# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-01T04:23:38+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Journal of the American Chemical Society') AND volume = 131 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
"4101586","11.3334","0.0002","14.8825","0.0003","15.6938","0.0004","90","","90","","90","","2647.06","0.1","298","2","130","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","GRF002","GRF002","","- C24 H44 O P2 Pd -","- C24 H44 O P2 Pd -","- C96 H176 O4 P8 Pd4 -","4","1","","Fulmer, Gregory R.; Muller, Richard P.; Kemp, Richard A.; Goldberg, Karen I.","Hydrogenolysis of Palladium(II) Hydroxide and Methoxide Pincer Complexes","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1346","","10.1021/ja807936q","","","0.71073","MoKα","","0.0805","0.0391","","","0.0889","0.1082","","","","","","1.036","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101587","11.0895","0.0003","15.69","0.0005","30.3155","0.001","90","","90","","90","","5274.7","0.3","130","2","130","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","GRF003","GRF003","","- C24 H48 O3 P2 Pd -","- C24 H48 O3 P2 Pd -","- C192 H384 O24 P16 Pd8 -","8","1","","Fulmer, Gregory R.; Muller, Richard P.; Kemp, Richard A.; Goldberg, Karen I.","Hydrogenolysis of Palladium(II) Hydroxide and Methoxide Pincer Complexes","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1346","","10.1021/ja807936q","","","0.71073","MoKα","","0.123","0.0537","","","0.1305","0.1602","","","","","","0.967","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101588","9.9429","0.0001","14.7868","0.0002","18.02","0.0003","90","","90","","90","","2649.43","0.06","130","2","130","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","GRF001","GRF001","","- C25 H46 O P2 Pd -","- C25 H46 O P2 Pd -","- C100 H184 O4 P8 Pd4 -","4","1","","Fulmer, Gregory R.; Muller, Richard P.; Kemp, Richard A.; Goldberg, Karen I.","Hydrogenolysis of Palladium(II) Hydroxide and Methoxide Pincer Complexes","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1346","","10.1021/ja807936q","","","0.71073","MoKα","","0.0582","0.0441","","","0.1076","0.1163","","","","","","0.996","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101589","7.2459","0.0004","8.6833","0.0004","11.2308","0.0005","90","","104.73","0.003","90","","683.4","0.06","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H19 Br O4 -","- C14 H19 Br O4 -","- C28 H38 Br2 O8 -","2","1","","Gao, Shuanhu; Wang, Oiaoling; Chen, Chuo","Synthesis and Structure Revision of Nakiterpiosin","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1410","","10.1021/ja808110d","","","0.7107","MoKα","","0.0388","0.0286","","","0.0577","0.0616","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101590","7.136","0.0002","14.06","0.0004","16.616","0.0005","90","","90","","90","","1667.12","0.08","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H17 Br Cl2 O3 -","- C15 H17 Br Cl2 O3 -","- C60 H68 Br4 Cl8 O12 -","4","1","","Gao, Shuanhu; Wang, Oiaoling; Chen, Chuo","Synthesis and Structure Revision of Nakiterpiosin","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1410","","10.1021/ja808110d","","","0.7107","MoKα","","0.0902","0.044","","","0.0725","0.0846","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101591","10.077","0.003","5.4733","0.0014","9.316","0.002","90","","98.07","0.02","90","","508.7","0.2","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Na6 Sn2 Zn -","- Na6 Sn2 Zn -","- Na12 Sn4 Zn2 -","2","0.25","","Kim, Sung-Jin; Kraus, Florian; Faessler, Thomas F.","Na6ZnSn2, Na4.24K1.76(1)ZnSn2, and Na20Zn8Sn11: Three Intermetallic Structures Containing the Linear {Sn-Zn-Sn}(6-) Unit","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1469","1478","10.1021/ja806737k","","","0.71073","MoKα","","0.032","0.0221","","","0.0437","0.0448","","","","","","0.928","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101592","11.5716","0.0005","9.8617","0.0002","11.382","0.0004","90","","119.334","0.005","90","","1132.32","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- K1.76 Na4.24 Sn2 Zn -","- K1.766 Na4.234 Sn2 Zn -","- K7.064 Na16.936 Sn8 Zn4 -","4","1","","Kim, Sung-Jin; Kraus, Florian; Faessler, Thomas F.","Na6ZnSn2, Na4.24K1.76(1)ZnSn2, and Na20Zn8Sn11: Three Intermetallic Structures Containing the Linear {Sn-Zn-Sn}(6-) Unit","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1469","1478","10.1021/ja806737k","","","0.71073","MoKα","","0.0452","0.0288","","","0.0615","0.0668","","","","","","0.986","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101593","16.1505","0.0014","9.2762","0.0006","27.594","0.002","90","","102.969","0.007","90","","4028.6","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Na20 Sn11 Zn8 -","- Na20 Sn11 Zn8 -","- Na80 Sn44 Zn32 -","4","0.5","","Kim, Sung-Jin; Kraus, Florian; Faessler, Thomas F.","Na6ZnSn2, Na4.24K1.76(1)ZnSn2, and Na20Zn8Sn11: Three Intermetallic Structures Containing the Linear {Sn-Zn-Sn}(6-) Unit","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1469","1478","10.1021/ja806737k","","","0.71073","MoKα","","0.0406","0.0352","","","0.0777","0.0865","","","","","","1.222","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101594","14.601","0.005","9.537","0.004","14.72","0.005","90","","117.062","0.006","90","","1825.5","1.1","299","2","299","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 O3 -","- C22 H22 O3 -","- C88 H88 O12 -","4","1","","Koyama, Ichiro; Kurahashi, Takuya; Matsubara, Seijiro","Nickel-Catalyzed {[}4+2] Cycloaddition of Enones with Alkynes","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1350","","10.1021/ja807952r","","","0.71073","MoKα","","0.0823","0.0575","","","0.1446","0.1589","","","","","","1.03","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101595","14.527","0.008","9.394","0.005","15.537","0.008","90","","114.869","0.008","90","","1923.6","1.7","299","2","299","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O3 -","- C24 H24 O3 -","- C96 H96 O12 -","4","1","","Koyama, Ichiro; Kurahashi, Takuya; Matsubara, Seijiro","Nickel-Catalyzed {[}4+2] Cycloaddition of Enones with Alkynes","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1350","","10.1021/ja807952r","","","0.71073","MoKα","","0.0552","0.048","","","0.1372","0.1437","","","","","","1.044","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101596","10.5195","0.0018","10.9929","0.0017","11.5575","0.0015","66.224","0.008","67.551","0.008","76.882","0.009","1126.2","0.3","153.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22.5 H30 N2 Ni O3 -","- C22.5 H30 N2 Ni O3 -","- C45 H60 N4 Ni2 O6 -","2","1","","Koyama, Ichiro; Kurahashi, Takuya; Matsubara, Seijiro","Nickel-Catalyzed {[}4+2] Cycloaddition of Enones with Alkynes","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1350","","10.1021/ja807952r","","","0.7107","MoKα","","","0.0528","","","","0.1608","","","","","","1.147","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101597","9.4768","0.0019","10.58","0.002","31.161","0.006","90","","94.53","0.03","90","","3114.6","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Cl N O3 -","- C18 H14 Cl N O3 -","- C144 H112 Cl8 N8 O24 -","8","2","","Liang, Yong; Jiao, Lei; Zhang, Shiwei; Yu, Zhi-Xiang; Xu, Jiaxi","New Insights into the Torquoselectivity of the Staudinger Reaction","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1542","1549","10.1021/ja808046e","","","0.71073","MoKα","","0.1299","0.0569","","","0.1172","0.1313","","","","","","1.01","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101598","16.082","0.003","12.461","0.003","7.8035","0.0016","90","","102.1","0.03","90","","1529","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Cl N O3 -","- C18 H14 Cl N O3 -","- C72 H56 Cl4 N4 O12 -","4","1","","Liang, Yong; Jiao, Lei; Zhang, Shiwei; Yu, Zhi-Xiang; Xu, Jiaxi","New Insights into the Torquoselectivity of the Staudinger Reaction","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1542","1549","10.1021/ja808046e","","","0.71073","MoKα","","0.0994","0.0434","","","0.0837","0.0901","","","","","","1.012","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101599","11.8743","0.0005","11.8743","0.0005","33.2046","0.0009","90","","90","","90","","4681.8","0.3","150","1","150","1","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C46 H44 B2 F8 Fe N4 P2 -","- C46 H44 B2 F8 Fe N4 P2 -","- C184 H176 B8 F32 Fe4 N16 P8 -","4","0.5","","Mikhailine, Alexandre; Lough, Alan J.; Morris, Robert H.","Efficient Asymmetric Transfer Hydrogenation of Ketones Catalyzed by an Iron Complex Containing a P-N-N-P Tetradentate Ligand Formed by Template Synthesis","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1394","","10.1021/ja809493h","","","0.71073","MoKα","","0.1301","0.0667","","","0.1381","0.1597","","","","","","0.931","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101600","21.049","0.005","14.373","0.005","22.479","0.005","90","","90","","90","","6801","3","93","2","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H38 Mo O2 Rh2 S4 -","- C34 H38 Mo O2 Rh2 S4 -","- C272 H304 Mo8 O16 Rh16 S32 -","8","1","","Muratsugu, Satoshi; Sodeyama, Keitaro; Kitamura, Fusao; Sugimoto, Manabu; Tsuneyuki, Shinji; Miyashita, Seiji; Kato, Tatsuhisa; Nishihara, Hiroshi","Two-Electron Reduction of a Rh-Mo-Rh Dithiolato Complex To Form a Triplet Ground State Associated with a Change in CO Coordination Mode","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1388","","10.1021/ja8090577","","","0.71069","MoKα","","","0.0354","","","","0.071","","","","","","1.184","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101601","22.7489","0.0017","6.5732","0.0005","7.9998","0.0006","90","","99.563","0.001","90","","1179.61","0.15","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1H-benzo[d]imidazol-2-yl)-4-iodoaniline","","- C13 H10 I N3 -","- C13 H10 I N3 -","- C52 H40 I4 N12 -","4","1","","Rodriguez-Rodriguez, Cristina; Sanchez de Groot, Natalia; Rimola, Albert; Alvarez-Larena, Angel; Lloveras, Vega; Vidal-Gancedo, Jose; Ventura, Salvador; Vendrell, Josep; Sodupe, Mariona; Gonzalez-Duarte, Pilar","Design, Selection, and Characterization of Thioflavin-Based Intercalation Compounds with Metal Chelating Properties for Application in Alzheimer's Disease","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1436","1451","10.1021/ja806062g","","","0.71073","MoKα","","0.0526","0.0361","","","0.0839","0.1062","","","","","","0.981","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101602","14.7636","0.0015","4.7515","0.0005","18.0167","0.0017","90","","106.323","0.002","90","","1212.9","0.2","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(benzo[d]thiazol-2-yl)-4-iodophenol","","- C13 H8 I N O S -","- C13 H8 I N O S -","- C52 H32 I4 N4 O4 S4 -","4","1","","Rodriguez-Rodriguez, Cristina; Sanchez de Groot, Natalia; Rimola, Albert; Alvarez-Larena, Angel; Lloveras, Vega; Vidal-Gancedo, Jose; Ventura, Salvador; Vendrell, Josep; Sodupe, Mariona; Gonzalez-Duarte, Pilar","Design, Selection, and Characterization of Thioflavin-Based Intercalation Compounds with Metal Chelating Properties for Application in Alzheimer's Disease","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1436","1451","10.1021/ja806062g","","","0.71073","MoKα","","0.071","0.0422","","","0.0924","0.1026","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101603","5.8887","0.0004","14.6161","0.0011","27.273","0.002","90","","90","","90","","2347.4","0.3","294","2","294","2","","","","","","","","5","P 2 21 21","P 2bc 2","18","","2-(benzo[d]oxazol-2-yl)-4-iodophenol","","- C13 H8 I N O2 -","- C13 H8 I N O2 -","- C104 H64 I8 N8 O16 -","8","2","","Rodriguez-Rodriguez, Cristina; Sanchez de Groot, Natalia; Rimola, Albert; Alvarez-Larena, Angel; Lloveras, Vega; Vidal-Gancedo, Jose; Ventura, Salvador; Vendrell, Josep; Sodupe, Mariona; Gonzalez-Duarte, Pilar","Design, Selection, and Characterization of Thioflavin-Based Intercalation Compounds with Metal Chelating Properties for Application in Alzheimer's Disease","JOURNAL OF THE AMERICAN CHEMICAL SOCIETY","2009","131","4","1436","1451","10.1021/ja806062g","","","0.71073","MoKα","","0.0977","0.0478","","","0.0802","0.0942","","","","","","0.961","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101667","5.6298","0.0004","8.2145","0.0006","37.372","0.003","90","","90","","90","","1728.3","0.2","85","2","85","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H16 Br N O3 -","- C21 H16 Br N O3 -","- C84 H64 Br4 N4 O12 -","4","1","","Duffey, Trisha A.; Shaw, Scott A.; Vedejs, Edwin","AcOLeDMAP and BnOLeDMAP: conformationally restricted nucleophilic catalysts for enantioselective rearrangement of indolyl acetates and carbonates.","Journal of the American Chemical Society","2009","131","1","14","15","10.1021/ja805541u","","","0.71073","MoKα","","0.0218","0.0217","","","0.0543","0.0544","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101668","7.2377","0.0018","10.127","0.003","15.948","0.004","103.179","0.003","96.629","0.003","109.845","0.003","1046.6","0.5","123","2","123","2","","","","","","","","5","P 1","P 1","1","","","","- C25 H20 Br N O3 -","- C25 H20 Br N O3 -","- C50 H40 Br2 N2 O6 -","2","2","","Duffey, Trisha A.; Shaw, Scott A.; Vedejs, Edwin","AcOLeDMAP and BnOLeDMAP: conformationally restricted nucleophilic catalysts for enantioselective rearrangement of indolyl acetates and carbonates.","Journal of the American Chemical Society","2009","131","1","14","15","10.1021/ja805541u","","","0.71073","MoKα","","0.0365","0.0279","","","0.0604","0.0639","","","","","","1.024","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101669","8.3738","0.0008","11.4894","0.0011","21.864","0.002","90","","90","","90","","2103.5","0.3","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H29 N3 O3 -","- C22 H29 N3 O3 -","- C88 H116 N12 O12 -","4","1","","Duffey, Trisha A.; Shaw, Scott A.; Vedejs, Edwin","AcOLeDMAP and BnOLeDMAP: conformationally restricted nucleophilic catalysts for enantioselective rearrangement of indolyl acetates and carbonates.","Journal of the American Chemical Society","2009","131","1","14","15","10.1021/ja805541u","","","0.71073","MoKα","","0.0345","0.0312","","","0.0805","0.083","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101670","12.5925","0.0007","13.144","0.0007","19.0071","0.001","89.02","0.001","74.248","0.001","63.938","0.001","2700.9","0.3","571","2","298","2","","","","","","","","8","P -1","-P 1","2","","","","- C51 H81 Cl4 N O2 P2 Ru S -","- C51 H81 Cl4 N O2 P2 Ru S -","- C102 H162 Cl8 N2 O4 P4 Ru2 S2 -","2","1","","Yun, Sang Young; Kim, Mansuk; Lee, Daesung; Wink, Donald J.","Structure and reactivity of alkynyl ruthenium alkylidenes.","Journal of the American Chemical Society","2009","131","1","24","25","10.1021/ja806218x","","","0.71073","MoKα","","0.0567","0.0416","","","0.1143","0.1313","","","","","","0.715","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101671","13.111","0.003","22.22","0.004","18.014","0.004","90","","94.542","0.004","90","","5231.5","1.9","298","2","298","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C53 H72 Cl2 N3 O2 P Ru S -","- C53 H72 Cl2 N3 O2 P Ru S -","- C212 H288 Cl8 N12 O8 P4 Ru4 S4 -","4","1","","Yun, Sang Young; Kim, Mansuk; Lee, Daesung; Wink, Donald J.","Structure and reactivity of alkynyl ruthenium alkylidenes.","Journal of the American Chemical Society","2009","131","1","24","25","10.1021/ja806218x","","","0.71073","MoKα","","0.1521","0.0832","","","0.1475","0.1732","","","","","","1.049","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101672","9.152","0.002","12.81","0.003","15.916","0.004","77.958","0.004","81.559","0.004","84.934","0.004","1801.9","0.7","105","2","105","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H48 Cl5 O P Ru -","- C34 H48 Cl5 O P Ru -","- C68 H96 Cl10 O2 P2 Ru2 -","2","1","","Yun, Sang Young; Kim, Mansuk; Lee, Daesung; Wink, Donald J.","Structure and reactivity of alkynyl ruthenium alkylidenes.","Journal of the American Chemical Society","2009","131","1","24","25","10.1021/ja806218x","","","0.71073","Mo-Kα","","0.065","0.0549","","","0.1472","0.155","","","","","","1.078","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4101673","9.034","0.003","9.516","0.003","11.485","0.003","84.428","0.008","81.872","0.008","83.45","0.009","967.7","0.5","150","2","150","2","","","","","","","","8","P -1","-P 1","2","Pt2(tfepma)2Cl2","","","- C18 H22 Cl2 F24 N2 O8 P4 Pt2 -","- C18 H22 Cl2 F24 N2 O8 P4 Pt2 -","- C18 H22 Cl2 F24 N2 O8 P4 Pt2 -","1","0.5","","Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G.","Chlorine photoelimination from a diplatinum core: circumventing the back reaction.","Journal of the American Chemical Society","2009","131","1","28","29","10.1021/ja807222p","","","0.71073","MoKα","","0.0195","0.0178","","","0.0432","0.0442","","","","","","1.037","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101674","23.3862","0.0014","8.7562","0.0005","22.1281","0.0013","90","","109.955","0.001","90","","4259.2","0.4","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","Pt2(tfepma)2Cl6","","","- C18 H22 Cl6 F24 N2 O8 P4 Pt2 -","- C18 H22 Cl6 F24 N2 O8 P4 Pt2 -","- C72 H88 Cl24 F96 N8 O32 P16 Pt8 -","4","0.5","","Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G.","Chlorine photoelimination from a diplatinum core: circumventing the back reaction.","Journal of the American Chemical Society","2009","131","1","28","29","10.1021/ja807222p","","","0.71073","MoKα","","0.0303","0.0235","","","0.053","0.0565","","","","","","1.084","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101675","10.499","0.003","13.544","0.004","29.154","0.009","90","","99.423","0.005","90","","4090","2","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Pt2(tfepma)2Cl4","","","- C18 H22 Cl4 F24 N2 O8 P4 Pt2 -","- C18 H22 Cl4 F24 N2 O8 P4 Pt2 -","- C72 H88 Cl16 F96 N8 O32 P16 Pt8 -","4","1","","Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G.","Chlorine photoelimination from a diplatinum core: circumventing the back reaction.","Journal of the American Chemical Society","2009","131","1","28","29","10.1021/ja807222p","","","0.71073","MoKα","","0.0594","0.0476","","","0.0911","0.095","","","","","","1.336","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101676","15.295","0.002","15.739","0.002","16.395","0.003","82.06","0.003","76.309","0.002","62.259","0.002","3392.1","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C77 H96.26 Cl1.74 O4.13 Pt2 -","- C77.002 H96.266 Cl1.742 O4.131 Pt2 -","- C154.004 H192.532 Cl3.484 O8.262 Pt4 -","2","1","","Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G.","Chlorine photoelimination from a diplatinum core: circumventing the back reaction.","Journal of the American Chemical Society","2009","131","1","28","29","10.1021/ja807222p","","","0.71073","MoKα","","0.0648","0.0446","","","0.0955","0.1052","","","","","","1.018","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101677","11.621","0.002","16.506","0.003","22.836","0.004","91.323","0.004","90.869","0.004","110.373","0.004","4104","1.