","10.1021/ja109702h","","","0.71073","MoKα","","0.0364","0.0291","","","0.0713","0.0761","","","","","","1.074","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103725","12.198","0.0003","12.925","0.0003","17.948","0.0003","83.658","0.001","81.718","0.001","70.564","0.001","2634.65","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H64 N2 O2 P2 Ru -","- C62 H64 N2 O2 P2 Ru -","- C124 H128 N4 O4 P4 Ru2 -","2","1","","L. Jonas L. Häller; Michael J. Page; Stefan Erhardt; Stuart A. Macgregor; Mary F. Mahon; M. Abu Naser; Andrea Vélez; Michael K. Whittlesey","Experimental and Computational Investigation of C-N Bond Activation in Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2010","132","","18408","18416","10.1021/ja109702h","","","0.71073","MoKα","","0.0446","0.0309","","","0.0662","0.0709","","","","","","1.033","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103726","14.6767","0.0004","24.0479","0.0004","14.9109","0.0003","90","","113.548","0.003","90","","4824.5","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H50 Cl N2 O P2 Ru -","- C58 H50 Cl N2 O P2 Ru -","- C232 H200 Cl4 N8 O4 P8 Ru4 -","4","1","","L. Jonas L. Häller; Michael J. Page; Stefan Erhardt; Stuart A. Macgregor; Mary F. Mahon; M. Abu Naser; Andrea Vélez; Michael K. Whittlesey","Experimental and Computational Investigation of C-N Bond Activation in Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2010","132","","18408","18416","10.1021/ja109702h","","","0.7107","MoKα","","0.0909","0.0493","","","0.1297","0.1362","","","","","","1.054","","","","has coordinates","178783","2020-10-21","18:00:00","" "4103727","11.497","0.0001","13.084","0.0002","17.31","0.0002","75.317","0.001","75.635","0.001","87.905","0.001","2439.14","0.05","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H55 Cl N2 O P2 Ru -","- C56 H55 Cl N2 O P2 Ru -","- C112 H110 Cl2 N4 O2 P4 Ru2 -","2","1","","L. Jonas L. Häller; Michael J. Page; Stefan Erhardt; Stuart A. Macgregor; Mary F. Mahon; M. Abu Naser; Andrea Vélez; Michael K. Whittlesey","Experimental and Computational Investigation of C-N Bond Activation in Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2010","132","","18408","18416","10.1021/ja109702h","","","0.71073","MoKα","","0.0467","0.0324","","","0.0735","0.08","","","","","","1.034","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103728","18.057","0.003","18.057","0.003","23.058","0.005","90","","90","","90","","7518","2","293","2","293","2","","","","","","","","5","I 41/a m d :2","-I 4bd 2","141","","","","- C32 H100 Co4 N16 O44 -","- C32 H100 Co4 N16 O44 -","- C128 H400 Co16 N64 O176 -","4","0.125","","Shuang Wang; Tingting Zhao; Guanghua Li; Lukasz Wojtas; Qisheng Huo; Mohamed Eddaoudi; Yunling Liu","From Metal-Organic Squares to Porous Zeolite-like Supramolecular Assemblies","Journal of the American Chemical Society","2010","132","","18038","18041","10.1021/ja109980c","","","0.71073","MoKα","","0.057","0.045","","","0.1247","0.1312","","","","","","1.154","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00","" "4103729","29.319","0.003","29.319","0.003","29.319","0.003","90","","90","","90","","25203","4","293","2","293","2","","","","","","","","6","I m -3","-I 2 2 3","204","","","","- C46 H56 In4 K3 N26 O27.5 -","- C46 H56 In4 K3 N25.9867 O27.49 -","- C552 H672 In48 K36 N311.84 O329.88 -","12","0.25","","Shuang Wang; Tingting Zhao; Guanghua Li; Lukasz Wojtas; Qisheng Huo; Mohamed Eddaoudi; Yunling Liu","From Metal-Organic Squares to Porous Zeolite-like Supramolecular Assemblies","Journal of the American Chemical Society","2010","132","","18038","18041","10.1021/ja109980c","","","0.71073","MoKα","","0.0737","0.0497","","","0.1343","0.1464","","","","","","1.04","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00","" "4119117","9.3406","0.0019","12.461","0.003","15.759","0.003","90","","103.66","0.03","90","","1782.4","0.7","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C19 H23 Br F N O -","- C19 H23 Br F N O -","- C76 H92 Br4 F4 N4 O4 -","4","2","","Shibatomi, Kazutaka; Futatsugi, Kentaro; Kobayashi, Fumito; Iwasa, Seiji; Yamamoto, Hisashi","Stereoselective Construction of Halogenated Quaternary Stereogenic Centers via Catalytic Asymmetric Diels−Alder Reaction","Journal of the American Chemical Society","2010","132","16","5625","5627","10.1021/ja1018628","","","0.71073","MoKα","","0.0726","0.0503","","","0.1182","0.1302","","","","","","0.683","","","","has coordinates","178962","2020-10-21","18:00:00","" "4119136","12.2291","0.0001","13.0394","0.0002","16.4212","0.0003","94.7085","0.0008","106.87","0.0006","104.595","0.0006","2390.68","0.06","103","2","103.15","","","","","","","","","4","P -1","-P 1","2","","","","- C74 H162 O2 Si16 -","- C74 H162 O2 Si16 -","- C74 H162 O2 Si16 -","1","0.5","","Han, Joon Soo; Sasamori, Takahiro; Mizuhata, Yoshiyuki; Tokitoh, Norihiro","Reactivity of an Aryl-Substituted Silicon−Silicon Triple Bond: Reactions of a 1,2-Diaryldisilyne with Alkenes","Journal of the American Chemical Society","2010","132","8","2546","2547","10.1021/ja9108566","","","0.71075","MoKα","","0.0388","0.0358","","","0.0965","0.0994","","","","","","1.02","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00","" "9014103","5.571","","7.766","","5.513","","90","","90","","90","","238.517","","","","","","","","","","","","Synthetic","3","P 21 m a","P -2a 2a","26","","","Lueshite","- Na Nb O3 -","- Na Nb O3 -","- Na4 Nb4 O12 -","4","1","","Johnston, K. E.; Tang, C. C.; Parker, J. E.; Knight, K. S.; Lightfoot, P.; Ashbrook, S. E.","The polar phase of NaNbO3: a combined study by powder diffraction, solid-state NMR and first-principles calculations Note: this is a polymorph of lueshite","Journal of the American Chemical Society","2010","132","","8732","8746","10.1021/ja101860r","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""