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","Pt2(tfepma)2Cl4","","","- C18 H22 Cl4 F24 N2 O8 P4 Pt2 -","- C18 H22 Cl4 F24 N2 O8 P4 Pt2 -","- C72 H88 Cl16 F96 N8 O32 P16 Pt8 -","4","2","","Cook, Timothy R.; Surendranath, Yogesh; Nocera, Daniel G.","Chlorine photoelimination from a diplatinum core: circumventing the back reaction.","Journal of the American Chemical Society","2009","131","1","28","29","10.1021/ja807222p","","","0.71073","MoKα","","0.0971","0.0595","","","0.1295","0.1549","","","","","","1.015","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101678","25.0365","0.0005","11.1259","0.0002","24.5183","0.0005","90","","113.503","0.001","90","","6263.1","0.2","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C72 H82 B2 Fe N12 -","- C72 H82 B2 Fe N12 -","- C288 H328 B8 Fe4 N48 -","4","1","","Ni, Zhaoping; Shores, Matthew P","Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors.","Journal of the American Chemical Society","2009","131","1","32","33","10.1021/ja807379a","","","0.71073","MoKα","","0.0411","0.0343","","","0.0862","0.0928","","","","","","1.034","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101679","25.4833","0.0007","11.1536","0.0003","24.7455","0.0007","90","","113.466","0.001","90","","6451.7","0.3","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C72 H82 B2 Fe N12 -","- C72 H82 B2 Fe N12 -","- C288 H328 B8 Fe4 N48 -","4","1","","Ni, Zhaoping; Shores, Matthew P","Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors.","Journal of the American Chemical Society","2009","131","1","32","33","10.1021/ja807379a","","","0.71073","MoKα","","0.194","0.055","","","0.0837","0.1072","","","","","","1","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101680","13.4698","0.0004","18.017","0.0005","13.9282","0.0004","90","","115.011","0.001","90","","3063.2","0.15","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C72 H82 B2 Fe N12 -","- C72 H82 B2 Fe N12 -","- C144 H164 B4 Fe2 N24 -","2","1","","Ni, Zhaoping; Shores, Matthew P","Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors.","Journal of the American Chemical Society","2009","131","1","32","33","10.1021/ja807379a","","","0.71073","MoKα","","0","0.0323","","","0.0858","0.0936","","","","","","0.992","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101681","9.3168","0.0004","31.7028","0.0012","16.0446","0.0006","90","","90.283","0.002","90","","4739","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49 H62 B Br Fe N12 O -","- C49 H62 B Br Fe N12 O -","- C196 H248 B4 Br4 Fe4 N48 O4 -","4","1","","Ni, Zhaoping; Shores, Matthew P","Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors.","Journal of the American Chemical Society","2009","131","1","32","33","10.1021/ja807379a","","","0.71073","MoKα","","0.0919","0.0534","","","0.1303","0.1507","","","","","","1.01","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101682","9.4246","0.0004","31.7843","0.0013","16.3078","0.0007","90","","90","","90","","4885.1","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H62 B Br Fe N12 -","- C48 H62 B Br Fe N12 -","- C192 H248 B4 Br4 Fe4 N48 -","4","1","","Ni, Zhaoping; Shores, Matthew P","Magnetic observation of anion binding in iron coordination complexes: toward spin-switching chemosensors.","Journal of the American Chemical Society","2009","131","1","32","33","10.1021/ja807379a","","","0.71073","MoKα","","0.2259","0.0661","","","0.1515","0.1829","","","","","","1.005","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101683","11.849","0.0004","16.5426","0.0006","18.2817","0.0006","90","","92.494","0.001","90","","3580.1","0.2","243","2","243","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H50 Fe N4 -","- C40 H50 Fe N4 -","- C160 H200 Fe4 N16 -","4","1","","Russell, Sarah K.; Lobkovsky, Emil; Chirik, Paul J.","N-N bond cleavage in diazoalkanes by a bis(imino)pyridine iron complex.","Journal of the American Chemical Society","2009","131","1","36","37","10.1021/ja8075132","","","0.71073","MoKα","","0.0843","0.0471","","","0.1073","0.1244","","","","","","0.988","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101684","7.02","0.003","8.139","0.003","9.731","0.004","90","","104.87","0.03","90","","537.4","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C5 H13 Cl3 Co N2 -","- C5 H13 Cl3 Co N2 -","- C10 H26 Cl6 Co2 N4 -","2","1","","Ye, Heng-Yun; Fu, Da-Wei; Zhang, Yi; Zhang, Wen; Xiong, Ren-Gen; Huang, Songping D","Hydrogen-bonded ferroelectrics based on metal-organic coordination.","Journal of the American Chemical Society","2009","131","1","42","43","10.1021/ja808331g","","","0.71073","MoKα","","0.035","0.0295","","","0.0616","0.065","","","","","","1.047","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101685","7.0385","0.0014","8.1172","0.0016","9.754","0.002","90","","105.06","0.03","90","","538.1","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C5 H13 Cl3 N2 Zn -","- C5 H13 Cl3 N2 Zn -","- C10 H26 Cl6 N4 Zn2 -","2","1","","Ye, Heng-Yun; Fu, Da-Wei; Zhang, Yi; Zhang, Wen; Xiong, Ren-Gen; Huang, Songping D","Hydrogen-bonded ferroelectrics based on metal-organic coordination.","Journal of the American Chemical Society","2009","131","1","42","43","10.1021/ja808331g","","","0.71073","MoKα","","0.042","0.0364","","","0.0758","0.0786","","","","","","1.022","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101686","18.1452","0.0008","12.6687","0.0003","19.7459","0.0009","90","","112.809","0.0016","90","","4184.2","0.3","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H13 B F12 O -","- C22 H13 B F12 O -","- C176 H104 B8 F96 O8 -","8","2","","Ullrich, Matthias; Lough, Alan J.; Stephan, Douglas W.","Reversible, metal-free, heterolytic activation of H2 at room temperature.","Journal of the American Chemical Society","2009","131","1","52","53","10.1021/ja808506t","","","0.71073","MoKα","","0.0988","0.0461","","","0.0972","0.1204","","","","","","1.024","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101687","16.964","0.002","16.964","0.002","9.963","0.002","90","","90","","120","","2483","0.6","150","1","150","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C36 H38 B F12 P -","- C36 H38 B F12 P -","- C108 H114 B3 F36 P3 -","3","0.333333","","Ullrich, Matthias; Lough, Alan J.; Stephan, Douglas W.","Reversible, metal-free, heterolytic activation of H2 at room temperature.","Journal of the American Chemical Society","2009","131","1","52","53","10.1021/ja808506t","","","0.71073","MoKα","","0.0429","0.0359","","","0.0802","0.0855","","","","","","1.018","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101688","14.7861","0.0006","12.0082","0.0006","15.9814","0.001","90","","105.197","0.004","90","","2738.3","0.3","103","2","103","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H26 N4 O4 -","- C32 H26 N4 O4 -","- C128 H104 N16 O16 -","4","1","","Kawabata, Takeo; Jiang, Changsheng; Hayashi, Kazuhiro; Tsubaki, Kazunori; Yoshimura, Tomoyuki; Majumdar, Swapan; Sasamori, Takahiro; Tokitoh, Norihiro","Axially chiral binaphthyl surrogates with an inner N-H-N hydrogen bond.","Journal of the American Chemical Society","2009","131","1","54","55","10.1021/ja808213r","","","0.71069","MoKα","","0.075","0.0423","","","0.0966","0.1113","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4101689","10.8412","0.0015","18.736","0.003","29.809","0.004","90","","90","","90","","6054.8","1.5","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C60.25 H87.25 Br2 Mo N2 O2 P1.25 Si -","- C60.25 H87.25 Br2 Mo N2 O2 P1.25 Si -","- C241 H349 Br8 Mo4 N8 O8 P5 Si4 -","4","1","","Marinescu, Smaranda C.; Schrock, Richard R.; Li, Bo; Hoveyda, Amir H.","Inversion of configuration at the metal in diastereomeric imido alkylidene monoaryloxide monopyrrolide complexes of molybdenum.","Journal of the American Chemical Society","2009","131","1","58","59","10.1021/ja808308e","","","0.71073","MoKα","","0.0448","0.0401","","","0.1015","0.1047","","","","","","1.047","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101690","29.009","0.018","22.577","0.018","43.99","0.03","90","","96.182","0.017","90","","28643","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C130 H102.75 Cl3 F30 P11 Re2 S6 -","- C127.5 H101.5 Cl2.5 F24 P10 Re2 S6 -","- C1020 H812 Cl20 F192 P80 Re16 S48 -","8","1","","Grapperhaus, Craig A.; Ouch, Kagna; Mashuta, Mark S.","Redox-regulated ethylene binding to a rhenium-thiolate complex.","Journal of the American Chemical Society","2009","131","1","64","65","10.1021/ja8086483","","","0.71073","MoKα","","0.1253","0.0749","","","0.1843","0.1969","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101691","16.4246","0.0007","7.3362","0.0003","19.1152","0.0008","90","","103.219","0.004","90","","2242.24","0.17","135","2","135","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C24 H20 Ag N6 P -","- C24 H20 Ag N6 P -","- C96 H80 Ag4 N24 P4 -","4","1","","Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias","The binary silver nitrogen anion [Ag(N3)2]-.","Journal of the American Chemical Society","2009","131","1","72","74","10.1021/ja8077544","","","0.71073","MoKα","","0.0517","0.0308","","","0.0814","0.0885","","","","","","0.981","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101692","16.3409","0.0012","10.5219","0.0008","10.6388","0.0006","90","","94.213","0.006","90","","1824.3","0.2","200","2","200","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C18 H15 Ag N6 S -","- C18 H15 Ag N6 S -","- C72 H60 Ag4 N24 S4 -","4","1","","Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias","The binary silver nitrogen anion [Ag(N3)2]-.","Journal of the American Chemical Society","2009","131","1","72","74","10.1021/ja8077544","","","0.71073","MoKα","","0.0616","0.037","","","0.0686","0.0796","","","","","","1.041","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101693","14.2571","0.0007","12.4154","0.0007","9.4505","0.0005","90","","100.12","0.004","90","","1646.78","0.15","100","","100","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- As K3 S11 Ta2 -","- As K3 S11 Ta2 -","- As4 K12 S44 Ta8 -","4","1","","Bera, Tarun K.; Jang, Joon I.; Ketterson, John B.; Kanatzidis, Mercouri G.","Strong second harmonic generation from the tantalum thioarsenates A3Ta2AsS11 (A = K and Rb).","Journal of the American Chemical Society","2009","131","1","75","77","10.1021/ja807928d","","","0.71073","MoKα","","0.0223","0.0215","","","0.0546","0.0548","","","","","","1.034","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101694","14.4397","0.0008","12.8013","0.0009","9.5687","0.0005","90","","99.289","0.004","90","","1745.55","0.18","100","","100","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- As Rb3 S11 Ta2 -","- As Rb3 S11 Ta2 -","- As4 Rb12 S44 Ta8 -","4","1","","Bera, Tarun K.; Jang, Joon I.; Ketterson, John B.; Kanatzidis, Mercouri G.","Strong second harmonic generation from the tantalum thioarsenates A3Ta2AsS11 (A = K and Rb).","Journal of the American Chemical Society","2009","131","1","75","77","10.1021/ja807928d","","","0.71073","MoKα","","0.0331","0.031","","","0.0658","0.0663","","","","","","1.047","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101695","9.5967","0.0007","13.5926","0.0007","14.716","0.001","90","","98.876","0.006","90","","1896.6","0.2","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- As Cs3 S11 Ta2 -","- As Cs3 S11 Ta2 -","- As4 Cs12 S44 Ta8 -","4","1","","Bera, Tarun K.; Jang, Joon I.; Ketterson, John B.; Kanatzidis, Mercouri G.","Strong second harmonic generation from the tantalum thioarsenates A3Ta2AsS11 (A = K and Rb).","Journal of the American Chemical Society","2009","131","1","75","77","10.1021/ja807928d","","","0.71073","MoKα","","0.0559","0.0419","","","0.063","0.0659","","","","","","1.168","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101696","15.109","0.003","6.1735","0.0012","24.395","0.005","90","","91.535","0.004","90","","2274.6","0.8","89","2","89","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 O -","- C29 H32 O -","- C116 H128 O4 -","4","1","","Mitchell, Reginald H.; Zhang, Rui; Berg, David J.; Twamley, Brendan; Williams, Richard Vaughan","Measuring aromaticity with the dimethyldihydropyrene ring current probe. Experimental and computational studies of the fulvenes and the strongly antiaromatic cyclopentadienone reveal large Mills-Nixon-type bond localization effects. Synthesis of fulvene-fused dihydropyrenes.","Journal of the American Chemical Society","2009","131","1","189","199","10.1021/ja806427n","","x-ray","0.71073","MoKα","","0.0954","0.0685","","","0.1519","0.1622","","","","","","1.097","","","","has coordinates,has disorder","211196","2020-10-21","18:00:00",""
"4101697","9.685","0.004","10.666","0.004","12.406","0.005","112.859","0.007","91.953","0.008","103.258","0.008","1138.5","0.8","86","2","86","2","","","","","","","","3","P -1","-P 1","2","Cyclopentenone-tBuDHP","","","- C29 H34 O -","- C29 H34 O -","- C58 H68 O2 -","2","1","","Mitchell, Reginald H.; Zhang, Rui; Berg, David J.; Twamley, Brendan; Williams, Richard Vaughan","Measuring aromaticity with the dimethyldihydropyrene ring current probe. Experimental and computational studies of the fulvenes and the strongly antiaromatic cyclopentadienone reveal large Mills-Nixon-type bond localization effects. Synthesis of fulvene-fused dihydropyrenes.","Journal of the American Chemical Society","2009","131","1","189","199","10.1021/ja806427n","","x-ray","0.71073","MoKα","","0.1308","0.0668","","","0.1474","0.1758","","","","","","0.999","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101698","16.893","0.003","21.358","0.004","8.0731","0.0016","90","","90","","90","","2912.8","0.9","150","2","150","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C34 H20 F4 N0 O4 P2 W -","- C34 H18 F4 O4 P2 W -","- C136 H72 F16 O16 P8 W4 -","4","0.5","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71073","MoKα","","0.0247","0.0208","","","0.045","0.0463","","","","","","1.027","","","","has coordinates,has disorder","178762","2020-10-21","18:00:00",""
"4101699","8.8522","0.0018","10.297","0.002","12.389","0.003","90","","107.84","0.03","90","","1075","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 Cl N2 O4 Re -","- C7 H6 Cl N2 O4 Re -","- C28 H24 Cl4 N8 O16 Re4 -","4","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71073","MoKα","","0.0312","0.0264","","","0.0596","0.0619","","","","","","1.039","","","","has coordinates","178762","2020-10-21","18:00:00",""
"4101700","9.03","0.005","10.898","0.005","19.929","0.005","75.388","0.005","82.356","0.005","68.013","0.005","1758.1","1.3","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H30 Cl F2 N2 O6 P2 Re -","- C36 H24 Cl F2 N2 O6 P2 Re -","- C72 H48 Cl2 F4 N4 O12 P4 Re2 -","2","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71069","MoKα","","0.0368","0.0308","","","0.066","0.069","","","","","","1.045","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101701","9.8118","0.0004","19.1632","0.0006","17.1424","0.0007","90","","93.836","0.003","90","","3216","0.2","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H24 F3 N2 O3 P2 Re -","- C36 H24 F3 N2 O3 P2 Re -","- C144 H96 F12 N8 O12 P8 Re4 -","4","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","1.54178","CuKα","","0.0567","0.0359","","","0.0671","0.0702","","","","","","0.88","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101702","9.9913","0.0012","10.8606","0.0014","18.072","0.002","96.301","0.003","101.241","0.002","114.69","0.002","1706.9","0.4","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H26.5 Cl3 F2 N2 O2.25 P2 Re -","- C36 H26 Cl3 F2 N2 O2.25 P2 Re -","- C72 H52 Cl6 F4 N4 O4.5 P4 Re2 -","2","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71073","MoKα","","0.0518","0.0415","","","0.0858","0.0895","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101703","12.506","0.003","13.456","0.003","12.976","0.003","90","","91.53","0.03","90","","2182.8","0.9","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 Br Mn N2 O4 -","- C7 H6 Br Mn N2 O4 -","- C56 H48 Br8 Mn8 N16 O32 -","8","2","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71073","MoKα","","0.0387","0.0282","","","0.0511","0.0541","","","","","","1.02","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101704","16.493","0.003","11.902","0.002","18.845","0.003","90","","105.589","0.004","90","","3563.2","1.1","153","2","153","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C37 H26 Br Cl2 F2 Mn N2 O3 P2 -","- C37 H26 Br Cl2 F2 Mn N2 O3 P2 -","- C148 H104 Br4 Cl8 F8 Mn4 N8 O12 P8 -","4","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71073","MoKα","","0.0684","0.0449","","","0.1054","0.1155","","","","","","1.027","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101705","13.051","0.007","9.533","0.005","20.391","0.011","90","","101.09","0.03","90","","2490","2","100","","100","","","","","","","","dimethylformamide","4","P 1 21/c 1","-P 2ybc","14","","4-trans-(3',5'-di-tert-butyl-phenyldiazo)-3-spiro-(N- methyl-4'-piperidyl)-phthalide","","- C27 H35 N3 O2 -","- C27 H35 N3 O2 -","- C108 H140 N12 O8 -","4","1","","Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan","Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach.","Journal of the American Chemical Society","2009","131","1","357","367","10.1021/ja807694s","","","1.54178","CuKα","","0.2251","0.0659","","","0.1473","0.1977","","","","","","0.954","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101706","11.465","0.002","11.577","0.002","18.72","0.004","91.16","0.03","103.05","0.03","104.05","0.03","2340.7","0.9","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C43 H34 Cl4 F4 N4 O6 P2 Re2 -","- C42.9 H34 Cl4 F4 N4 O5.9 P2 Re2 -","- C85.8 H68 Cl8 F8 N8 O11.8 P4 Re4 -","2","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71073","MoKα","","0.0393","0.0308","","","0.0625","0.0658","","","","","","1.033","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00",""
"4101707","51.292","0.004","13.2238","0.0011","29.0236","0.0019","90","","118.497","0.007","90","","17301","3","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H41 N3 O2 -","- C30 H41 N3 O2 -","- C720 H984 N72 O48 -","24","3","","Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan","Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach.","Journal of the American Chemical Society","2009","131","1","357","367","10.1021/ja807694s","","","0.71073","MoKα","","0.0891","0.0438","","","0.085","0.0949","","","","","","0.81","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101708","11.201","0.005","11.8","0.005","20.504","0.005","92.239","0.005","100.058","0.005","117.123","0.005","2353.1","1.6","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H50 Cl F4 N2 O6 P2 Re -","- C48 H42 Cl F4 N2 O6 P2 Re -","- C96 H84 Cl2 F8 N4 O12 P4 Re2 -","2","1","","Kaufhold, Oliver; Stasch, Andreas; Pape, Tania; Hepp, Alexander; Edwards, Peter G.; Newman, Paul D.; Hahn, F. Ekkehardt","Metal template controlled formation of [11]ane-P2C(NHC) macrocycles.","Journal of the American Chemical Society","2009","131","1","306","317","10.1021/ja807333f","","","0.71069","MoKα","","0.0448","0.0415","","","0.0987","0.1005","","","","","","1.095","","","","has coordinates,has disorder","178763","2020-10-21","18:00:00",""
"4101709","11.3812","0.0004","24.8447","0.001","12.4766","0.0004","90","","116.154","0.003","90","","3166.7","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-trans-(3',5'-bis-(2,6-dimethylphenyl)phenyldiazo)-3-spiro- (N-tert-butyl-4'-piperidyl)-phthalide","","- C38 H41 N3 O2 -","- C38 H41 N3 O2 -","- C152 H164 N12 O8 -","4","1","","Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan","Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach.","Journal of the American Chemical Society","2009","131","1","357","367","10.1021/ja807694s","","","0.71073","MoKα","","0.0778","0.0392","","","0.0697","0.0773","","","","","","0.835","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4101710","7.5388","0.0013","13.771","0.002","14.573","0.002","93.35","0.02","102.371","0.019","100.33","0.02","1446.4","0.4","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H41 N3 O2 -","- C30 H41 N3 O2 -","- C60 H82 N6 O4 -","2","1","","Stoll, Ragnar S; Peters, Maike V; Kuhn, Andreas; Heiles, Sven; Goddard, Richard; Bühl, Michael; Thiele, Christina M; Hecht, Stefan","Photoswitchable catalysts: correlating structure and conformational dynamics with reactivity by a combined experimental and computational approach.","Journal of the American Chemical Society","2009","131","1","357","367","10.1021/ja807694s","","","0.71073","MoKα","","0.1186","0.0463","","","0.0877","0.1037","","","","","","0.789","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103745","17.084","0.0009","9.2508","0.0004","10.2983","0.0005","90","","90","","90","","1627.55","0.14","243","2","243","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C17 H30 O3 -","- C17 H30 O3 -","- C68 H120 O12 -","4","1","","Kevin M. McQuaid; Dalibor Sames","C-H Bond Functionalization via Hydride Transfer: Lewis Acid Catalyzed Alkylation Reactions by Direct Intramolecular Coupling of sp3 C-H Bonds and Reactive Alkenyl Oxocarbenium Intermediates","Journal of the American Chemical Society","2009","131","","402","403","10.1021/ja806068h","","","0.71073","MoKα","","0.0556","0.0407","","","0.1158","0.1279","","","","","","1.061","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103746","9.6931","0.0005","9.8584","0.0005","11.9252","0.0006","90","","90","","90","","1139.55","0.1","125","2","125","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H13 O2 -","- C14 H13 O2 -","- C56 H52 O8 -","4","1","","Kevin M. McQuaid; Dalibor Sames","C-H Bond Functionalization via Hydride Transfer: Lewis Acid Catalyzed Alkylation Reactions by Direct Intramolecular Coupling of sp3 C-H Bonds and Reactive Alkenyl Oxocarbenium Intermediates","Journal of the American Chemical Society","2009","131","","402","403","10.1021/ja806068h","","","0.71073","MoKα","","0.0702","0.0582","","","0.1839","0.2002","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103747","8.595","0.002","9.799","0.003","10.014","0.003","71.928","0.005","85.027","0.005","68.533","0.005","745.8","0.4","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 N2 O5 -","- C16 H14 N2 O5 -","- C32 H28 N4 O10 -","2","1","","Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda","Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism","Journal of the American Chemical Society","2009","131","","570","576","10.1021/ja8062315","","","0.71073","MoKα","","0.0898","0.051","","","0.1048","0.122","","","","","","1.016","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103748","17.451","0.004","17.675","0.005","21.505","0.006","90","","90","","90","","6633","3","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C70 H79 Ag N4 O7 P2 -","- C70 H79 Ag N4 O7 P2 -","- C280 H316 Ag4 N16 O28 P8 -","4","1","","Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda","Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism","Journal of the American Chemical Society","2009","131","","570","576","10.1021/ja8062315","","","0.71073","MoKα","","0.0352","0.0316","","","0.0861","0.0895","","","","","","1.029","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103749","8.8375","0.0016","11.63","0.002","18.584","0.003","90","","90","","90","","1910.1","0.6","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 Cl N2 O5 -","- C20 H19 Cl N2 O5 -","- C80 H76 Cl4 N8 O20 -","4","1","","Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda","Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism","Journal of the American Chemical Society","2009","131","","570","576","10.1021/ja8062315","","","0.71073","MoKα","","0.1139","0.0615","","","0.1043","0.1226","","","","","","0.995","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103750","6.4323","0.0002","9.5882","0.0002","23.5349","0.0006","90","","90","","90","","1451.5","0.07","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H17 N O5 -","- C15 H17 N O5 -","- C60 H68 N4 O20 -","4","1","","Laura C. Wieland; Erika M. Vieira; Marc L. Snapper; Amir H. Hoveyda","Ag-Catalyzed Diastereo- and Enantioselective Vinylogous Mannich Reactions of α-Ketoimine Esters. Development of a Method and Investigation of its Mechanism","Journal of the American Chemical Society","2009","131","","570","576","10.1021/ja8062315","","","1.54178","CuKα","","0.0242","0.0241","","","0.0628","0.0629","","","","","","1.049","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103751","6.4306","0.0013","10.05","0.002","11.98","0.002","84.052","0.004","84.765","0.003","88.383","0.004","766.7","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H18 N6 O2 -","- C16 H18 N6 O2 -","- C32 H36 N12 O4 -","2","1","","Roslyn S. Butler; Pamela Cohn; Phillip Tenzel; Khalil A. Abboud; Ronald K. Castellano","Synthesis, Photophysical Behavior, and Electronic Structure of Push-Pull Purines","Journal of the American Chemical Society","2009","131","","623","633","10.1021/ja806348z","","","0.71073","MoKα","","0.055","0.0392","","","0.0982","0.1046","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103752","10.6415","0.0008","13.5541","0.001","13.043","0.0009","90","","107.01","0.01","90","","1799","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H21 N7 O3 -","- C18 H21 N7 O3 -","- C72 H84 N28 O12 -","4","1","","Roslyn S. Butler; Pamela Cohn; Phillip Tenzel; Khalil A. Abboud; Ronald K. Castellano","Synthesis, Photophysical Behavior, and Electronic Structure of Push-Pull Purines","Journal of the American Chemical Society","2009","131","","623","633","10.1021/ja806348z","","","0.71073","MoKα","","0.0545","0.0442","","","0.1101","0.1162","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103753","7.7544","0.0011","11.0912","0.0015","22.122","0.003","90","","90","","90","","1902.6","0.5","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H36 Fe N2 -","- C16 H36 Fe N2 -","- C64 H144 Fe4 N8 -","4","1","","William M. Reiff; Charles E. Schulz; Myung-Hwan Whangbo; Jung In Seo; Yoon Sup Lee; Gregory R. Potratz; Charles W. Spicer; Gregory S. Girolami","Consequences of a Linear Two-Coordinate Geometry for the Orbital Magnetism and Jahn-Teller Distortion Behavior of the High Spin Iron(II) Complex Fe[N(t-Bu)2]2","Journal of the American Chemical Society","2009","131","","404","405","10.1021/ja806660f","","","0.71073","MoKα","","0.0654","0.0338","","","0.0661","0.0744","","","","","","0.941","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103754","4.4968","0.0007","10.4078","0.0016","11.821","0.0018","70.645","0.002","85.722","0.003","84.971","0.003","519.36","0.14","273","2","273","2","","","","","","","","4","P -1","-P 1","2","NH4Hog.2H2O","","","- C6 H13 N3 O7 -","- C6 H13 N3 O7 -","- C12 H26 N6 O14 -","2","1","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.0822","0.0626","","","0.1757","0.1985","","","","","","1.07","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103755","13.9089","0.0016","7.685","0.0009","14.2279","0.0016","90","","97.758","0.002","90","","1506.9","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(methylNH3)2og.2H2O","","","- C8 H22 N4 O8 -","- C8 H22 N4 O8 -","- C32 H88 N16 O32 -","4","1","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.0723","0.0594","","","0.1553","0.1692","","","","","","1.028","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103756","8.969","0.002","7.779","0.002","11.803","0.003","90","","95.522","0.004","90","","819.7","0.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(ethylNH3)2og.2H2O","","","- C10 H26 N4 O8 -","- C10 H26 N4 O8 -","- C20 H52 N8 O16 -","2","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.124","0.0899","","","0.2419","0.1905","","","","","","0.973","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103757","9.962","0.002","9.965","0.002","10.064","0.002","70.093","0.004","69.558","0.004","66.216","0.003","833.1","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H26 N4 O6 -","- C12 H26 N4 O6 -","- C24 H52 N8 O12 -","2","1","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.1251","0.0734","","","0.2021","0.2305","","","","","","0.959","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103758","9.365","0.0011","12.6982","0.0014","12.7582","0.0014","75.762","0.002","75.679","0.002","82.023","0.002","1420","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","(butylNH3)2og","","","- C14 H30 N4 O6 -","- C14 H30 N4 O6 -","- C42 H90 N12 O18 -","3","1.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.1538","0.0785","","","0.2144","0.2612","","","","","","0.885","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103759","5.0096","0.001","11.818","0.002","14.202","0.003","74.787","0.004","81.591","0.004","77.922","0.004","789.7","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","(pentylNH3)2og.H2og","","","- C11 H21 N3 O6 -","- C11 H21 N3 O6 -","- C22 H42 N6 O12 -","2","1","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.1204","0.0687","","","0.1712","0.1976","","","","","","0.934","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103760","4.994","0.003","16.209","0.011","20.341","0.014","90","","90.221","0.013","90","","1646.5","1.9","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(hexylNH3)2Hog","","","- C12 H23 N3 O6 -","- C12 H23 N3 O6 -","- C48 H92 N12 O24 -","4","1","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.3593","0.0642","","","0.1367","0.2207","","","","","","0.957","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103761","4.9193","0.0009","10.2941","0.0019","10.765","0.002","88.508","0.005","76.911","0.004","85.008","0.004","528.95","0.17","273","2","273","2","","","","","","","","4","P -1","-P 1","2","(benzylNH3)2og","","","- C20 H26 N4 O6 -","- C20 H26 N4 O6 -","- C20 H26 N4 O6 -","1","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.0956","0.0847","","","0.2172","0.2383","","","","","","1.149","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103762","5.0552","0.0015","9.651","0.003","11.101","0.003","81.894","0.006","81.684","0.006","83.687","0.005","528.3","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","(cyclohexylNH3)2og","","","- C18 H34 N4 O6 -","- C18 H34 N4 O6 -","- C18 H34 N4 O6 -","1","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.0745","0.0631","","","0.1841","0.199","","","","","","1.097","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103763","4.943","0.002","23.463","0.009","10.699","0.004","90","","101.774","0.007","90","","1214.7","0.8","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(ethynylbenzylNH3)2og","","","- C24 H26 N4 O6 -","- C24 H26 N4 O6 -","- C48 H52 N8 O12 -","2","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.2736","0.0792","","","0.1758","0.2584","","","","","","0.72","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103764","4.931","0.003","10.017","0.007","13.738","0.009","85.899","0.014","84.56","0.02","85.141","0.016","671.7","0.8","273","2","273","2","","","","","","","","4","P -1","-P 1","2","(diacetylenylbenzylNH3)2og monomer","","","- C28 H26 N4 O6 -","- C28 H26 N4 O6 -","- C28 H26 N4 O6 -","1","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.1917","0.0781","","","0.1111","0.1551","","","","","","0.823","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103765","15.822","0.015","9.289","0.008","9.526","0.009","90","","100.914","0.012","90","","1375","2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(diethynylbenzylNH3)2og hydrate","","","- C28 H30 N4 O8 -","- C28 H30 N4 O8 -","- C56 H60 N8 O16 -","2","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.4409","0.0791","","","0.0806","0.1848","","","","","","0.867","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103766","13.594","0.005","8.266","0.003","13.865","0.005","90","","100.435","0.006","90","","1532.2","1","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(diethynylbenzylNH3)2og methanol","","","- C30 H34 N4 O8 -","- C30 H34 N4 O8 -","- C60 H68 N8 O16 -","2","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.1736","0.0974","","","0.1081","0.1831","","","","","","0.833","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103767","4.8862","0.0019","10.072","0.004","13.67","0.005","79.154","0.006","88.615","0.009","85.662","0.008","658.8","0.4","273","2","273","2","","","","","","","","4","P -1","-P 1","2","(diethynylbenzylNH3)2og polymer","","","- C28 H26 N4 O6 -","- C28 H26 N4 O6 -","- C28 H26 N4 O6 -","1","0.5","","Zhong Li; Frank W. Fowler; Joseph W. Lauher","Weak Interactions Dominating the Supramolecular Self-Assembly in a Salt: A Designed Single-Crystal-to-Single-Crystal Topochemical Polymerization of a Terminal Aryldiacetylene","Journal of the American Chemical Society","2009","131","","634","643","10.1021/ja806663h","","","0.71073","MoKα","","0.4372","0.0624","","","0.0944","0.1577","","","","","","0.849","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103768","7.6165","0.0003","16.5619","0.0007","16.8917","0.0007","90","","92.805","0.001","90","","2128.23","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C96 H96 N16 O16 -","8","2","","Jian Dong; Kyril M. Solntsev; Laren M. Tolbert","Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing","Journal of the American Chemical Society","2009","131","","662","670","10.1021/ja806962e","","","1.54178","CuKα","","0.0349","0.0338","","","0.0899","0.0908","","","","","","1.043","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103769","11.4832","0.0004","7.7162","0.0003","13.3246","0.0005","90","","102.553","0.002","90","","1152.43","0.07","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C52 H56 N8 O8 -","4","1","","Jian Dong; Kyril M. Solntsev; Laren M. Tolbert","Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing","Journal of the American Chemical Society","2009","131","","662","670","10.1021/ja806962e","","","1.54178","CuKα","","0.0384","0.0361","","","0.0997","0.1015","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103770","7.4623","0.0005","10.0972","0.0006","11.7537","0.0008","88.216","0.003","79.002","0.002","71.188","0.002","822.48","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 N2 O2 -","- C18 H24 N2 O2 -","- C36 H48 N4 O4 -","2","1","","Jian Dong; Kyril M. Solntsev; Laren M. Tolbert","Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing","Journal of the American Chemical Society","2009","131","","662","670","10.1021/ja806962e","","","1.54178","CuKα","","0.0396","0.0353","","","0.1029","0.1077","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103771","7.4678","0.0003","10.2078","0.0007","15.4909","0.0007","85.971","0.003","85.619","0.004","71.602","0.004","1115.91","0.11","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H36 N2 O2 -","- C24 H36 N2 O2 -","- C48 H72 N4 O4 -","2","1","","Jian Dong; Kyril M. Solntsev; Laren M. Tolbert","Activation and Tuning of Green Fluorescent Protein Chromophore Emission by Alkyl Substituent-Mediated Crystal Packing","Journal of the American Chemical Society","2009","131","","662","670","10.1021/ja806962e","","","1.54178","CuKα","","0.0557","0.0449","","","0.1261","0.1349","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103772","7.9946","0.0007","12.0879","0.0011","13.1153","0.0012","70.346","0.002","82.95","0.002","84.082","0.002","1181.98","0.18","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C25 H17 Al Cl2 N6 O3 -","- C25 H17 Al Cl2 N6 O3 -","- C50 H34 Al2 Cl4 N12 O6 -","2","1","","Szu-Hung Liao; Jin-Ruei Shiu; Shun-Wei Liu; Shi-Jay Yeh; Yu-Hung Chen; Chin-Ti Chen; Tahsin J. Chow; Chih-I Wu","Hydroxynaphthyridine-Derived Group III Metal Chelates: Wide Band Gap and Deep Blue Analogues of Green Alq3(Tris(8-hydroxyquinolate)aluminum) and Their Versatile Applications for Organic Light-Emitting Diodes","Journal of the American Chemical Society","2009","131","","763","777","10.1021/ja807284e","","","0.71073","MoKα","","0.0857","0.0588","","","0.1663","0.1748","","","","","","0.977","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103773","6.2898","0.0013","16.096","0.003","14.357","0.003","90","","90.204","0.003","90","","1453.5","0.5","141","2","141","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 N O6 V -","- C13 H15 N O7 V -","- C52 H60 N4 O28 V4 -","4","1","","Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; Andrew D. Sutton; David L. Thorn","Aerobic Oxidation of Pinacol by Vanadium(V) Dipicolinate Complexes: Evidence for Reduction to Vanadium(III)","Journal of the American Chemical Society","2009","131","","428","429","10.1021/ja807522n","","","0.71073","MoKα","","0.0568","0.0427","","","0.0971","0.0998","","","","","","1.528","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103774","9.6731","0.0009","9.8036","0.0009","16.6299","0.0016","90","","90","","90","","1577","0.3","120","1","120","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H13 N3 O5 V -","- C17 H13 N3 O5 V -","- C68 H52 N12 O20 V4 -","4","1","","Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; Andrew D. Sutton; David L. Thorn","Aerobic Oxidation of Pinacol by Vanadium(V) Dipicolinate Complexes: Evidence for Reduction to Vanadium(III)","Journal of the American Chemical Society","2009","131","","428","429","10.1021/ja807522n","","","0.71073","MoKα","","0.042","0.0321","","","0.0641","0.0672","","","","","","1.09","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103775","28.459","0.005","8.6208","0.0015","19.834","0.003","90","","121.545","0.002","90","","4147","1.2","120","1","120","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H36 N8 O9 V2 -","- C44 H36 N8 O9 V2 -","- C176 H144 N32 O36 V8 -","4","0.5","","Susan K. Hanson; R. Tom Baker; John C. Gordon; Brian L. Scott; Andrew D. Sutton; David L. Thorn","Aerobic Oxidation of Pinacol by Vanadium(V) Dipicolinate Complexes: Evidence for Reduction to Vanadium(III)","Journal of the American Chemical Society","2009","131","","428","429","10.1021/ja807522n","","","0.71073","MoKα","","0.1025","0.0515","","","0.1152","0.1319","","","","","","0.767","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103776","39.761","0.002","39.761","0.002","14.6366","0.001","90","","90","","90","","23140","2","173","2","173","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C36 H92 K12 N24 O82 V18 -","- C36 H36 K12 N24 O77.7375 V18 -","- C288 H288 K96 N192 O621.9 V144 -","8","0.5","","Xikui Fang; Paul Kögerler; Lyle Isaacs; Sayaka Uchida; Noritaka Mizuno","Cucurbit[n]uril-Polyoxoanion Hybrids","Journal of the American Chemical Society","2009","131","","432","433","10.1021/ja807751b","","","0.71073","MoKα","","0.1346","0.0898","","","0.2204","0.237","","","","","","1.127","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103777","14.5575","0.0011","31.58","0.002","38.173","0.003","90","","90.127","0.001","90","","17549","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C72 H144 N36 Na12 O93 V18 -","- C72 H76 N36 Na7.75 O107 V18 -","- C288 H304 N144 Na31 O428 V72 -","4","0.5","","Xikui Fang; Paul Kögerler; Lyle Isaacs; Sayaka Uchida; Noritaka Mizuno","Cucurbit[n]uril-Polyoxoanion Hybrids","Journal of the American Chemical Society","2009","131","","432","433","10.1021/ja807751b","","","0.71073","MoKα","","0.0959","0.0844","","","0.2375","0.2459","","","","","","1.121","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103778","17.972","0.002","10.7424","0.0014","18.427","0.003","90","","93.794","0.003","90","","3549.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H54 N4 O V -","- C37 H54 N4 O V -","- C148 H216 N16 O4 V4 -","4","1","","Jared S. Silvia; Christopher C. Cummins","Two-Electron Reduction of a Vanadium(V) Nitride by CO To Release Cyanate and Open a Coordination Site","Journal of the American Chemical Society","2009","131","","446","447","10.1021/ja807767w","","","0.71073","MoKα","","0.0527","0.0378","","","0.0913","0.0996","","","","","","1.056","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103779","7.273","0.0006","8.7412","0.0008","20.8648","0.0018","90","","90","","90","","1326.5","0.2","200","","200","","","","","","","","Synthesized by the authors. See text","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H17 F2 N O2 -","- C15 H17 F2 N O2 -","- C60 H68 F8 N4 O8 -","4","1","","Robert Webster; Christian Böing; Mark Lautens","Reagent-Controlled Regiodivergent Resolution of Unsymmetrical Oxabicyclic Alkenes Using a Cationic Rhodium Catalyst","Journal of the American Chemical Society","2009","131","","444","445","10.1021/ja807942m","","","1.54178","CuKα","","0.0547","0.0539","","","0.128","0.1301","","","","","","1.084","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103780","7.5519","0.0006","7.8449","0.0006","11.5761","0.0008","90","","91.663","0.002","90","","685.52","0.09","200","","200","","","","","","","","Synthesized by the authors. See text","5","P 1 21 1","P 2yb","4","","","","- C15 H17 F2 N O2 -","- C15 H17 F2 N O2 -","- C30 H34 F4 N2 O4 -","2","1","","Robert Webster; Christian Böing; Mark Lautens","Reagent-Controlled Regiodivergent Resolution of Unsymmetrical Oxabicyclic Alkenes Using a Cationic Rhodium Catalyst","Journal of the American Chemical Society","2009","131","","444","445","10.1021/ja807942m","","","1.54178","CuKα","","0.0521","0.052","","","0.1096","0.1098","","","","","","1.16","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103781","10.2115","0.0007","11.9691","0.0007","15.3437","0.0009","96.244","0.005","95.976","0.005","91.175","0.005","1853.1","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C39.5 H45 O8 P Pd S2 -","- C37 H39 O8 P Pd S2 -","- C74 H78 O16 P2 Pd2 S4 -","2","1","","Damien Guironnet; Philipp Roesle; Thomas Rünzi; Inigo Göttker-Schnetmann; Stefan Mecking","Insertion Polymerization of Acrylate","Journal of the American Chemical Society","2009","131","","422","423","10.1021/ja808017n","","","0.71073","MoKα","","0.066","0.0456","","","0.0851","0.0902","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103782","10.9981","0.0008","12.0103","0.0009","12.0742","0.001","83.154","0.006","67.82","0.006","88.107","0.006","1466.2","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H35 Ni O8 P S2 -","- C27 H35 Ni O8 P S2 -","- C54 H70 Ni2 O16 P2 S4 -","2","1","","Damien Guironnet; Philipp Roesle; Thomas Rünzi; Inigo Göttker-Schnetmann; Stefan Mecking","Insertion Polymerization of Acrylate","Journal of the American Chemical Society","2009","131","","422","423","10.1021/ja808017n","","","0.71073","MoKα","","0.088","0.0548","","","0.1264","0.1427","","","","","","1.037","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103783","21.961","0.003","8.5678","0.0009","21.91","0.003","90","","113.555","0.003","90","","3779","0.8","143","1","143","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H34 B3 N O6 -","- C12 H34 B3 N O6 -","- C96 H272 B24 N8 O48 -","8","2","","Chang Won Yoon; Patrick J. Carroll; Larry G. Sneddon","Ammonia Triborane: A New Synthesis, Structural Determinations, and Hydrolytic Hydrogen-Release Properties","Journal of the American Chemical Society","2009","131","","855","864","10.1021/ja808045p","","","0.71073","MoKα","","0.056","0.0498","","","0.1208","0.127","","","","","","1.086","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103784","10.358","0.003","4.8041","0.0012","9.967","0.003","90","","115.141","0.006","90","","449","0.2","143","1","143","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- B3 H10 N -","- B3 H10 N -","- B12 H40 N4 -","4","1","","Chang Won Yoon; Patrick J. Carroll; Larry G. Sneddon","Ammonia Triborane: A New Synthesis, Structural Determinations, and Hydrolytic Hydrogen-Release Properties","Journal of the American Chemical Society","2009","131","","855","864","10.1021/ja808045p","","","0.71073","MoKα","","0.0438","0.0411","","","0.1078","0.1098","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103785","12.0504","0.0005","12.6148","0.0004","12.2383","0.0005","90","","110.912","0.005","90","","1737.84","0.13","110","","110","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H20 F8 Fe N5 O -","- C44 H20 F8 Fe N5 O -","- C88 H40 F16 Fe2 N10 O2 -","2","0.5","","Jun Wang; Mark P. Schopfer; Amy A. N. Sarjeant; Kenneth D. Karlin","Heme-Copper Assembly Mediated Reductive Coupling of Nitrogen Monoxide (.NO)","Journal of the American Chemical Society","2009","131","","450","451","10.1021/ja8084324","","","0.71073","MoKα","","0.0811","0.0542","","","0.1389","0.1548","","","","","","1.058","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103786","23.275","0.004","25.486","0.004","49.521","0.007","90","","117.409","0.006","90","","26078","7","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C106 H83 N8 O29 Zn4 -","- C106 H82 N8 O29 Zn4 -","- C424 H328 N32 O116 Zn16 -","4","1","","Andrew P. Nelson; Omar K. Farha; Karen L. Mulfort; Joseph T. Hupp","Supercritical Processing as a Route to High Internal Surface Areas and Permanent Microporosity in Metal-Organic Framework Materials","Journal of the American Chemical Society","2009","131","","458","460","10.1021/ja808853q","","","0.71073","MoKα","","0.2194","0.0692","","","0.1513","0.167","","","","","","0.563","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103787","16.6402","0.0003","16.6402","0.0003","7.7024","0.0001","90","","90","","120","","1847.03","0.05","277.2","","","","","","","","","","","2","R 3 c :H","R 3 -2""c","161","","","","- C21 H12 -","- C21 H12 -","- C126 H72 -","6","0.333333","","Toru Amaya; Shu Seki; Toshiyuki Moriuchi; Kana Nakamoto; Takuto Nakata; Hiroyuki Sakane; Akinori Saeki; Seiichi Tagawa; Toshikazu Hirao","Anisotropic Electron Transport Properties in Sumanene Crystal","Journal of the American Chemical Society","2009","131","","408","409","10.1021/ja805997v","","","1.5419","CuKα","","","0.0334","","","","0.0862","","","","","","0.788","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103788","10.0252","0.0003","18.003","0.0011","9.7974","0.0005","90","","115.066","0.003","90","","1601.74","0.14","150","1","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 O3 -","- C21 H16 O3 -","- C84 H64 O12 -","4","1","","Zengming Shen; Peter K. Dornan; Hasan A. Khan; Tom K. Woo; Vy M. Dong","Mechanistic Insights into the Rhodium-Catalyzed Intramolecular Ketone Hydroacylation","Journal of the American Chemical Society","2009","131","","1077","1091","10.1021/ja806758m","","","0.71073","MoKα","","0.0755","0.046","","","0.1055","0.1221","","","","","","1.042","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103789","6.0476","0.0005","15.2453","0.0012","20.0851","0.0017","90","","90","","90","","1851.8","0.3","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 Br O4 -","- C18 H27 Br O4 -","- C72 H108 Br4 O16 -","4","1","","Hun Young Kim; Luca Salvi; Patrick J. Carroll; Patrick J. Walsh","Highly Enantio- and Diastereoselective One-Pot Methods for the Synthesis of Halocyclopropyl Alcohols","Journal of the American Chemical Society","2009","131","","954","962","10.1021/ja806989n","","","0.71073","MoKα","","0.0401","0.0348","","","0.0711","0.0746","","","","","","1.081","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103790","6.06","0.003","22.39","0.006","40.762","0.012","90","","90","","90","","5531","4","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 Cl O4 -","- C18 H27 Cl O4 -","- C72 H108 Cl4 O16 -","4","1","","Hun Young Kim; Luca Salvi; Patrick J. Carroll; Patrick J. Walsh","Highly Enantio- and Diastereoselective One-Pot Methods for the Synthesis of Halocyclopropyl Alcohols","Journal of the American Chemical Society","2009","131","","954","962","10.1021/ja806989n","","","0.71073","MoKα","","0.0865","0.0581","","","0.1172","0.1374","","","","","","1.092","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103791","6.8584","0.0003","13.6465","0.0008","21.3782","0.0014","90","","90","","90","","2000.9","0.2","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H29 I O4 -","- C20 H29 I O4 -","- C80 H116 I4 O16 -","4","1","","Hun Young Kim; Luca Salvi; Patrick J. Carroll; Patrick J. Walsh","Highly Enantio- and Diastereoselective One-Pot Methods for the Synthesis of Halocyclopropyl Alcohols","Journal of the American Chemical Society","2009","131","","954","962","10.1021/ja806989n","","","0.71069","MoKα","","0.0278","0.026","","","0.0614","0.0625","","","","","","1.059","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103792","6.094","0.006","15.229","0.014","20.355","0.018","90","","90","","90","","1889","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 I O4 -","- C18 H27 I O4 -","- C72 H108 I4 O16 -","4","1","","Hun Young Kim; Luca Salvi; Patrick J. Carroll; Patrick J. Walsh","Highly Enantio- and Diastereoselective One-Pot Methods for the Synthesis of Halocyclopropyl Alcohols","Journal of the American Chemical Society","2009","131","","954","962","10.1021/ja806989n","","","0.71069","MoKα","","0.0243","0.0196","","","0.0288","0.0299","","","","","","0.744","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103793","7.2994","0.0018","12.819","0.003","13.121","0.003","77.774","0.015","89.559","0.016","77.542","0.018","1170.7","0.5","153","1","153","1","","","","","","","","4","P 1","P 1","1","","","","- C23 H29.5 Br0.5 O4 -","- C23 H29.5 Br0.5 O4 -","- C46 H59 Br O8 -","2","2","","Hun Young Kim; Luca Salvi; Patrick J. Carroll; Patrick J. Walsh","Highly Enantio- and Diastereoselective One-Pot Methods for the Synthesis of Halocyclopropyl Alcohols","Journal of the American Chemical Society","2009","131","","954","962","10.1021/ja806989n","","","0.71073","MoKα","","0.0787","0.0684","","","0.1784","0.1881","","","","","","0.999","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4103794","19.862","0.003","9.3987","0.0013","22.279","0.003","90","","90","","90","","4159","1","120","2","120","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H28 O4 -","- C24 H28 O4 -","- C192 H224 O32 -","8","1","","Andrew DeAngelis; Michael T. Taylor; Joseph M. Fox","Unusually Reactive and Selective Carbonyl Ylides for Three-Component Cycloaddition Reactions","Journal of the American Chemical Society","2009","131","","1101","1105","10.1021/ja807184r","","","0.71073","MoKα","","0.0722","0.0459","","","0.1143","0.1327","","","","","","1.056","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103795","11.765","0.004","15.839","0.005","22.419","0.007","90","","90","","90","","4178","2","120","2","120","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C24 H24 O6 -","- C24 H24 O6 -","- C192 H192 O48 -","8","1","","Andrew DeAngelis; Michael T. Taylor; Joseph M. Fox","Unusually Reactive and Selective Carbonyl Ylides for Three-Component Cycloaddition Reactions","Journal of the American Chemical Society","2009","131","","1101","1105","10.1021/ja807184r","","","0.71073","MoKα","","0.1157","0.0529","","","0.1128","0.1385","","","","","","1.008","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103796","8.523","0.005","10.054","0.006","16.299","0.009","72.654","0.008","80.74","0.008","70.202","0.008","1251.6","1.3","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H28 O7 -","- C28 H28 O7 -","- C56 H56 O14 -","2","1","","Andrew DeAngelis; Michael T. Taylor; Joseph M. Fox","Unusually Reactive and Selective Carbonyl Ylides for Three-Component Cycloaddition Reactions","Journal of the American Chemical Society","2009","131","","1101","1105","10.1021/ja807184r","","","0.71073","MoKα","","0.0505","0.043","","","0.1111","0.1197","","","","","","1.007","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103797","8.252","0.003","9.571","0.003","17.007","0.005","97.352","0.004","97.916","0.004","101.042","0.004","1289.2","0.7","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H29 N O6 -","- C31 H29 N O6 -","- C62 H58 N2 O12 -","2","1","","Andrew DeAngelis; Michael T. Taylor; Joseph M. Fox","Unusually Reactive and Selective Carbonyl Ylides for Three-Component Cycloaddition Reactions","Journal of the American Chemical Society","2009","131","","1101","1105","10.1021/ja807184r","","","0.71073","MoKα","","0.0635","0.0481","","","0.1083","0.1189","","","","","","1.007","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103798","29.658","0.002","21.8217","0.0011","29.9635","0.0015","90","","90","","90","","19392","1.9","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C104 H104 Li2 O2 P6 S6 U -","- C104 H104 Li2 O2 P6 S6 U -","- C832 H832 Li16 O16 P48 S48 U8 -","8","1","","Thibault Cantat; Thérèse Arliguie; Anne Noël; Pierre Thuéry; Michel Ephritikhine; Pascal Le Floch; Nicolas Mézailles","The U=C Double Bond: Synthesis and Study of Uranium Nucleophilic Carbene Complexes","Journal of the American Chemical Society","2009","131","","963","972","10.1021/ja807282s","","","0.71073","MoKα","","0.129","0.0889","","","0.2145","0.2266","","","","","","1.096","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103799","14.0685","0.0003","15.4706","0.0003","24.6002","0.0004","107.317","0.002","98.742","0.001","95.683","0.001","4992.72","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C99.5 H112 B6 P6 S6 U3 -","- C99.5 H108 B6 P6 S6 U3 -","- C199 H216 B12 P12 S12 U6 -","2","1","","Thibault Cantat; Thérèse Arliguie; Anne Noël; Pierre Thuéry; Michel Ephritikhine; Pascal Le Floch; Nicolas Mézailles","The U=C Double Bond: Synthesis and Study of Uranium Nucleophilic Carbene Complexes","Journal of the American Chemical Society","2009","131","","963","972","10.1021/ja807282s","","","0.71073","MoKα","","0.0525","0.0328","","","0.076","0.0812","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103800","14.6445","0.0005","13.368","0.0004","17.8089","0.0006","90","","92.438","0.002","90","","3483.3","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H44 B2 O2 P2 S2 U -","- C33 H44 B2 O2 P2 S2 U -","- C132 H176 B8 O8 P8 S8 U4 -","4","1","","Thibault Cantat; Thérèse Arliguie; Anne Noël; Pierre Thuéry; Michel Ephritikhine; Pascal Le Floch; Nicolas Mézailles","The U=C Double Bond: Synthesis and Study of Uranium Nucleophilic Carbene Complexes","Journal of the American Chemical Society","2009","131","","963","972","10.1021/ja807282s","","","0.71073","MoKα","","0.0324","0.0248","","","0.0558","0.0578","","","","","","1.048","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103801","16.2135","0.0003","22.3247","0.0004","21.3662","0.0006","90","","91.524","0.001","90","","7731","0.3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C83 H80 Li2 O2 P6 S6 U -","- C83 H80 Li2 O2 P6 S6 U -","- C332 H320 Li8 O8 P24 S24 U4 -","4","0.5","","Thibault Cantat; Thérèse Arliguie; Anne Noël; Pierre Thuéry; Michel Ephritikhine; Pascal Le Floch; Nicolas Mézailles","The U=C Double Bond: Synthesis and Study of Uranium Nucleophilic Carbene Complexes","Journal of the American Chemical Society","2009","131","","963","972","10.1021/ja807282s","","","0.71073","MoKα","","0.033","0.0266","","","0.0618","0.064","","","","","","1.029","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103802","11.6554","0.0004","13.5597","0.0005","15.5642","0.0005","103.382","0.002","97.274","0.002","95.948","0.002","2351.15","0.14","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H56 F9 N8 O13 S3 Tb -","- C30 H56 F9 N8 O13 S3 Tb -","- C60 H112 F18 N16 O26 S6 Tb2 -","2","1","","Matthew J. Belousoff; Phuc Ung; Craig M. Forsyth; Yitzhak Tor; Leone Spiccia; Bim Graham","New Macrocyclic Terbium(III) Complex for Use in RNA Footprinting Experiments","Journal of the American Chemical Society","2009","131","","1106","1114","10.1021/ja807301r","","","0.71073","MoKα","","0.0224","0.0205","","","0.0497","0.0506","","","","","","1.067","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103803","24.448","0.005","6.616","0.005","28.057","0.005","90","","109.246","0.005","90","","4285","3","100","2","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","calcium 5-azidotetrazolate pentahydrate","calcium 5-azidotetrazolate pentahydrate","","- C6 H32 Ca3 N42 O16 -","- C6 H32 Ca3 N42 O16 -","- C24 H128 Ca12 N168 O64 -","4","0.5","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.1036","0.0423","","","0.0763","0.0992","","","","","","0.96","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103804","10.8114","0.0005","7.4641","0.0004","7.6676","0.0004","90","","101.437","0.005","90","","606.47","0.05","100","2","200","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","hydrazinium 5-azidotetrazolate","hydrazinium 5-azidotetrazolate","","- C H5 N9 -","- C H5 N9 -","- C4 H20 N36 -","4","1","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.0477","0.0305","","","0.071","0.0767","","","","","","0.931","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103805","3.9103","0.0003","6.914","0.0004","9.9127","0.0006","90","","99.177","0.006","90","","264.57","0.03","200","2","200","","","","","","","","","3","P 1 21 1","P 2yb","4","ammonium 5-azidotetrazolate","ammonium 5-azidotetrazolate","","- C H4 N8 -","- C H4 N8 -","- C2 H8 N16 -","2","1","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.0731","0.0307","","","0.0516","0.0637","","","","","","0.907","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103806","9.7652","0.0008","9.7803","0.0009","10.0434","0.0009","71.327","0.008","74.399","0.007","63.962","0.009","807.15","0.14","200","2","200","","","","","","","","","3","P -1","-P 1","2","aminoguanidinium 5-azidotetrazolate","aminoguanidinium 5-azidotetrazolate","","- C2 H7 N11 -","- C2 H7 N11 -","- C8 H28 N44 -","4","2","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.106","0.045","","","0.0931","0.1154","","","","","","0.925","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103807","9.5374","0.0008","15.312","0.0009","10.5731","0.0006","90","","94.361","0.007","90","","1539.59","0.18","100","2","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","guanidinium 5-azidotetrazolate","guanidinium 5-azidotetrazolate","","- C2 H7 N10 O0.5 -","- C2 H7 N10 O0.5 -","- C16 H56 N80 O4 -","8","2","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.1619","0.049","","","0.0945","0.1288","","","","","","0.882","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103808","8.9207","0.0005","4.6663","0.0002","12.8648","0.0006","90","","95.608","0.005","90","","532.96","0.05","200","2","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","lithium 5-azidotetrazolate monohydrate","lithium 5-azidotetrazolate monohydrate","","- C H2 Li N7 O -","- C H2 Li N7 O -","- C4 H8 Li4 N28 O4 -","4","1","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.055","0.0313","","","0.0732","0.0869","","","","","","1.052","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103809","11.203","0.002","7.138","0.002","14.409","0.002","90","","91.63","0.01","90","","1151.8","0.4","200","2","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","sodium 5-azidotetrazolate monohydrate","sodium 5-azidotetrazolate monohydrate","","- C H2 N7 Na O -","- C H2 N7 Na O -","- C8 H16 N56 Na8 O8 -","8","2","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.1028","0.0313","","","0.0671","0.0798","","","","","","0.713","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103810","9.7759","0.0009","6.299","0.0006","8.4533","0.0006","90","","96.72","0.008","90","","516.96","0.08","100","2","200","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","potassium 5-azdotetrazolate","potassium 5-azidotetrazolate","","- C K N7 -","- C K N7 -","- C4 K4 N28 -","4","1","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.0452","0.0315","","","0.074","0.0763","","","","","","0.988","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103811","4.3082","0.0001","7.1345","0.0002","18.6869","0.0009","90","","90","","90","","574.38","0.03","200","2","200","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","cesium 5-azidotetrazolate","cesium 5-azidotetrazolate","","- C Cs N7 -","- C Cs N7 -","- C4 Cs4 N28 -","4","1","","Klapötke, Thomas M.; Stierstorfer, Jörg","The CN~7~^-^ anion","Journal of the American Chemical Society","2009","131","3","1122","1134","10.1021/ja8077522","","","0.71073","MoKα","","0.0275","0.0227","","","0.0394","0.0398","","","","","","0.918","","","","has coordinates","210875","2020-10-21","18:00:00",""
"4103812","17.775","0.002","10.7571","0.0012","18.0887","0.0019","90","","118.258","0.002","90","","3046.5","0.6","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H24 Cu I N4 -","- C10 H24 Cu I N4 -","- C80 H192 Cu8 I8 N32 -","8","2","","Sonja Herres-Pawlis; Pratik Verma; Roxana Haase; Peng Kang; Christopher T. Lyons; Erik C. Wasinger; Ulrich Flörke; Gerald Henkel; T. Daniel P. Stack","Phenolate Hydroxylation in a Bis(μ-oxo)dicopper(III) Complex: Lessons from the Guanidine/Amine Series","Journal of the American Chemical Society","2009","131","","1154","1169","10.1021/ja807809x","","","0.71073","MoKα","","0.0358","0.0283","","","0.0587","0.0612","","","","","","1.036","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4103813","19.4392","0.0012","11.2206","0.0007","15.288","0.0009","90","","93.181","0.001","90","","3329.5","0.4","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H50 Cu3 I3 N8 O2 -","- C20 H50 Cu3 I3 N8 O2 -","- C80 H200 Cu12 I12 N32 O8 -","4","0.5","","Sonja Herres-Pawlis; Pratik Verma; Roxana Haase; Peng Kang; Christopher T. Lyons; Erik C. Wasinger; Ulrich Flörke; Gerald Henkel; T. Daniel P. Stack","Phenolate Hydroxylation in a Bis(μ-oxo)dicopper(III) Complex: Lessons from the Guanidine/Amine Series","Journal of the American Chemical Society","2009","131","","1154","1169","10.1021/ja807809x","","","0.71073","MoKα","","0.0479","0.0381","","","0.0905","0.0941","","","","","","1.04","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103814","6.023","0.0002","10.9397","0.0002","6.5172","0.0001","90","","100.728","0.001","90","","421.912","0.017","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/m 1","-P 2yb","11","","","","- C9 H6 Cr O3 -","- C9 H6 Cr O3 -","- C18 H12 Cr2 O6 -","2","0.5","","Louis J. Farrugia; Cameron Evans; Dieter Lentz; Max Roemer","The QTAIM Approach to Chemical Bonding Between Transition Metals and Carbocyclic Rings: A Combined Experimental and Theoretical Study of (η5-C5H5)Mn(CO)3, (η6-C6H6)Cr(CO)3, and (E)-{(η5-C5H4)CF=CF(η5-C5H4)}(η5-C5H5)2Fe2","Journal of the American Chemical Society","2009","131","","1251","1268","10.1021/ja808303j","","x-ray","0.71073","MoKα","","0.011","0.0084","","","","0.01","","","","","","1.662","","","","has coordinates,has Fobs","178784","2020-10-21","18:00:00",""
"4103815","16.9812","0.0004","16.9812","0.0004","5.8607","0.0001","90","","90","","90","","1690","0.06","100","2","100","2","","","","","","","synthesis as described","4","P 42/n :2","-P 4bc","86","","","","- C22 H18 F2 Fe2 -","- C22 H18 F2 Fe2 -","- C88 H72 F8 Fe8 -","4","0.5","","Louis J. Farrugia; Cameron Evans; Dieter Lentz; Max Roemer","The QTAIM Approach to Chemical Bonding Between Transition Metals and Carbocyclic Rings: A Combined Experimental and Theoretical Study of (η5-C5H5)Mn(CO)3, (η6-C6H6)Cr(CO)3, and (E)-{(η5-C5H4)CF=CF(η5-C5H4)}(η5-C5H5)2Fe2","Journal of the American Chemical Society","2009","131","","1251","1268","10.1021/ja808303j","","x-ray","0.71073","MoKα","","0.0228","0.0178","","","","0.0226","","","","","","1.401","","","","has coordinates,has Fobs","264764","2021-05-03","08:11:05",""
"4103816","10.7573","0.0003","6.9348","0.0002","11.6614","0.0003","90","","115.764","0.001","90","","783.46","0.04","100","2","100","2","","","","","","","commercial purchase","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 Mn O3 -","- C8 H5 Mn O3 -","- C32 H20 Mn4 O12 -","4","1","","Louis J. Farrugia; Cameron Evans; Dieter Lentz; Max Roemer","The QTAIM Approach to Chemical Bonding Between Transition Metals and Carbocyclic Rings: A Combined Experimental and Theoretical Study of (η5-C5H5)Mn(CO)3, (η6-C6H6)Cr(CO)3, and (E)-{(η5-C5H4)CF=CF(η5-C5H4)}(η5-C5H5)2Fe2","Journal of the American Chemical Society","2009","131","","1251","1268","10.1021/ja808303j","","x-ray","0.71073","MoKα","","0.0248","0.016","","","","0.012","","","","","","1.429","","","","has coordinates,has Fobs","178784","2020-10-21","18:00:00",""
"4103817","10.304","0.012","8.153","0.006","10.332","0.012","90","","101.67","0.04","90","","850","1.5","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C38 H44 O6 -","2","1","","Ana Z. González; José G. Román; Eyleen Alicea; Eda Canales; John A. Soderquist","Borabicyclo[3.3.2]decanes and the Stereoselective Asymmetric Synthesis of 1,3-Diol Stereotriads from 1,3-Diborylpropenes","Journal of the American Chemical Society","2009","131","","1269","1273","10.1021/ja808360z","","","0.71073","MoKα","","0.0458","0.0418","","","0.1145","0.1178","","","","","","1.077","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103818","7.3698","0.0014","9.719","0.003","13.835","0.004","107.84","0.03","97.26","0.03","103.55","0.02","895.8","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H24 Cl N O2 -","- C19 H24 Cl N O2 -","- C38 H48 Cl2 N2 O4 -","2","1","","Ana Z. González; José G. Román; Eyleen Alicea; Eda Canales; John A. Soderquist","Borabicyclo[3.3.2]decanes and the Stereoselective Asymmetric Synthesis of 1,3-Diol Stereotriads from 1,3-Diborylpropenes","Journal of the American Chemical Society","2009","131","","1269","1273","10.1021/ja808360z","","","0.71073","MoKα","","0.0485","0.0414","","","0.1095","0.1153","","","","","","1.031","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103819","10.201","0.005","8.152","0.004","10.264","0.005","90","","101.769","0.008","90","","835.6","0.7","301","2","301","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C38 H44 O6 -","2","1","","Ana Z. González; José G. Román; Eyleen Alicea; Eda Canales; John A. Soderquist","Borabicyclo[3.3.2]decanes and the Stereoselective Asymmetric Synthesis of 1,3-Diol Stereotriads from 1,3-Diborylpropenes","Journal of the American Chemical Society","2009","131","","1269","1273","10.1021/ja808360z","","","0.71073","MoKα","","0.0669","0.0563","","","0.1516","0.16","","","","","","1.023","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103820","9.53","0.006","20.803","0.013","17.593","0.011","90","","90.3","0.07","90","","3488","4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 Br O2 -","- C18 H19 Br O2 -","- C144 H152 Br8 O16 -","8","2","","Ana Z. González; José G. Román; Eyleen Alicea; Eda Canales; John A. Soderquist","Borabicyclo[3.3.2]decanes and the Stereoselective Asymmetric Synthesis of 1,3-Diol Stereotriads from 1,3-Diborylpropenes","Journal of the American Chemical Society","2009","131","","1269","1273","10.1021/ja808360z","","","0.71073","MoKα","","0.1932","0.0701","","","0.2004","0.2578","","","","","","0.922","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103821","21.1763","0.0014","21.1763","0.0014","12.835","0.001","90","","90","","90","","5755.7","0.7","173","2","173","2","","","","","","","","6","I -4","I -4","82","","","","- C29 H29 B Mo N7 O6 -","- C29 H29 B Mo N7 O6 -","- C232 H232 B8 Mo8 N56 O48 -","8","1","","Thomas C. Coombs; Yongqiang Zhang; Ethel C. Garnier-Amblard; Lanny S. Liebeskind","Organometallic Enantiomeric Scaffolding. Sequential Semipinacol/1,5-""Michael-like"" Reactions as a Strategic Approach to Bridgehead-Quaternary Center Aza[3.3.1]Bicyclics: Application to the Total Synthesis of (-)-Adaline","Journal of the American Chemical Society","2009","131","","876","877","10.1021/ja808533z","","","0.71073","MoKα","","0.0492","0.0413","","","0.0801","0.0814","","","","","","1.008","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103822","10.4754","0.0002","12.8534","0.0002","13.4732","0.0003","104.527","0.001","112.404","0.001","103.191","0.001","1513.56","0.06","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H33 B Mo N7 O6 -","- C29 H33 B Mo N7 O6 -","- C58 H66 B2 Mo2 N14 O12 -","2","1","","Thomas C. Coombs; Yongqiang Zhang; Ethel C. Garnier-Amblard; Lanny S. Liebeskind","Organometallic Enantiomeric Scaffolding. Sequential Semipinacol/1,5-""Michael-like"" Reactions as a Strategic Approach to Bridgehead-Quaternary Center Aza[3.3.1]Bicyclics: Application to the Total Synthesis of (-)-Adaline","Journal of the American Chemical Society","2009","131","","876","877","10.1021/ja808533z","","","1.54178","CuKα","","0.0385","0.0379","","","0.1112","0.1118","","","","","","1.062","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103823","21.8377","0.0008","15.3687","0.0006","18.347","0.0007","90","","114.664","0.001","90","","5595.8","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,6-disipropylimido)(tris(trimetylphosphine))(hydrido)molybdenum chloride","","- C21 H45 Cl Mo N P3 -","- C21 H45 Cl Mo N P3 -","- C168 H360 Cl8 Mo8 N8 P24 -","8","2","","Erik Peterson; Andrey Y. Khalimon; Razvan Simionescu; Lyudmila G. Kuzmina; Judith A. K. Howard; Georgii I. Nikonov","Diversity of Catalysis by an Imido-Hydrido Complex of Molybdenum. Mechanism of Carbonyl Hydrosilylation and Silane Alcoholysis","Journal of the American Chemical Society","2009","131","","908","909","10.1021/ja8085388","","","0.71073","MoKα","","0.0758","0.0456","","","0.1023","0.1133","","","","","","1.02","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103824","13.396","0.002","14.841","0.003","24.848","0.004","87.145","0.003","85.91","0.004","66.989","0.003","4534.1","1.4","15","2","15","2","","","","","","","","8","P -1","-P 1","2","","","","- C93.64 H89.29 Cl3.29 Cu2 F12 N10 O15 P2 -","- C93.647 H89.294 Cl3.294 Cu2 F12 N10 O15 P2 -","- C187.294 H178.588 Cl6.588 Cu4 F24 N20 O30 P4 -","2","1","","Kristy A. McNitt; Kumar Parimal; Andrew I. Share; Albert C. Fahrenbach; Edward H. Witlicki; Maren Pink; D. Kwabena Bediako; Christina L. Plaisier; Nga Le; Lee P. Heeringa; Douglas A. Vander Griend; Amar H. Flood","Reduction of a Redox-Active Ligand Drives Switching in a Cu(I) Pseudorotaxane by a Bimolecular Mechanism","Journal of the American Chemical Society","2009","131","","1305","1313","10.1021/ja8085593","","","0.41328","synchrotron","","0.1312","0.0934","","","0.2371","0.2708","","","","","","1.047","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4103825","11.0618","0.0018","5.9755","0.001","6.3873","0.0011","90","","90","","90","","422.2","0.12","149","2","149","2","","","","","","","","2","P m m n :2","-P 2ab 2a","59","","","","- Br3 Tc -","- Br3 Tc -","- Br12 Tc4 -","4","0.5","","Frederic Poineau; Efrain E. Rodriguez; Paul M. Forster; Alfred P. Sattelberger; Anthony K. Cheetham; Kenneth R. Czerwinski","Preparation of the Binary Technetium Bromides: TcBr3 and TcBr4","Journal of the American Chemical Society","2009","131","","910","911","10.1021/ja808597r","","","0.71073","MoKα","","0.0777","0.062","","","0.1799","0.1887","","","","","","1.028","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103826","6.3237","0.0005","12.1777","0.0009","14.7397","0.0011","90","","90","","90","","1135.08","0.15","157","2","157","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- Br4 Tc -","- Br4 Tc -","- Br32 Tc8 -","8","1","","Frederic Poineau; Efrain E. Rodriguez; Paul M. Forster; Alfred P. Sattelberger; Anthony K. Cheetham; Kenneth R. Czerwinski","Preparation of the Binary Technetium Bromides: TcBr3 and TcBr4","Journal of the American Chemical Society","2009","131","","910","911","10.1021/ja808597r","","","0.71073","MoKα","","0.0306","0.0216","","","0.0441","0.0466","","","","","","1.071","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103827","8.7449","0.0012","11.7058","0.0016","14.97","0.002","98.446","0.002","96.896","0.002","109.595","0.003","1404.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H42 Ge N2 O2 -","- C30 H42 Ge N2 O2 -","- C60 H84 Ge2 N4 O4 -","2","1","","Anukul Jana; Debajyoti Ghoshal; Herbert W. Roesky; Ina Objartel; Gerald Schwab; Dietmar Stalke","A Germanium(II) Hydride as an Effective Reagent for Hydrogermylation Reactions","Journal of the American Chemical Society","2009","131","","1288","1293","10.1021/ja808656t","","","0.71073","MoKα","","0.0354","0.0342","","","0.087","0.0876","","","","","","1.136","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103828","11.9917","0.0019","20.4171","0.0032","13.7973","0.0022","90","","106.896","0.003","90","","3232.3","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H48 Ge N2 O2 -","- C34 H48 Ge N2 O2 -","- C136 H192 Ge4 N8 O8 -","4","1","","Anukul Jana; Debajyoti Ghoshal; Herbert W. Roesky; Ina Objartel; Gerald Schwab; Dietmar Stalke","A Germanium(II) Hydride as an Effective Reagent for Hydrogermylation Reactions","Journal of the American Chemical Society","2009","131","","1288","1293","10.1021/ja808656t","","","0.71073","MoKα","","0.0535","0.0401","","","0.1042","0.1094","","","","","","1.068","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103829","12.0106","0.0019","15.01","0.002","19.635","0.003","90","","103.98","0.002","90","","3434.9","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H48 Ge N2 O4 -","- C35 H48 Ge N2 O4 -","- C140 H192 Ge4 N8 O16 -","4","1","","Anukul Jana; Debajyoti Ghoshal; Herbert W. Roesky; Ina Objartel; Gerald Schwab; Dietmar Stalke","A Germanium(II) Hydride as an Effective Reagent for Hydrogermylation Reactions","Journal of the American Chemical Society","2009","131","","1288","1293","10.1021/ja808656t","","","0.71073","MoKα","","0.0306","0.0264","","","0.0649","0.0668","","","","","","1.023","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103830","11.5788","0.0019","17.559","0.003","19.778","0.003","90","","103.221","0.002","90","","3914.5","1.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H60 Ge N2 O4 -","- C41 H60 Ge N2 O4 -","- C164 H240 Ge4 N8 O16 -","4","1","","Anukul Jana; Debajyoti Ghoshal; Herbert W. Roesky; Ina Objartel; Gerald Schwab; Dietmar Stalke","A Germanium(II) Hydride as an Effective Reagent for Hydrogermylation Reactions","Journal of the American Chemical Society","2009","131","","1288","1293","10.1021/ja808656t","","","0.71073","MoKα","","0.0339","0.0279","","","0.0666","0.0689","","","","","","1.047","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103831","12.7426","0.001","15.655","0.0012","18.0931","0.0014","90","","106.335","0.001","90","","3463.6","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","AJ-12","","","- C36 H50 Ge N2 S2 -","- C36 H50 Ge N2 S2 -","- C144 H200 Ge4 N8 S8 -","4","1","","Anukul Jana; Debajyoti Ghoshal; Herbert W. Roesky; Ina Objartel; Gerald Schwab; Dietmar Stalke","A Germanium(II) Hydride as an Effective Reagent for Hydrogermylation Reactions","Journal of the American Chemical Society","2009","131","","1288","1293","10.1021/ja808656t","","","0.71073","MoKα","","0.0274","0.0236","","","0.0611","0.0634","","","","","","1.045","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103832","11.035","0.002","10.918","0.002","25.983","0.005","90","","90","","90","","3130.4","1","301","2","301","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H36 N4 S4 -","- C32 H36 N4 S4 -","- C128 H144 N16 S16 -","4","0.5","","Vivian Wing-Wah Yam; Jason Ka-Wai Lee; Chi-Chiu Ko; Nianyong Zhu","Photochromic Diarylethene-Containing Ionic Liquids and N-Heterocyclic Carbenes","Journal of the American Chemical Society","2009","131","","912","913","10.1021/ja808791e","","","0.71073","MoKα","","0.0868","0.0397","","","0.0856","0.0973","","","","","","0.883","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103833","9.006","0.0018","20.473","0.004","11.705","0.002","90","","109.54","0.03","90","","2033.9","0.8","301","2","301","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H21 F6 N2 P S2 -","- C17 H21 F6 N2 P S2 -","- C68 H84 F24 N8 P4 S8 -","4","1","","Vivian Wing-Wah Yam; Jason Ka-Wai Lee; Chi-Chiu Ko; Nianyong Zhu","Photochromic Diarylethene-Containing Ionic Liquids and N-Heterocyclic Carbenes","Journal of the American Chemical Society","2009","131","","912","913","10.1021/ja808791e","","","0.71073","MoKα","","0.0653","0.0397","","","0.1049","0.1118","","","","","","1.049","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103834","8.222","0.003","8.984","0.003","17.071","0.005","85.15","0.03","82.8","0.03","65.11","0.03","1134.1","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H22 Ag Cl3 N2 S2 -","- C18 H22 Ag Cl3 N2 S2 -","- C36 H44 Ag2 Cl6 N4 S4 -","2","1","","Vivian Wing-Wah Yam; Jason Ka-Wai Lee; Chi-Chiu Ko; Nianyong Zhu","Photochromic Diarylethene-Containing Ionic Liquids and N-Heterocyclic Carbenes","Journal of the American Chemical Society","2009","131","","912","913","10.1021/ja808791e","","","0.71073","MoKα","","0.0535","0.0388","","","0.1003","0.1088","","","","","","1.022","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103835","17.141","0.003","7.93","0.0016","14.179","0.003","90","","96.23","0.03","90","","1915.9","0.7","301","2","301","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 Au Cl N2 S2 -","- C17 H20 Au Cl N2 S2 -","- C68 H80 Au4 Cl4 N8 S8 -","4","1","","Vivian Wing-Wah Yam; Jason Ka-Wai Lee; Chi-Chiu Ko; Nianyong Zhu","Photochromic Diarylethene-Containing Ionic Liquids and N-Heterocyclic Carbenes","Journal of the American Chemical Society","2009","131","","912","913","10.1021/ja808791e","","","0.71073","MoKα","","0.046","0.0412","","","0.1135","0.1254","","","","","","1.082","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103836","7.951","0.0016","11.154","0.002","11.492","0.002","103.03","0.03","91.32","0.03","103.46","0.03","962.6","0.4","263","2","263","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H40 I2 N4 Pd S4 -","- C34 H40 I2 N4 Pd S4 -","- C34 H40 I2 N4 Pd S4 -","1","0.5","","Vivian Wing-Wah Yam; Jason Ka-Wai Lee; Chi-Chiu Ko; Nianyong Zhu","Photochromic Diarylethene-Containing Ionic Liquids and N-Heterocyclic Carbenes","Journal of the American Chemical Society","2009","131","","912","913","10.1021/ja808791e","","","0.71073","MoKα","","0.0399","0.0334","","","0.0942","0.0958","","","","","","0.998","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103837","11.746","0.0005","13.361","0.0003","41.32","0.0013","90","","106.1","0.002","90","","6230.4","0.4","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cp2WSi4(SiMetBu2)","","- C52 H108 Si8 W -","- C52 H108 Si8 W -","- C208 H432 Si32 W4 -","4","1","","Kazunori Takanashi; Vladimir Ya. Lee; Taka Yokoyama; Akira Sekiguchi","Base-Free Molybdenum and Tungsten Bicyclic Silylene Complexes Stabilized by a Homoaromatic Contribution","Journal of the American Chemical Society","2009","131","","916","917","10.1021/ja8088313","","","0.7107","MoKα","","0.0786","0.0552","","","0.13","0.1425","","","","","","1.038","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103838","44.661","0.005","13.57","0.005","29.304","0.005","90","0.005","114.204","0.005","90","0.005","16198","7","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C130 H144 F36 N16 O36 P4 Pd2 S4 -","- C130 H144 F36 N16 O36 P4 Pd2 S4 -","- C520 H576 F144 N64 O144 P16 Pd8 S16 -","4","0.5","","Carlos Peinador; Víctor Blanco; José M. Quintela","A New Doubly Interlocked [2]Catenane","Journal of the American Chemical Society","2009","131","","920","921","10.1021/ja8088372","","","0.71073","MoKα","","0.2033","0.1182","","","0.3223","0.391","","","","","","1.281","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103839","8.999","","18.435","","34.463","","90","","90","","90","","5717.29","","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H27 N5 O3 Os -","- C30 H23 N5 O3 Os -","- C240 H184 N40 O24 Os8 -","8","1","","Subhas Samanta; Sreebrata Goswami","Regioselective Knitting of Anilinevia ortho-C-N Bond Fusion Using OsO4 as a Template","Journal of the American Chemical Society","2009","131","","924","925","10.1021/ja808901s","","","0.71073","MoKα","","0.1509","0.0874","","","0.1607","0.1832","","","","","","1.125","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4103840","26.657","0.005","9.5372","0.0017","16.013","0.003","90","","106.516","0.003","90","","3903.1","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C192 H144 N32 O8 Os8 -","- C192 H144 N32 O8 Os8 -","- C192 H144 N32 O8 Os8 -","1","0.25","","Subhas Samanta; Sreebrata Goswami","Regioselective Knitting of Anilinevia ortho-C-N Bond Fusion Using OsO4 as a Template","Journal of the American Chemical Society","2009","131","","924","925","10.1021/ja808901s","","","0.71073","MoKα","","0.0774","0.0543","","","0.1045","0.114","","","","","","1.172","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4103841","10.4293","0.0008","12.5452","0.0009","13.8588","0.0016","109.115","0.002","101.802","0.002","110.145","0.001","1502","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H26 N6 Os -","- C36 H26 N6 Os -","- C72 H52 N12 Os2 -","2","1","","Subhas Samanta; Sreebrata Goswami","Regioselective Knitting of Anilinevia ortho-C-N Bond Fusion Using OsO4 as a Template","Journal of the American Chemical Society","2009","131","","924","925","10.1021/ja808901s","","","0.71073","MoKα","","0.0231","0.021","","","0.0539","0.0546","","","","","","1.075","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103842","17.4203","0.0012","11.1311","0.0007","15.0886","0.0009","90","","110.124","0.004","90","","2747.2","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H26 N6 Os -","- C36 H26 N6 Os -","- C144 H104 N24 Os4 -","4","1","","Subhas Samanta; Sreebrata Goswami","Regioselective Knitting of Anilinevia ortho-C-N Bond Fusion Using OsO4 as a Template","Journal of the American Chemical Society","2009","131","","924","925","10.1021/ja808901s","","","0.71073","MoKα","","0.0717","0.0426","","","0.0844","0.0917","","","","","","1.093","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103843","16.308","0.003","7.9739","0.0014","17.077","0.004","90","","109.33","0.004","90","","2095.5","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 F2 N2 Pd -","- C10 H10 F2 N2 Pd -","- C80 H80 F16 N16 Pd8 -","8","2","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.1023","0.056","","","0.1018","0.1243","","","","","","0.975","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103844","21.979","0.003","9.4601","0.001","15.5953","0.0017","90","","120.946","0.002","90","","2781","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H15 F N2 Pd -","- C16 H15 F N2 Pd -","- C128 H120 F8 N16 Pd8 -","8","1","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.0432","0.0322","","","0.0754","0.0811","","","","","","1.059","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103845","17.553","0.01","10.013","0.006","9.524","0.005","90","","118.781","0.013","90","","1467.1","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H15 F N2 Pd -","- C16 H15 F N2 Pd -","- C64 H60 F4 N8 Pd4 -","4","0.5","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.0708","0.0513","","","0.1103","0.1182","","","","","","1.044","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103846","8.71","0.003","14.865","0.005","5.3681","0.0018","90","","100.127","0.005","90","","684.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C10 H10 I2 N2 Pd -","- C10 H10 I2 N2 Pd -","- C20 H20 I4 N4 Pd2 -","2","0.25","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.0477","0.0389","","","0.1006","0.1067","","","","","","1.105","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103847","17.039","0.008","4.993","0.002","17.697","0.008","90","","115.202","0.006","90","","1362.3","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 I2 N2 Pd -","- C10 H10 I2 N2 Pd -","- C40 H40 I8 N8 Pd4 -","4","0.5","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.0561","0.0417","","","0.0975","0.1042","","","","","","1.059","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103848","13.777","0.003","8.0323","0.0017","16.268","0.003","90","","90","","90","","1800.2","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H26 F2 N2 Pd -","- C18 H26 F2 N2 Pd -","- C72 H104 F8 N8 Pd4 -","4","1","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.1114","0.108","","","0.0599","0.0622","","","","","","0.868","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103849","16.821","0.014","12.063","0.01","11.799","0.009","90","","108.507","0.012","90","","2270","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H31 F N2 Pd -","- C24 H31 F N2 Pd -","- C96 H124 F4 N8 Pd4 -","4","1","","Vladimir V. Grushin; William J. Marshall","trans-Difluoro Complexes of Palladium(II)","Journal of the American Chemical Society","2009","131","","918","919","10.1021/ja808975a","","","0.71073","MoKα","","0.0332","0.0258","","","0.0597","0.0635","","","","","","1.041","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103850","9.982","0.0003","17.5147","0.0006","24.8092","0.0008","99.753","0.002","92.355","0.002","103.755","0.002","4137.1","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C42.5 H46 Cl6 Sb -","- C42.5 H46 Cl6 Sb -","- C170 H184 Cl24 Sb4 -","4","2","","Moloy Banerjee; Ruchi Shukla; Rajendra Rathore","Synthesis, Optical, and Electronic Properties of Soluble Poly-p-phenylene Oligomers as Models for Molecular Wires","Journal of the American Chemical Society","2009","131","","1780","1786","10.1021/ja805102d","","","1.54178","CuKα","","0.0308","0.0261","","","0.0648","0.0669","","","","","","1.013","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4103851","11.7185","0.0002","11.7394","0.0002","34.3511","0.0005","90","","92.989","0.001","90","","4719.19","0.13","100","2","100","2","","","","","","","","2","C 1 c 1","C -2yc","9","","","","- C32 H34 -","- C32 H34 -","- C256 H272 -","8","2","","Moloy Banerjee; Ruchi Shukla; Rajendra Rathore","Synthesis, Optical, and Electronic Properties of Soluble Poly-p-phenylene Oligomers as Models for Molecular Wires","Journal of the American Chemical Society","2009","131","","1780","1786","10.1021/ja805102d","","","1.54178","CuKα","","0.0317","0.0313","","","0.0853","0.0858","","","","","","1.011","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103852","13.5549","0.0002","15.6338","0.0003","18.5732","0.0003","90","","90","","90","","3935.93","0.11","153","2","153","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H19 Al N2 O4 -","- C23 H19 Al N2 O4 -","- C184 H152 Al8 N16 O32 -","8","1","","Victor A. Montes; Grigory V. Zyryanov; Evgeny Danilov; Neeraj Agarwal; Manuel A. Palacios; Pavel Anzenbacher","Ultrafast Energy Transfer in Oligofluorene-Aluminum Bis(8-hydroxyquinoline)acetylacetone Coordination Polymers","Journal of the American Chemical Society","2009","131","","1787","1795","10.1021/ja805175w","","","0.71073","MoKα","","0.0942","0.0539","","","0.0927","0.1032","","","","","","1.121","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103853","8.6445","0.0009","10.622","0.0011","26.384","0.003","90","","97.951","0.002","90","","2399.3","0.4","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 O8 -","- C28 H28 O8 -","- C112 H112 O32 -","4","1","","Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos","Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block","Journal of the American Chemical Society","2009","131","","1753","1765","10.1021/ja806183r","","","0.71073","MoKα","","0.1101","0.0661","","","0.1696","0.1994","","","","","","1.041","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103854","8.8332","0.0004","9.7719","0.0004","16.816","0.0007","101.213","0.001","90.461","0.001","107.48","","1354.62","0.1","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H29 Cl3 O7 -","- C28 H29 Cl3 O7 -","- C56 H58 Cl6 O14 -","2","1","","Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos","Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block","Journal of the American Chemical Society","2009","131","","1753","1765","10.1021/ja806183r","","","0.71073","MoKα","","0.062","0.041","","","0.1032","0.1144","","","","","","1.021","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103855","12.7907","0.001","15.3447","0.0012","12.2082","0.001","90","","107.131","0.001","90","","2289.8","0.3","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 O7 -","- C27 H28 O7 -","- C108 H112 O28 -","4","1","","Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos","Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block","Journal of the American Chemical Society","2009","131","","1753","1765","10.1021/ja806183r","","","0.71073","MoKα","","0.1016","0.0648","","","0.1839","0.2112","","","","","","1.076","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103856","15.983","0.004","8.71","0.002","23.384","0.005","90","","109.854","0.003","90","","3061.8","1.2","125","2","125","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H29 Cl6 O6 -","- C27 H27 O6 -","- C108 H108 O24 -","4","1","","Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos","Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block","Journal of the American Chemical Society","2009","131","","1753","1765","10.1021/ja806183r","","","0.71073","MoKα","","0.2107","0.1105","","","0.2835","0.3169","","","","","","1.017","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103857","8.6151","0.0012","22.939","0.003","11.7749","0.0016","90","","101.057","0.002","90","","2283.8","0.5","170","2","170","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C27 H28 O6 -","- C27 H28 O6 -","- C108 H112 O24 -","4","1","","Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos","Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block","Journal of the American Chemical Society","2009","131","","1753","1765","10.1021/ja806183r","","","0.71073","MoKα","","0.1577","0.0716","","","0.1735","0.2148","","","","","","1.032","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103858","12.4139","0.0004","5.3288","0.0002","17.1999","0.0006","90","","106.471","0.001","90","","1091.1","0.07","125","2","125","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H26 O6 -","- C26 H26 O6 -","- C52 H52 O12 -","2","1","","Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos","Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block","Journal of the American Chemical Society","2009","131","","1753","1765","10.1021/ja806183r","","","0.71073","MoKα","","0.051","0.0416","","","0.1042","0.1099","","","","","","1.029","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103859","15.104","0.0002","14.136","0.0002","16.745","0.0003","90","","99.633","0.001","90","","3524.82","0.09","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C40 H42 F N2 O P Ru -","- C40 H42 F N2 O P Ru -","- C160 H168 F4 N8 O4 P4 Ru4 -","4","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0443","0.0318","","","0.0729","0.0787","","","","","","1.071","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103860","13.731","0.0001","13.606","0.0001","21.764","0.0003","90","","105.746","0.004","90","","3913.46","0.1","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C44 H48 F N2 O2 P Ru -","- C44 H48 F N2 O2 P Ru -","- C176 H192 F4 N8 O8 P4 Ru4 -","4","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0646","0.0396","","","0.0945","0.1059","","","","","","1.054","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103861","11.305","0.0002","11.897","0.0003","20.774","0.0006","96.212","0.001","96.477","0.001","118","0.002","2409.5","0.11","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H58 N2 O P2 Ru -","- C58 H58 N2 O P2 Ru -","- C116 H116 N4 O2 P4 Ru2 -","2","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.067","0.0504","","","0.11","0.1168","","","","","","1.146","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103862","11.753","0.0001","12.48","0.0001","39.072","0.0004","90","","90","","90","","5730.98","0.09","150","2","150","2","","","","","","","","6","P 21 c n","P -2n 2a","33","","","","- C68 H78 N2 O2 P2 Ru -","- C68 H78 N2 O2 P2 Ru -","- C272 H312 N8 O8 P8 Ru4 -","4","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0778","0.0472","","","0.0757","0.0843","","","","","","1.048","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103863","11.601","0.0001","12.606","0.0002","39.35","0.0006","90","","90","","90","","5754.63","0.14","150","2","150","2","","","","","","","","6","P 21 c n","P -2n 2a","33","","","","- C68 H76 N2 O2 P2 Ru -","- C68 H76 N2 O2 P2 Ru -","- C272 H304 N8 O8 P8 Ru4 -","4","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.073","0.047","","","0.0792","0.0874","","","","","","1.062","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103864","44.345","0.0005","13.664","0.0001","13.479","0.0001","90","","93.837","0.001","90","","8149.02","0.13","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C47 H48 F N2 O2 P Ru -","- C47 H48 F N2 O2 P Ru -","- C376 H384 F8 N16 O16 P8 Ru8 -","8","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0492","0.034","","","0.0753","0.0822","","","","","","1.023","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103865","14.79","0.0002","17.245","0.0002","18.349","0.0003","90","","103.615","0.001","90","","4548.47","0.11","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H61 F N2 O2 P Ru -","- C50 H54 F N2 O2 P Ru -","- C200 H216 F4 N8 O8 P4 Ru4 -","4","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0625","0.0403","","","0.0847","0.0935","","","","","","1.038","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103866","10.745","0.0001","31.766","0.0003","12.5","0.0001","90","","90","","90","","4266.57","0.07","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C47 H54 F N2 O3 P Ru -","- C47 H52 F N2 O3 P Ru -","- C188 H208 F4 N8 O12 P4 Ru4 -","4","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0523","0.045","","","0.0978","0.1012","","","","","","1.076","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103867","44.334","0.0005","13.712","0.0002","13.372","0.0002","90","","93.96","0.001","90","","8109.54","0.19","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C47 H46 F N2 O2 P Ru -","- C47 H46 F N2 O2 P Ru -","- C376 H368 F8 N16 O16 P8 Ru8 -","8","1","","Steven P. Reade; Mary F. Mahon; Michael K. Whittlesey","Catalytic Hydrodefluorination of Aromatic Fluorocarbons by Ruthenium N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2009","131","","1847","1861","10.1021/ja806545e","","","0.71073","MoKα","","0.0658","0.0391","","","0.0797","0.0906","","","","","","1.043","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103868","30.622","0.004","12.7487","0.0017","26.301","0.004","90","","102.477","0.002","90","","10025","2","170","2","170","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46.5 H53 Cl5 O16 -","- C44 H48 O16 -","- C352 H384 O128 -","8","1","","Scott A. Snyder; Ferenc Kontes","Explorations into Neolignan Biosynthesis: Concise Total Syntheses of Helicterin B, Helisorin, and Helisterculin A from a Common Intermediate","Journal of the American Chemical Society","2009","131","","1745","1752","10.1021/ja806865u","","","0.71073","MoKα","","0.1428","0.0712","","","0.1694","0.1922","","","","","","1.009","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4103869","10.4583","0.0012","10.8459","0.0012","11.8553","0.0013","65.243","0.002","65.777","0.002","81.552","0.002","1113.1","0.2","125","2","125","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H28 O9 -","- C24 H28 O9 -","- C48 H56 O18 -","2","1","","Scott A. Snyder; Ferenc Kontes","Explorations into Neolignan Biosynthesis: Concise Total Syntheses of Helicterin B, Helisorin, and Helisterculin A from a Common Intermediate","Journal of the American Chemical Society","2009","131","","1745","1752","10.1021/ja806865u","","","0.71073","MoKα","","0.0639","0.0492","","","0.1681","0.1897","","","","","","1.051","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103870","8.224","0.002","10.543","0.003","12.41","0.003","70.152","0.004","81.717","0.004","81.656","0.004","996.2","0.4","125","2","125","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H25 O8 -","- C22 H25 O8 -","- C44 H50 O16 -","2","1","","Scott A. Snyder; Ferenc Kontes","Explorations into Neolignan Biosynthesis: Concise Total Syntheses of Helicterin B, Helisorin, and Helisterculin A from a Common Intermediate","Journal of the American Chemical Society","2009","131","","1745","1752","10.1021/ja806865u","","","0.71073","MoKα","","0.1891","0.0641","","","0.1234","0.1585","","","","","","1.01","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103871","12.2083","0.0008","14.8043","0.001","14.8729","0.001","86.302","0.001","69.538","0.001","89.653","0.001","2512.8","0.3","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H58 Cl4 O17 -","- C48 H56 Cl4 O17 -","- C96 H112 Cl8 O34 -","2","1","","Scott A. Snyder; Ferenc Kontes","Explorations into Neolignan Biosynthesis: Concise Total Syntheses of Helicterin B, Helisorin, and Helisterculin A from a Common Intermediate","Journal of the American Chemical Society","2009","131","","1745","1752","10.1021/ja806865u","","","0.71073","MoKα","","0.1339","0.0744","","","0.21","0.2483","","","","","","1.035","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103872","9.6319","0.0014","10.0782","0.0015","11.4236","0.0017","95.203","0.002","109.962","0.002","105.838","0.002","981.8","0.3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 O8 -","- C22 H22 O8 -","- C44 H44 O16 -","2","1","","Scott A. Snyder; Ferenc Kontes","Explorations into Neolignan Biosynthesis: Concise Total Syntheses of Helicterin B, Helisorin, and Helisterculin A from a Common Intermediate","Journal of the American Chemical Society","2009","131","","1745","1752","10.1021/ja806865u","","","0.71073","MoKα","","0.1394","0.0573","","","0.1105","0.135","","","","","","1.014","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103873","10.88","0.003","17.907","0.004","19.794","0.005","84.234","0.002","79.86","0.003","73.623","0.003","3636.9","1.6","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C78 H82 B3 N7 O16 -","- C78 H82 B3 N7 O16 -","- C156 H164 B6 N14 O32 -","2","1","","Hiroshi Danjo; Kadzuya Hirata; Seiki Yoshigai; Isao Azumaya; Kentaro Yamaguchi","Back to Back Twin Bowls of D3-Symmetric Tris(spiroborate)s for Supramolecular Chain Structures","Journal of the American Chemical Society","2009","131","","1638","1639","10.1021/ja8071435","","","0.71073","MoKα","","0.1371","0.111","","","0.3551","0.3826","","","","","","1.534","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103874","21.698","0.014","22.607","0.014","27.01","0.008","67.78","0.08","73.26","0.09","68.21","0.08","11220","13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C252 H256 B6 Ir2 N20 O41 -","- C251.94 H255.88 B6 Ir2 N20 O41 -","- C503.88 H511.76 B12 Ir4 N40 O82 -","2","1","","Hiroshi Danjo; Kadzuya Hirata; Seiki Yoshigai; Isao Azumaya; Kentaro Yamaguchi","Back to Back Twin Bowls of D3-Symmetric Tris(spiroborate)s for Supramolecular Chain Structures","Journal of the American Chemical Society","2009","131","","1638","1639","10.1021/ja8071435","","","0.7","synchrotron","","0.1673","0.1421","","","0.3512","0.3921","","","","","","1.258","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103875","7.0932","0.0003","11.9357","0.0005","20.7406","0.0009","98.387","0.004","98.331","0.004","93.949","0.004","1711.56","0.13","110","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H20 F6 N6 O2 S2 -","- C42 H20 F6 N6 O2 S2 -","- C84 H40 F12 N12 O4 S4 -","2","1","","Taegweon Lee; Chad A. Landis; Bal Mukund Dhar; Byung Jun Jung; Jia Sun; Amy Sarjeant; Ho-Jin Lee; Howard E. Katz","Synthesis, Structural Characterization, and Unusual Field-Effect Behavior of Organic Transistor Semiconductor Oligomers: Inferiority of Oxadiazole Compared with Other Electron-Withdrawing Subunits","Journal of the American Chemical Society","2009","131","","1692","1705","10.1021/ja807219x","","","0.71073","MoKα","","0.1777","0.0846","","","0.1388","0.1757","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103876","26.3044","0.0008","26.3044","0.0008","26.3044","0.0008","90","","90","","90","","18200.6","1","296","2","293","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C76 H36 Cu12 N O112 Si W12 -","- C76 H36.24 Cu12 N O112 Si W12 -","- C304 H144.96 Cu48 N4 O448 Si4 W48 -","4","0.0208333","","Chun-Yan Sun; Shu-Xia Liu; Da-Dong Liang; Kui-Zhan Shao; Yuan-Hang Ren; Zhong-Min Su","Highly Stable Crystalline Catalysts Based on a Microporous Metal-Organic Framework and Polyoxometalates","Journal of the American Chemical Society","2009","131","","1883","1888","10.1021/ja807357r","","","0.71073","MoKα","","0.0434","0.0313","","","0.0965","0.1005","","","","","","1.089","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103877","26.3189","0.0012","26.318","0.012","26.318","0.012","90","","90","","90","","18229","12","296","2","293","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C76 H36 Cu12 Ge N O112 W12 -","- C76 H35.52 Cu12 Ge N O112 W12 -","- C304 H142.08 Cu48 Ge4 N4 O448 W48 -","4","0.0208333","","Chun-Yan Sun; Shu-Xia Liu; Da-Dong Liang; Kui-Zhan Shao; Yuan-Hang Ren; Zhong-Min Su","Highly Stable Crystalline Catalysts Based on a Microporous Metal-Organic Framework and Polyoxometalates","Journal of the American Chemical Society","2009","131","","1883","1888","10.1021/ja807357r","","","0.71073","MoKα","","0.0668","0.0493","","","0.1373","0.1608","","","","","","1.295","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103878","26.3141","0.0012","26.3141","0.0012","26.3141","0.0012","90","","90","","90","","18220.7","1.4","293","2","293","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C148 H48 Cu24 N2 O221.84 P2 W24 -","- C148 H48 Cu24 N2 O221.84 P2 W24 -","- C296 H96 Cu48 N4 O443.68 P4 W48 -","2","0.0104167","","Chun-Yan Sun; Shu-Xia Liu; Da-Dong Liang; Kui-Zhan Shao; Yuan-Hang Ren; Zhong-Min Su","Highly Stable Crystalline Catalysts Based on a Microporous Metal-Organic Framework and Polyoxometalates","Journal of the American Chemical Society","2009","131","","1883","1888","10.1021/ja807357r","","","0.71073","MoKα","","0.0541","0.0411","","","0.1214","0.1393","","","","","","1.275","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103879","26.3034","0.0009","26.3034","0.0009","26.3034","0.0009","90","","90","","90","","18198.5","1.1","296","2","296","2","","","","","","","","6","F m -3 m","-F 4 2 3","225","","","","- C304 Cu48 Mo48 N4 O461.2 Si4 -","- C304 Cu48 Mo48 N4 O461.2 Si4 -","- C304 Cu48 Mo48 N4 O461.2 Si4 -","1","0.00520833","","Chun-Yan Sun; Shu-Xia Liu; Da-Dong Liang; Kui-Zhan Shao; Yuan-Hang Ren; Zhong-Min Su","Highly Stable Crystalline Catalysts Based on a Microporous Metal-Organic Framework and Polyoxometalates","Journal of the American Chemical Society","2009","131","","1883","1888","10.1021/ja807357r","","","0.71073","MoKα","","0.0709","0.058","","","0.1857","0.1958","","","","","","1.042","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103880","26.3348","0.0008","26.3348","0.0008","26.3348","0.0008","90","","90","","90","","18263.8","1","296","2","296","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C148 H48 Cu24 Mo24 N O224 P2 -","- C148 H48 Cu24 Mo24 N O224 P2 -","- C296 H96 Cu48 Mo48 N2 O448 P4 -","2","0.0104167","","Chun-Yan Sun; Shu-Xia Liu; Da-Dong Liang; Kui-Zhan Shao; Yuan-Hang Ren; Zhong-Min Su","Highly Stable Crystalline Catalysts Based on a Microporous Metal-Organic Framework and Polyoxometalates","Journal of the American Chemical Society","2009","131","","1883","1888","10.1021/ja807357r","","","0.71073","MoKα","","0.0547","0.0513","","","0.1618","0.1656","","","","","","1.139","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103881","26.3239","0.0006","26.3239","0.0006","26.3239","0.0006","90","","90","","90","","18241.1","0.7","293","2","293","2","","","","","","","","7","F m -3 m","-F 4 2 3","225","","","","- C148 H48 As2 Cu24 Mo24 N O212 -","- C148 H48 As2 Cu24 Mo24 N O212 -","- C296 H96 As4 Cu48 Mo48 N2 O424 -","2","0.0104167","","Chun-Yan Sun; Shu-Xia Liu; Da-Dong Liang; Kui-Zhan Shao; Yuan-Hang Ren; Zhong-Min Su","Highly Stable Crystalline Catalysts Based on a Microporous Metal-Organic Framework and Polyoxometalates","Journal of the American Chemical Society","2009","131","","1883","1888","10.1021/ja807357r","","","0.71073","MoKα","","0.0525","0.0496","","","0.1538","0.1561","","","","","","1.102","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103882","25.5737","0.0009","25.5737","0.0009","12.5736","0.0009","90","","90","","90","","8223.3","0.7","173","2","173","2","","","","","","","","6","P 41","P 4w","76","06235b","","","- C83 H62 F24 N14 P4 Ru2 -","- C83 H62 F24 N14 P4 Ru2 -","- C332 H248 F96 N56 P16 Ru8 -","4","1","","Kari A. McGee; Kent R. Mann","Inefficient Crystal Packing in Chiral [Ru(phen)3](PF6)2 Enables Oxygen Molecule Quenching of the Solid-State MLCT Emission","Journal of the American Chemical Society","2009","131","","1896","1902","10.1021/ja8075605","","","0.71073","MoKα","","0.1209","0.073","","","0.1549","0.1755","","","","","","1.027","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103883","11.5794","0.0003","13.935","0.0004","16.6418","0.0005","90","","105.578","0.001","90","","2586.66","0.13","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 Cl2 N2 O Ru -","- C27 H30 Cl2 N2 O Ru -","- C108 H120 Cl8 N8 O4 Ru4 -","4","1","","Ian C. Stewart; Diego Benitez; Daniel J. O'Leary; Ekaterina Tkatchouk; Michael W. Day; William A. Goddard; Robert H. Grubbs","Conformations of N-Heterocyclic Carbene Ligands in Ruthenium Complexes Relevant to Olefin Metathesis","Journal of the American Chemical Society","2009","131","","1931","1938","10.1021/ja8078913","","","0.71073","MoKα","","0.0575","0.0348","","","0.0652","0.0688","","","","","","1.35","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4103884","17.1288","0.0009","15.8049","0.0008","19.861","0.0012","90","","90","","90","","5376.7","0.5","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C27 H28 Cl4 N2 Ru -","- C27 H28 Cl4 N2 Ru -","- C216 H224 Cl32 N16 Ru8 -","8","2","","Ian C. Stewart; Diego Benitez; Daniel J. O'Leary; Ekaterina Tkatchouk; Michael W. Day; William A. Goddard; Robert H. Grubbs","Conformations of N-Heterocyclic Carbene Ligands in Ruthenium Complexes Relevant to Olefin Metathesis","Journal of the American Chemical Society","2009","131","","1931","1938","10.1021/ja8078913","","","0.71073","MoKα","","0.1073","0.0538","","","0.0956","0.0995","","","","","","2.288","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4103885","6.3906","0.0002","10.7093","0.0002","39.9227","0.0006","90","","90","","90","","2732.26","0.11","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H37 N O3 Si -","- C29 H37 N O3 Si -","- C116 H148 N4 O12 Si4 -","4","1","","Yu-hong Lam; Paul Ha-Yeon Cheong; José M. Blasco Mata; Steven J. Stanway; Véronique Gouverneur; K. N. Houk","Diels-Alder Exo Selectivity in Terminal-Substituted Dienes and Dienophiles: Experimental Discoveries and Computational Explanations","Journal of the American Chemical Society","2009","131","","1947","1957","10.1021/ja8079548","","","0.71073","MoKα","","0.0606","0.0377","","0.0592","0.0411","0.0411","","","","","","1.0945","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103886","21.111","0.003","17.542","0.003","21.355","0.003","90","","97.37","0.03","90","","7843","2","294","2","294","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C55 H68 F6 N8 O16 S2 Zn -","- C55 H28 F6 N8 O15 S2 Zn -","- C220 H112 F24 N32 O60 S8 Zn4 -","4","1","","Shiyong Zhang; Shuaijun Yang; Jingbo Lan; Yurong Tang; Ying Xue; Jingsong You","Ultrasound-Induced Switching of Sheetlike Coordination Polymer Microparticles to Nanofibers Capable of Gelating Solvents","Journal of the American Chemical Society","2009","131","","1689","1691","10.1021/ja808210z","","","0.71073","MoKα","","0.2714","0.0989","","","0.2457","0.3209","","","","","","0.948","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103887","20.588","0.003","9.481","0.003","8.455","0.003","90","","110.54","0.03","90","","1545.5","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 N4 O -","- C18 H16 N4 O -","- C72 H64 N16 O4 -","4","0.5","","Shiyong Zhang; Shuaijun Yang; Jingbo Lan; Yurong Tang; Ying Xue; Jingsong You","Ultrasound-Induced Switching of Sheetlike Coordination Polymer Microparticles to Nanofibers Capable of Gelating Solvents","Journal of the American Chemical Society","2009","131","","1689","1691","10.1021/ja808210z","","","0.71073","MoKα","","0.1257","0.0439","","","0.1007","0.123","","","","","","0.95","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103888","40.6692","0.0005","9.6463","0.0002","21.1243","0.0004","90","","120.872","0.001","90","","7113","0.2","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H33 B F10 Si2 Zr -","- C34 H33 B F10 Si2 Zr -","- C272 H264 B8 F80 Si16 Zr8 -","8","1","","Juri Ugolotti; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Five-Membered Zirconacycloallenoids: Synthesis and Characterization of Members of a Unique Class of Internally Metal-Stabilized Bent Allenoid Compounds","Journal of the American Chemical Society","2009","131","","1996","2007","10.1021/ja8084302","","","0.71073","MoKα","","0.1195","0.0522","","","0.1128","0.1344","","","","","","1.005","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103889","12.0655","0.0001","14.5258","0.0002","15.7909","0.0003","111.166","0.001","94.238","0.001","111.542","0.001","2331.55","0.07","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H57 B F10 Si2 Zr -","- C45 H57 B F10 Si2 Zr -","- C90 H114 B2 F20 Si4 Zr2 -","2","1","","Juri Ugolotti; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Five-Membered Zirconacycloallenoids: Synthesis and Characterization of Members of a Unique Class of Internally Metal-Stabilized Bent Allenoid Compounds","Journal of the American Chemical Society","2009","131","","1996","2007","10.1021/ja8084302","","","0.71073","MoKα","","0.0652","0.0453","","","0.1061","0.1163","","","","","","1.028","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103890","10.0841","0.0003","15.819","0.0005","11.5732","0.0004","90","","104.946","0.001","90","","1783.7","0.1","223","2","223","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C34 H33 B F10 Si2 Zr -","- C34 H34 B F10 Si2 Zr -","- C68 H68 B2 F20 Si4 Zr2 -","2","0.5","","Juri Ugolotti; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Five-Membered Zirconacycloallenoids: Synthesis and Characterization of Members of a Unique Class of Internally Metal-Stabilized Bent Allenoid Compounds","Journal of the American Chemical Society","2009","131","","1996","2007","10.1021/ja8084302","","","0.71073","MoKα","","0.0957","0.0557","","","0.1191","0.1356","","","","","","1.019","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103891","11.366","0.01","11.366","0.01","29.309","0.027","90","","90","","120","","3279","5","173","2","173","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C38 H48 F12 Fe4 P2 Si2 -","- C38 H46 F12 Fe4 P2 Si2 -","- C114 H138 F36 Fe12 P6 Si6 -","3","0.5","","Masaaki Okazaki; Masato Takano; Fumiyuki Ozawa","Redox-Responsive Recombination of Carbon-Carbon Bonds on Flexible Tetrairon Cores","Journal of the American Chemical Society","2009","131","","1684","1685","10.1021/ja809540w","","x-ray","0.7107","MoKα","","0.0683","0.0608","","","0.1589","0.1663","","","","","","1.107","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103892","11.7779","0.0002","12.2958","0.0003","15.5196","0.0003","94.926","0.001","102.285","0.001","92.765","0.001","2182.84","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Fe(TpCF3PP)(NO)(1-MeIm)]","","","- C52 H30 F12 Fe N7 O -","- C52 H30 F11.994 Fe N7 O -","- C104 H60 F23.988 Fe2 N14 O2 -","2","1","","Nathan J. Silvernail; Alexander Barabanschikov; J. Timothy Sage; Bruce C. Noll; W. Robert Scheidt","Mapping NO Movements in Crystalline [Fe(Porph)(NO)(1-MeIm)]","Journal of the American Chemical Society","2009","131","","2131","2140","10.1021/ja8055613","","","0.71073","MoKα","","0.0557","0.0366","","","0.0799","0.0913","","","","","","1.068","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103893","12.0195","0.0002","12.5326","0.0002","15.5689","0.0003","95.222","0.001","101.446","0.001","94.253","0.001","2278.81","0.07","290","2","290","2","","","","","","","","6","P -1","-P 1","2","[Fe(TpCF3PP)(NO)(1-MeIm)]","","","- C52 H30 F12 Fe N7 O -","- C52 H30 F12 Fe N7 O -","- C104 H60 F24 Fe2 N14 O2 -","2","1","","Nathan J. Silvernail; Alexander Barabanschikov; J. Timothy Sage; Bruce C. Noll; W. Robert Scheidt","Mapping NO Movements in Crystalline [Fe(Porph)(NO)(1-MeIm)]","Journal of the American Chemical Society","2009","131","","2131","2140","10.1021/ja8055613","","","0.71073","MoKα","","0.0589","0.0484","","","0.1378","0.1501","","","","","","1.052","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103894","12.566","0.016","13.301","0.016","15.773","0.019","65.65","0.04","85.112","0.014","75.519","0.017","2325","5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Fe(TpNO2FP)(NO)(1-MeIm)]","","","- C51.43 H34.85 Cl0.57 Fe N12.62 O8.99 -","- C51.427 H34.854 Cl0.573 Fe N12.618 O8.991 -","- C102.854 H69.708 Cl1.146 Fe2 N25.236 O17.982 -","2","1","","Nathan J. Silvernail; Alexander Barabanschikov; J. Timothy Sage; Bruce C. Noll; W. Robert Scheidt","Mapping NO Movements in Crystalline [Fe(Porph)(NO)(1-MeIm)]","Journal of the American Chemical Society","2009","131","","2131","2140","10.1021/ja8055613","","","0.71073","MoKα","","0.0654","0.0485","","","0.1252","0.1367","","","","","","1.038","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103895","9.6224","0.0002","17.514","0.0004","25.1564","0.0006","90","","90","","90","","4239.53","0.17","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Fe(TPP)(NO)(1-MeIm)].CHCl3","","","- C48.88 H34.88 Cl2.64 Fe N7 O -","- C48.8813 H34.8813 Cl2.6439 Fe N7 O -","- C195.525 H139.525 Cl10.5756 Fe4 N28 O4 -","4","1","","Nathan J. Silvernail; Alexander Barabanschikov; J. Timothy Sage; Bruce C. Noll; W. Robert Scheidt","Mapping NO Movements in Crystalline [Fe(Porph)(NO)(1-MeIm)]","Journal of the American Chemical Society","2009","131","","2131","2140","10.1021/ja8055613","","","0.71073","MoKα","","0.0469","0.0384","","","0.0968","0.1019","","","","","","1.032","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103896","9.755","0.0003","17.7199","0.0005","25.3249","0.0007","90","","90","","90","","4377.6","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Fe(TPP)(NO)(1-MeIm)].CHCl3","","","- C48.74 H34.74 Cl2.23 Fe N7 O0.99 -","- C48.742 H34.742 Cl2.226 Fe N7 O0.991 -","- C194.968 H138.968 Cl8.904 Fe4 N28 O3.964 -","4","1","","Nathan J. Silvernail; Alexander Barabanschikov; J. Timothy Sage; Bruce C. Noll; W. Robert Scheidt","Mapping NO Movements in Crystalline [Fe(Porph)(NO)(1-MeIm)]","Journal of the American Chemical Society","2009","131","","2131","2140","10.1021/ja8055613","","","0.71073","MoKα","","0.0739","0.0564","","","0.1702","0.1897","","","","","","1.059","","","","has coordinates,has disorder","178784","2020-10-21","18:00:00",""
"4103897","9.142","0.004","6.37","0.003","5.889","0.003","90","","90","","90","","342.9","0.3","143","2","143","2","","","","","","","","3","I m a 2","I 2 -2a","46","","ammonia acetylene cocrystal","","- C2 H5 N -","- C2 H5.02 N -","- C8 H20.08 N4 -","4","0.5","","Roland Boese; Dieter Bläser; Georg Jansen","Synthesis and Theoretical Characterization of an Acetylene-Ammonia Cocrystal","Journal of the American Chemical Society","2009","131","","2104","2106","10.1021/ja8059705","","","0.71073","MoKα","","0.052","0.0461","","","0.0929","0.0973","","","","","","1.29","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103898","9.142","0.004","6.37","0.003","5.889","0.003","90","","90","","90","","342.9","0.3","293","2","293","2","","","","","","","","3","I m a 2","I 2 -2a","46","","ammonia acetylene cocrystal","","- C2 H5 N -","- C2 H5.02 N -","- C8 H20.08 N4 -","4","0.5","","Roland Boese; Dieter Bläser; Georg Jansen","Synthesis and Theoretical Characterization of an Acetylene-Ammonia Cocrystal","Journal of the American Chemical Society","2009","131","","2104","2106","10.1021/ja8059705","","","0.71073","MoKα","","0.0597","0.054","","","0.1361","0.1452","","","","","","0.925","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103899","18.513","0.001","18.513","0.001","45.354","0.005","90","","90","","120","","13461.7","1.8","150","2","150","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C35 H43 Cu2 N3 O16 -","- C26 H8 Cu2 O10 -","- C234 H72 Cu18 O90 -","9","0.25","","Xiang Lin; Irvin Telepeni; Alexander J. Blake; Anne Dailly; Craig M. Brown; Jason M. Simmons; Marco Zoppi; Gavin S. Walker; K. Mark Thomas; Timothy J. Mays; Peter Hubberstey; Neil R. Champness; Martin Schröder","High Capacity Hydrogen Adsorption in Cu(II) Tetracarboxylate Framework Materials: The Role of Pore Size, Ligand Functionalization, and Exposed Metal Sites","Journal of the American Chemical Society","2009","131","","2159","2171","10.1021/ja806624j","","","0.71073","MoKα","","0.161","0.113","","","0.312","0.336","","","","","","0.99","","","","has coordinates","178784","2020-10-21","18:00:00",""
"4103900","18.348","0.001","18.348","0.001","65.094","0.002","90","","90","","120","","18977.9","1.6","100","2","100","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C74 H70 Cu4 N2 O28 -","- C66 H12 Cu4 O20 -","- C594 H108 Cu36 O180 -","9","0.25","","Xiang Lin; Irvin Telepeni; Alexander J. Blake; Anne Dailly; Craig M. Brown; Jason M. Simmons; Marco Zoppi; Gavin S. Walker; K. Mark Thomas; Timothy J. Mays; Peter Hubberstey; Neil R. Champness; Martin Schröder","High Capacity Hydrogen Adsorption in Cu(II) Tetracarboxylate Framework Materials: The Role of Pore Size, Ligand Functionalization, and Exposed Metal Sites","Journal of the American Chemical Society","2009","131","","2159","2171","10.1021/ja806624j","","","0.6907","Synchrotron","","0.196","0.132","","","0.372","0.402","","","","","","1.23","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103901","18.5944","0.0019","18.5944","0.0019","38.671","0.004","90","","90","","120","","11579","2","150","2","150","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- C32 H42 Cu2 F2 N2 O18 -","- C22 H8 Cu2 F2 O10 -","- C198 H72 Cu18 F18 O90 -","9","0.25","","Xiang Lin; Irvin Telepeni; Alexander J. Blake; Anne Dailly; Craig M. Brown; Jason M. Simmons; Marco Zoppi; Gavin S. Walker; K. Mark Thomas; Timothy J. Mays; Peter Hubberstey; Neil R. Champness; Martin Schröder","High Capacity Hydrogen Adsorption in Cu(II) Tetracarboxylate Framework Materials: The Role of Pore Size, Ligand Functionalization, and Exposed Metal Sites","Journal of the American Chemical Society","2009","131","","2159","2171","10.1021/ja806624j","","","0.71073","MoKα","","0.0456","0.0368","","","0.0897","0.0917","","","","","","0.912","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103902","18.504","0.002","18.504","0.002","39.035","0.005","90","","90","","120","","11575","2","150","2","150","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C24.75 H21.75 Cu2 N0.25 O11.25 -","- C24 H14 Cu2 O10 -","- C216 H126 Cu18 O90 -","9","0.25","","Xiang Lin; Irvin Telepeni; Alexander J. Blake; Anne Dailly; Craig M. Brown; Jason M. Simmons; Marco Zoppi; Gavin S. Walker; K. Mark Thomas; Timothy J. Mays; Peter Hubberstey; Neil R. Champness; Martin Schröder","High Capacity Hydrogen Adsorption in Cu(II) Tetracarboxylate Framework Materials: The Role of Pore Size, Ligand Functionalization, and Exposed Metal Sites","Journal of the American Chemical Society","2009","131","","2159","2171","10.1021/ja806624j","","","0.7848","Synchrotron","","0.0963","0.0651","","","0.185","0.196","","","","","","0.98","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103903","18.525","0.001","18.525","0.001","38.83","0.002","90","","90","","120","","11540.2","1.1","100","2","100","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- C25 H19 Cu2 F4 N O12 -","- C22 H6 Cu2 F4 O10 -","- C198 H54 Cu18 F36 O90 -","9","0.25","","Xiang Lin; Irvin Telepeni; Alexander J. Blake; Anne Dailly; Craig M. Brown; Jason M. Simmons; Marco Zoppi; Gavin S. Walker; K. Mark Thomas; Timothy J. Mays; Peter Hubberstey; Neil R. Champness; Martin Schröder","High Capacity Hydrogen Adsorption in Cu(II) Tetracarboxylate Framework Materials: The Role of Pore Size, Ligand Functionalization, and Exposed Metal Sites","Journal of the American Chemical Society","2009","131","","2159","2171","10.1021/ja806624j","","","0.6907","Synchrotron","","0.0725","0.0589","","","0.164","0.172","","","","","","1.04","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103904","18.852","0.003","18.852","0.003","27.417","0.006","90","","90","","90","","9744","3","150","2","150","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- C44 H66 Cu2 N6 O20 -","- C26 H6 Cu2 O10.28 -","- C208 H48 Cu16 O82.24 -","8","0.25","","Xiang Lin; Irvin Telepeni; Alexander J. Blake; Anne Dailly; Craig M. Brown; Jason M. Simmons; Marco Zoppi; Gavin S. Walker; K. Mark Thomas; Timothy J. Mays; Peter Hubberstey; Neil R. Champness; Martin Schröder","High Capacity Hydrogen Adsorption in Cu(II) Tetracarboxylate Framework Materials: The Role of Pore Size, Ligand Functionalization, and Exposed Metal Sites","Journal of the American Chemical Society","2009","131","","2159","2171","10.1021/ja806624j","","","0.864","synchrotronradiation","","0.0821","0.0676","","","0.181","0.192","","","","","","1.04","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103905","8.7902","0.0001","45.7088","0.0006","7.6051","0.0001","90","","90","","90","","3055.65","0.07","223.1","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C38 H25 Cl3 N2 O -","- C38 H25 Cl3 N2 O -","- C152 H100 Cl12 N8 O4 -","4","1","","Ken Albrecht; Kimihisa Yamamoto","Dendritic Structure Having a Potential Gradient: New Synthesis and Properties of Carbazole Dendrimers","Journal of the American Chemical Society","2009","131","","2244","2251","10.1021/ja807312e","","","1.54187","CuKα","","","0.037","","","","0.0346","","","","","","0.918","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103906","8.1267","0.0019","12.837","0.003","9.775","0.003","90","","99.493","0.012","90","","1005.8","0.5","223.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H21 Fe N -","- C28 H21 Fe N -","- C56 H42 Fe2 N2 -","2","1","","Ken Albrecht; Kimihisa Yamamoto","Dendritic Structure Having a Potential Gradient: New Synthesis and Properties of Carbazole Dendrimers","Journal of the American Chemical Society","2009","131","","2244","2251","10.1021/ja807312e","","","0.71075","MoKα","","","0.0268","","","","0.072","","","","","","0.617","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103907","14.0077","0.0017","17.5798","0.0018","18.722","0.002","76.256","0.006","74.551","0.007","74.555","0.006","4213.8","0.8","223.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C109 H52 N6 O -","- C109 H52 N6 O -","- C218 H104 N12 O2 -","2","1","","Ken Albrecht; Kimihisa Yamamoto","Dendritic Structure Having a Potential Gradient: New Synthesis and Properties of Carbazole Dendrimers","Journal of the American Chemical Society","2009","131","","2244","2251","10.1021/ja807312e","","","1.54187","CuKα","","","0.0973","","","","0.2966","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103908","10.8911","0.0007","34.7331","0.0018","11.3866","0.0007","90","","108.577","0.0015","90","","4082.9","0.4","103.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C52 H35 Cl3 Fe N3 -","- C53 H36 Cl3 Fe N3 -","- C212 H144 Cl12 Fe4 N12 -","4","1","","Ken Albrecht; Kimihisa Yamamoto","Dendritic Structure Having a Potential Gradient: New Synthesis and Properties of Carbazole Dendrimers","Journal of the American Chemical Society","2009","131","","2244","2251","10.1021/ja807312e","","","0.71075","MoKα","","","0.0556","","","","0.1389","","","","","","0.882","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103909","11.135","0.0008","6.5575","0.0004","4.9194","0.0003","90","","90","","90","","359.2","0.04","150","","150","","","","","","","","Christina Tang & Tony Downs","4","P n m a","-P 2ac 2n","62","","","","- C H8 B N -","- C H8 B N -","- C4 H32 B4 N4 -","4","0.5","","Simon Aldridge; Anthony J. Downs; Christina Y. Tang; Simon Parsons; Michael C. Clarke; Russell D. L. Johnstone; Heather E. Robertson; David W. H. Rankin; Derek A. Wann","Structures and Aggregation of the Methylamine-Borane Molecules, MenH3-nN.BH3 (n= 1-3), Studied by X-ray Diffraction, Gas-Phase Electron Diffraction, and Quantum Chemical Calculations","Journal of the American Chemical Society","2009","131","","2231","2243","10.1021/ja807545p","","","0.71073","MoKα","","0.052","0.0381","","0.1054","0.0964","0.1054","","","","","","1.0019","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103910","7.0452","0.0006","5.8368","0.0005","12.2335","0.0014","90","","104.648","0.004","90","","486.71","0.08","150","","150","","","","","","","","Tony Downs & Christina Tang","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H10 B N -","- C2 H10 B N -","- C8 H40 B4 N4 -","4","1","","Simon Aldridge; Anthony J. Downs; Christina Y. Tang; Simon Parsons; Michael C. Clarke; Russell D. L. Johnstone; Heather E. Robertson; David W. H. Rankin; Derek A. Wann","Structures and Aggregation of the Methylamine-Borane Molecules, MenH3-nN.BH3 (n= 1-3), Studied by X-ray Diffraction, Gas-Phase Electron Diffraction, and Quantum Chemical Calculations","Journal of the American Chemical Society","2009","131","","2231","2243","10.1021/ja807545p","","","0.71073","MoKα","","0.0549","0.0416","","0.112","0.1021","0.112","","","","","","1.0032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103911","9.0792","0.0005","9.0792","0.0005","5.8922","0.0005","90","","90","","120","","420.63","0.05","150","","150","","","","","","","","Christina Tang, Oxford.","4","R 3 m :H","R 3 -2""","160","","","","- C3 H12 B N -","- C3 H12 B N -","- C9 H36 B3 N3 -","3","0.166667","","Simon Aldridge; Anthony J. Downs; Christina Y. Tang; Simon Parsons; Michael C. Clarke; Russell D. L. Johnstone; Heather E. Robertson; David W. H. Rankin; Derek A. Wann","Structures and Aggregation of the Methylamine-Borane Molecules, MenH3-nN.BH3 (n= 1-3), Studied by X-ray Diffraction, Gas-Phase Electron Diffraction, and Quantum Chemical Calculations","Journal of the American Chemical Society","2009","131","","2231","2243","10.1021/ja807545p","","","0.71073","MoKα","","0.0286","0.0283","","0.0738","0.0734","0.0738","","","","","","1.0092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103912","7.6417","0.0004","10.3281","0.0006","18.8545","0.0011","90","","92.941","0.002","90","","1486.12","0.15","296","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Cs6 Ge4 H8 O24 U3 -","- Cs6 Ge4 O24 U3 -","- Cs12 Ge8 O48 U6 -","2","0.5","","Chia-Hui Lin; Ray-Kuang Chiang; Kwang-Hwa Lii","Synthesis of Thermally Stable Extra-Large Pore Crystalline Materials: A Uranyl Germanate with 12-Ring Channels","Journal of the American Chemical Society","2009","131","","2068","2069","10.1021/ja8084143","","","0.71073","MoKα","","0.0232","0.0197","","","0.04","0.041","","","","","","1.063","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103913","12.722","0.0015","13.0859","0.0015","14.9523","0.0017","90","","90","","90","","2489.2","0.5","143","1","143","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H20 O3 -","- C11 H20 O3 -","- C88 H160 O24 -","8","2","","Amos B. Smith III; Todd Bosanac; Kallol Basu","Evolution of the Total Synthesis of (-)-Okilactomycin Exploiting a Tandem Oxy-Cope Rearrangement/Oxidation, a Petasis-Ferrier Union/Rearrangement, and Ring-Closing Metathesis","Journal of the American Chemical Society","2009","131","","2348","2358","10.1021/ja8084669","","","0.71069","MoKα","","0.0552","0.0472","","","0.1189","0.1268","","","","","","1.044","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103914","10.291","0.012","7.147","0.005","14.561","0.012","90","","108.581","0.009","90","","1015.1","1.6","143","1","143","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H34 O4 -","- C22 H34 O4 -","- C44 H68 O8 -","2","1","","Amos B. Smith III; Todd Bosanac; Kallol Basu","Evolution of the Total Synthesis of (-)-Okilactomycin Exploiting a Tandem Oxy-Cope Rearrangement/Oxidation, a Petasis-Ferrier Union/Rearrangement, and Ring-Closing Metathesis","Journal of the American Chemical Society","2009","131","","2348","2358","10.1021/ja8084669","","","0.71069","MoKα","","0.0361","0.0338","","","0.0851","0.0876","","","","","","1.067","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103915","10.8093","0.0009","11.143","0.001","20.0215","0.0019","90","","90","","90","","2411.6","0.4","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H37 I O4 -","- C24 H37 I O4 -","- C96 H148 I4 O16 -","4","1","","Amos B. Smith III; Todd Bosanac; Kallol Basu","Evolution of the Total Synthesis of (-)-Okilactomycin Exploiting a Tandem Oxy-Cope Rearrangement/Oxidation, a Petasis-Ferrier Union/Rearrangement, and Ring-Closing Metathesis","Journal of the American Chemical Society","2009","131","","2348","2358","10.1021/ja8084669","","","0.71069","MoKα","","0.0359","0.0332","","","0.0746","0.0778","","","","","","1.063","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103916","7.4743","0.0005","14.7529","0.0007","7.7424","0.0004","90","","90","","90","","853.74","0.08","293","2","293","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Gd5 Si4 -","- Gd5 Si4 -","- Gd20 Si16 -","4","0.5","","Volodymyr Svitlyk; Gordon J. Miller; Yurij Mozharivskyj","Gd5Si4-xPx: Targeted Structural Changes through Increase in Valence Electron Count","Journal of the American Chemical Society","2009","131","","2367","2374","10.1021/ja8085033","","","0.71073","MoKα","","0.0419","0.0344","","","0.0749","0.0774","","","","","","1.089","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103917","7.6067","0.0017","14.645","0.003","7.6843","0.0016","90","","90","","90","","856","0.3","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Gd5 P1.25 Si2.75 -","- Gd5 P1.24 Si2.76 -","- Gd20 P4.96 Si11.04 -","4","0.5","","Volodymyr Svitlyk; Gordon J. Miller; Yurij Mozharivskyj","Gd5Si4-xPx: Targeted Structural Changes through Increase in Valence Electron Count","Journal of the American Chemical Society","2009","131","","2367","2374","10.1021/ja8085033","","","0.71073","MoKα","","0.0824","0.0754","","","0.1655","0.1688","","","","","","1.11","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103918","12.03","0.005","17.467","0.005","17.5333","0.0014","90","","107.689","0.011","90","","3510","1.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H44 Li2 O6 Zn -","- C36 H44 Li2 O6 Zn -","- C144 H176 Li8 O24 Zn4 -","4","1","","William Clegg; Ben Conway; Eva Hevia; Matthew D. McCall; Luca Russo; Robert E. Mulvey","Closer Insight into the Reactivity of TMP-Dialkyl Zincates in Directed ortho-Zincation of Anisole: Experimental Evidence of Amido Basicity and Structural Elucidation of Key Reaction Intermediates","Journal of the American Chemical Society","2009","131","","2375","2384","10.1021/ja8087168","","","0.71073","MoKα","","0.1093","0.0483","","","0.0832","0.1007","","","","","","1.04","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103919","8.3053","0.0003","13.0406","0.0003","16.4544","0.0005","90","","90","","90","","1782.11","0.09","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H29 Li N2 O Zn -","- C15 H29 Li N2 O Zn -","- C60 H116 Li4 N8 O4 Zn4 -","4","1","","William Clegg; Ben Conway; Eva Hevia; Matthew D. McCall; Luca Russo; Robert E. Mulvey","Closer Insight into the Reactivity of TMP-Dialkyl Zincates in Directed ortho-Zincation of Anisole: Experimental Evidence of Amido Basicity and Structural Elucidation of Key Reaction Intermediates","Journal of the American Chemical Society","2009","131","","2375","2384","10.1021/ja8087168","","","0.71073","MoKα","","0.0411","0.0288","","","0.0406","0.0425","","","","","","0.887","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103920","12.0463","0.0003","14.9178","0.0005","15.5281","0.0004","90","","90","","90","","2790.47","0.14","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H48 Li N3 O Zn -","- C24 H48 Li N3 O Zn -","- C96 H192 Li4 N12 O4 Zn4 -","4","1","","William Clegg; Ben Conway; Eva Hevia; Matthew D. McCall; Luca Russo; Robert E. Mulvey","Closer Insight into the Reactivity of TMP-Dialkyl Zincates in Directed ortho-Zincation of Anisole: Experimental Evidence of Amido Basicity and Structural Elucidation of Key Reaction Intermediates","Journal of the American Chemical Society","2009","131","","2375","2384","10.1021/ja8087168","","","0.71073","MoKα","","0.0619","0.0375","","","0.0748","0.0782","","","","","","0.933","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103921","11.2443","0.0002","10.0849","0.0002","21.2607","0.0004","90","","90","","90","","2410.91","0.08","90","","90","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H10 N2 O2 S2 -","- C12 H10 N2 O2 S2 -","- C96 H80 N16 O16 S16 -","8","1","","Takashi Hirano; Yosuke Hasumi; Kazuhiro Ohtsuka; Shojiro Maki; Haruki Niwa; Minoru Yamaji; Daisuke Hashizume","Spectroscopic Studies of the Light-Color Modulation Mechanism of Firefly (Beetle) Bioluminescence","Journal of the American Chemical Society","2009","131","","2385","2396","10.1021/ja808836b","","","0.71073","MoKα","","0.0458","0.0317","","","0.0753","0.0812","","","","","","1.006","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103922","6.8862","0.0014","12.4986","0.0017","16.205","0.003","101.436","0.006","101.429","0.008","96.34","0.013","1323.6","0.4","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 N2 O2 S2 -","- C13 H12 N2 O2 S2 -","- C52 H48 N8 O8 S8 -","4","2","","Takashi Hirano; Yosuke Hasumi; Kazuhiro Ohtsuka; Shojiro Maki; Haruki Niwa; Minoru Yamaji; Daisuke Hashizume","Spectroscopic Studies of the Light-Color Modulation Mechanism of Firefly (Beetle) Bioluminescence","Journal of the American Chemical Society","2009","131","","2385","2396","10.1021/ja808836b","","","0.71073","MoKα","","0.1011","0.0586","","","0.1511","0.176","","","","","","1.021","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103923","56.082","0.003","13.3274","0.0008","21.6153","0.0012","90","","110.135","0.002","90","","15168.5","1.5","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C83 H88 N6 O3 Ti2 -","- C83 H88 N6 O3 Ti2 -","- C664 H704 N48 O24 Ti16 -","8","2","","Jason A. Bexrud; Patrick Eisenberger; David C. Leitch; Philippa R. Payne; Laurel L. Schafer","Selective C-H Activation α to Primary Amines. Bridging Metallaaziridines for Catalytic, Intramolecular α-Alkylation","Journal of the American Chemical Society","2009","131","","2116","2118","10.1021/ja808862w","","","0.71073","MoKα","","0.0498","0.0409","","","0.109","0.1154","","","","","","1.019","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103924","12.8333","0.0006","9.9404","0.0005","34.8473","0.0015","90","","90","","90","","4445.4","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C27 H31 N O S -","- C26 H28 N O2 S -","- C208 H224 N8 O16 S8 -","8","1","","Jason A. Bexrud; Patrick Eisenberger; David C. Leitch; Philippa R. Payne; Laurel L. Schafer","Selective C-H Activation α to Primary Amines. Bridging Metallaaziridines for Catalytic, Intramolecular α-Alkylation","Journal of the American Chemical Society","2009","131","","2116","2118","10.1021/ja808862w","","","0.71073","MoKα","","0.0711","0.0493","","","0.1208","0.1333","","","","","","1.044","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103925","7.5843","0.0008","9.7333","0.0011","11.8584","0.0013","88.595","0.003","83.254","0.003","68.29","0.003","807.5","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H21 N O2 S -","- C18 H20 N O2 S -","- C36 H40 N2 O4 S2 -","2","1","","Jason A. Bexrud; Patrick Eisenberger; David C. Leitch; Philippa R. Payne; Laurel L. Schafer","Selective C-H Activation α to Primary Amines. Bridging Metallaaziridines for Catalytic, Intramolecular α-Alkylation","Journal of the American Chemical Society","2009","131","","2116","2118","10.1021/ja808862w","","","0.71073","MoKα","","0.0541","0.0491","","","0.1353","0.1417","","","","","","0.563","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103926","9.636","0.002","11.622","0.003","15.13","0.004","90","","90","","90","","1694.4","0.7","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 N O -","- C20 H24 N O -","- C80 H96 N4 O4 -","4","1","","Jason A. Bexrud; Patrick Eisenberger; David C. Leitch; Philippa R. Payne; Laurel L. Schafer","Selective C-H Activation α to Primary Amines. Bridging Metallaaziridines for Catalytic, Intramolecular α-Alkylation","Journal of the American Chemical Society","2009","131","","2116","2118","10.1021/ja808862w","","","0.71073","MoKα","","0.0987","0.0717","","","0.1923","0.2197","","","","","","1.04","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103927","13.297","0.003","13.818","0.003","18.023","0.003","93.172","0.003","101.882","0.003","91.269","0.003","3233.7","1.1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C71 H87 B Cl2 N2 O Os P2 -","- C71 H87 B Cl2 N2 O Os P2 -","- C142 H174 B2 Cl4 N4 O2 Os2 P4 -","2","1","","Tamara Bolaño; Ricardo Castarlenas; Miguel A. Esteruelas; Enrique Oñate","Nazarov Type Cyclization on an Osmium-Dienylcarbene Complex","Journal of the American Chemical Society","2009","131","","2064","2065","10.1021/ja8093058","","","0.71073","MoKα","","0.0781","0.0611","","","0.1301","0.1382","","","","","","1.07","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103928","15.252","0.003","23.471","0.004","18.257","0.004","90","","91.508","0.004","90","","6533","2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C39 H81 B30 Cl Li N3 Ni3 O6 -","- C39 H81 B30 Cl Li N3 Ni3 O6 -","- C156 H324 B120 Cl4 Li4 N12 Ni12 O24 -","4","1","","Zaozao Qiu; Zuowei Xie","Nickel-Mediated Three-Component Cycloaddition Reaction of Carboryne, Alkenes, and Alkynes","Journal of the American Chemical Society","2009","131","","2084","2085","10.1021/ja809389k","","","0.71073","MoKα","","0.1738","0.062","","","0.1457","0.2124","","","","","","1.01","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103929","21.807","0.004","10.773","0.002","24.597","0.005","90","","108.214","0.005","90","","5489","1.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H18 B10 O2 -","- C6 H18 B10 O2 -","- C96 H288 B160 O32 -","16","4","","Zaozao Qiu; Zuowei Xie","Nickel-Mediated Three-Component Cycloaddition Reaction of Carboryne, Alkenes, and Alkynes","Journal of the American Chemical Society","2009","131","","2084","2085","10.1021/ja809389k","","","0.71073","MoKα","","0.1893","0.0761","","","0.2165","0.3028","","","","","","1.079","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103930","12.961","0.002","7.0537","0.0011","23.025","0.003","90","","98.982","0.002","90","","2079.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 B10 N -","- C18 H25 B10 N -","- C72 H100 B40 N4 -","4","1","","Zaozao Qiu; Zuowei Xie","Nickel-Mediated Three-Component Cycloaddition Reaction of Carboryne, Alkenes, and Alkynes","Journal of the American Chemical Society","2009","131","","2084","2085","10.1021/ja809389k","","","0.71073","MoKα","","0.0843","0.0574","","","0.1583","0.182","","","","","","1.023","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103931","10.4119","0.0012","14.9521","0.0017","12.0963","0.0013","90","","102.436","0.002","90","","1839","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H26 B10 O2 -","- C12 H26 B10 O2 -","- C48 H104 B40 O8 -","4","2","","Zaozao Qiu; Zuowei Xie","Nickel-Mediated Three-Component Cycloaddition Reaction of Carboryne, Alkenes, and Alkynes","Journal of the American Chemical Society","2009","131","","2084","2085","10.1021/ja809389k","","","0.71073","MoKα","","0.1184","0.059","","","0.122","0.1513","","","","","","1.005","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103932","5.0792","0.001","15.951","0.003","24.316","0.005","90","","90","","90","","1970","0.7","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H21 Br N O4 -","- C20 H21 Br N O4 -","- C80 H84 Br4 N4 O16 -","4","1","","K. C. Nicolaou; Rüdiger Reingruber; David Sarlah; Stefan Bräse","Enantioselective Intramolecular Friedel-Crafts-Type α-Arylation of Aldehydes","Journal of the American Chemical Society","2009","131","","2086","2087","10.1021/ja809405c","","","0.71073","MoKα","","0.1216","0.0708","","","0.1815","0.2168","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103933","11.3854","0.0012","10.5567","0.0012","28.68","0.003","90","","99.251","0.003","90","","3402.3","0.6","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 O2 -","- C21 H22 O2 -","- C168 H176 O16 -","8","2","","Yu-Chia Hsu; Chun-Ming Ting; Rai-Shung Liu","Stereocontrolled Synthesis of Complicated Oxacyclic Compounds via Platinum-Catalyzed [4 + 2]-Cycloadditions and Annulations of Enynals with Allylic Alcohols","Journal of the American Chemical Society","2009","131","","2090","2091","10.1021/ja809560c","","","0.71073","MoKα","","0.3033","0.0771","","","0.1922","0.3393","","","","","","0.915","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103934","6.1427","0.0002","12.2134","0.0006","27.1155","0.0011","90","","90","","90","","2034.29","0.15","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H32 O3 -","- C24 H32 O3 -","- C96 H128 O12 -","4","1","","Yu-Chia Hsu; Chun-Ming Ting; Rai-Shung Liu","Stereocontrolled Synthesis of Complicated Oxacyclic Compounds via Platinum-Catalyzed [4 + 2]-Cycloadditions and Annulations of Enynals with Allylic Alcohols","Journal of the American Chemical Society","2009","131","","2090","2091","10.1021/ja809560c","","","0.71073","MoKα","","0.1023","0.0876","","","0.2395","0.2544","","","","","","1.045","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103935","7.69821","0.00019","5.8403","0.00015","24.5825","0.0006","90","","96.3116","0.0013","90","","1098.53","0.05","296.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H11 N O -","- C14 H11 N O -","- C56 H44 N4 O4 -","4","1","","Shinji Yamada; Yoko Tokugawa","Cation-π Controlled Solid-State Photodimerization of 4-Azachalcones","Journal of the American Chemical Society","2009","131","","2098","2099","10.1021/ja809906c","","","1.54187","CuKα","","","0.043","","","","0.1038","","","","","","0.964","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103936","22.3925","0.0007","6.04763","0.00018","18.9197","0.0006","90","","94.0378","0.0016","90","","2555.78","0.14","296.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 Cl N O2 -","- C14 H12 Cl N O1.5 -","- C112 H96 Cl8 N8 O12 -","8","1","","Shinji Yamada; Yoko Tokugawa","Cation-π Controlled Solid-State Photodimerization of 4-Azachalcones","Journal of the American Chemical Society","2009","131","","2098","2099","10.1021/ja809906c","","","1.54187","CuKα","","","0.0459","","","","0.1405","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103937","3.85739","0.0001","17.2367","0.0004","19.274","0.0005","112.901","0.0015","95.7517","0.0018","96.409","0.0018","1158.58","0.05","123.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C60 H52 N4 O8 -","4","2","","Shinji Yamada; Yoko Tokugawa","Cation-π Controlled Solid-State Photodimerization of 4-Azachalcones","Journal of the American Chemical Society","2009","131","","2098","2099","10.1021/ja809906c","","","1.54187","CuKα","","","0.0601","","","","0.1743","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103938","7.1308","0.0003","14.4771","0.0006","13.2057","0.0005","90","","101.889","0.002","90","","1334.02","0.09","298.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 Cl N O2 -","- C15 H14 Cl N O2 -","- C60 H56 Cl4 N4 O8 -","4","1","","Shinji Yamada; Yoko Tokugawa","Cation-π Controlled Solid-State Photodimerization of 4-Azachalcones","Journal of the American Chemical Society","2009","131","","2098","2099","10.1021/ja809906c","","","1.54187","CuKα","","","0.0609","","","","0.191","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103939","6.82677","0.00016","10.9063","0.0002","14.7427","0.0003","90","","97.9763","0.0014","90","","1087.05","0.04","296.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H22 N2 O2 -","- C28 H22 N2 O2 -","- C56 H44 N4 O4 -","2","1","","Shinji Yamada; Yoko Tokugawa","Cation-π Controlled Solid-State Photodimerization of 4-Azachalcones","Journal of the American Chemical Society","2009","131","","2098","2099","10.1021/ja809906c","","","1.54187","CuKα","","","0.0378","","","","0.1185","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103940","9.0768","0.0002","11.4769","0.0003","13.8031","0.0003","111.847","0.0013","110.515","0.0012","92.9062","0.0012","1222.58","0.05","298.1","","","","","","","","","","","4","P 1","P 1","1","","","","- C30 H26 N2 O4 -","- C30 H26 N2 O4 -","- C60 H52 N4 O8 -","2","2","","Shinji Yamada; Yoko Tokugawa","Cation-π Controlled Solid-State Photodimerization of 4-Azachalcones","Journal of the American Chemical Society","2009","131","","2098","2099","10.1021/ja809906c","","","1.54187","CuKα","","","0.0419","","","","0.1311","","","","","","1.071","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103941","18.7195","0.0001","8.7594","0.0001","18.3245","0.0001","90","","100.125","0.001","90","","2957.9","0.04","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C18 H14 Br N O -","- C18 H14 Br N O -","- C144 H112 Br8 N8 O8 -","8","2","","José Barluenga; Eva Tudela; Alfredo Ballesteros; Miguel Tomás","Asymmetric C2-C3 Cyclopentannulation of the Indole Ring","Journal of the American Chemical Society","2009","131","","2096","2097","10.1021/ja809919t","","","1.54184","CuKα","","0.0252","0.0225","","","0.0549","0.0677","","","","","","1.154","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103942","7.2867","0.0001","10.3536","0.0002","19.1306","0.0003","90","","90","","90","","1443.28","0.04","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H24 I N O -","- C14 H24 I N O -","- C56 H96 I4 N4 O4 -","4","1","","José Barluenga; Eva Tudela; Alfredo Ballesteros; Miguel Tomás","Asymmetric C2-C3 Cyclopentannulation of the Indole Ring","Journal of the American Chemical Society","2009","131","","2096","2097","10.1021/ja809919t","","","1.54184","CuKα","","0.0364","0.0348","","","0.0967","0.113","","","","","","1.148","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103943","7.5357","0.0002","13.7783","0.0006","28.0807","0.0008","90","","90","","90","","2915.59","0.17","293","2","293","2","","","","","","","","4","P m c 21","P 2c -2","26","","","","- Bi Cs5 P4 Se12 -","- Bi Cs5 P4 Se12 -","- Bi4 Cs20 P16 Se48 -","4","1","","In Chung; Jung-Hwan Song; Joon I. Jang; Arthur J. Freeman; John B. Ketterson; Mercouri G. Kanatzidis","Flexible Polar Nanowires of Cs5BiP4Se12 from Weak Interactions between Coordination Complexes: Strong Nonlinear Optical Second Harmonic Generation","Journal of the American Chemical Society","2009","131","","2647","2656","10.1021/ja808242g","","","0.71073","MoKα","","0.079","0.0626","","","0.1151","0.1207","","","","","","1.077","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103944","18.7736","0.0013","10.6759","0.0007","26.9091","0.0019","90","","109.621","0.001","90","","5080.1","0.6","105","2","105","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H34 Fe O4 Si2 -","- C24 H34 Fe O4 Si2 -","- C192 H272 Fe8 O32 Si16 -","8","1","","Charles P. Casey; Hairong Guan","Cyclopentadienone Iron Alcohol Complexes: Synthesis, Reactivity, and Implications for the Mechanism of Iron-Catalyzed Hydrogenation of Aldehydes","Journal of the American Chemical Society","2009","131","","2499","2507","10.1021/ja808683z","","","0.71073","Mo-Kα","","0.0387","0.0308","","","0.0804","0.0857","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4103945","17.7905","0.001","17.7905","0.001","15.6247","0.0017","90","","90","","120","","4282.7","0.6","155","2","155","2","","","","","","","","5","P -3","-P 3","147","","","","- C26 H48 La N Si2 -","- C26 H48 La N Si2 -","- C156 H288 La6 N6 Si12 -","6","1","","William J. Evans; Thomas J. Mueller; Joseph W. Ziller","Reactivity of (C5Me5)3LaLx Complexes: Synthesis of a Tris(pentamethylcyclopentadienyl) Complex with Two Additional Ligands, (C5Me5)3La(NCCMe3)2","Journal of the American Chemical Society","2009","131","","2678","2686","10.1021/ja808763y","","","0.71073","MoKα","","0.034","0.0289","","","0.0718","0.0763","","","","","","1.098","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103946","13.4632","0.0017","41.393","0.005","14.2084","0.0017","90","","96.432","0.002","90","","7868.2","1.7","143","2","143","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C94 H96 B La O2 P2 -","- C94 H88 B La O2 P2 -","- C376 H352 B4 La4 O8 P8 -","4","0.5","","William J. Evans; Thomas J. Mueller; Joseph W. Ziller","Reactivity of (C5Me5)3LaLx Complexes: Synthesis of a Tris(pentamethylcyclopentadienyl) Complex with Two Additional Ligands, (C5Me5)3La(NCCMe3)2","Journal of the American Chemical Society","2009","131","","2678","2686","10.1021/ja808763y","","","0.71073","MoKα","","0.0644","0.0405","","","0.0866","0.0968","","","","","","1.048","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103947","19.1633","0.0006","17.5365","0.0005","12.9886","0.0004","90","","101.86","0.001","90","","4271.7","0.2","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H69 La N2 -","- C46 H69 La N2 -","- C184 H276 La4 N8 -","4","1","","William J. Evans; Thomas J. Mueller; Joseph W. Ziller","Reactivity of (C5Me5)3LaLx Complexes: Synthesis of a Tris(pentamethylcyclopentadienyl) Complex with Two Additional Ligands, (C5Me5)3La(NCCMe3)2","Journal of the American Chemical Society","2009","131","","2678","2686","10.1021/ja808763y","","","0.71073","MoKα","","0.0257","0.02","","","0.0484","0.0527","","","","","","1.072","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103948","9.9376","0.0006","11.339","0.0007","14.4297","0.0009","74.182","0.001","83.38","0.001","70.704","0.001","1475.95","0.16","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H45 La S2 -","- C31 H45 La S2 -","- C62 H90 La2 S4 -","2","1","","William J. Evans; Thomas J. Mueller; Joseph W. Ziller","Reactivity of (C5Me5)3LaLx Complexes: Synthesis of a Tris(pentamethylcyclopentadienyl) Complex with Two Additional Ligands, (C5Me5)3La(NCCMe3)2","Journal of the American Chemical Society","2009","131","","2678","2686","10.1021/ja808763y","","","0.71073","MoKα","","0.0328","0.0298","","","0.0739","0.0756","","","","","","1.045","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103949","13.2291","0.0008","14.6728","0.0009","15.5581","0.001","76.555","0.001","76.062","0.001","63.486","0.001","2595.5","0.3","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C57 H83 La N6 -","- C57 H83 La N6 -","- C114 H166 La2 N12 -","2","1","","William J. Evans; Thomas J. Mueller; Joseph W. Ziller","Reactivity of (C5Me5)3LaLx Complexes: Synthesis of a Tris(pentamethylcyclopentadienyl) Complex with Two Additional Ligands, (C5Me5)3La(NCCMe3)2","Journal of the American Chemical Society","2009","131","","2678","2686","10.1021/ja808763y","","","0.71073","MoKα","","0.039","0.0315","","","0.0794","0.0843","","","","","","1.044","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103950","12.0956","0.0019","12.0752","0.0019","31.142","0.005","90","","91.606","0.002","90","","4546.7","1.2","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H60 La O P S2 -","- C49 H60 La O P S2 -","- C196 H240 La4 O4 P4 S8 -","4","1","","William J. Evans; Thomas J. Mueller; Joseph W. Ziller","Reactivity of (C5Me5)3LaLx Complexes: Synthesis of a Tris(pentamethylcyclopentadienyl) Complex with Two Additional Ligands, (C5Me5)3La(NCCMe3)2","Journal of the American Chemical Society","2009","131","","2678","2686","10.1021/ja808763y","","","0.71073","MoKα","","0.0684","0.0503","","","0.1167","0.1243","","","","","","1.049","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103951","50.3695","0.0007","50.3695","0.0007","48.0517","0.0006","90","","90","","90","","121911","3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C296 H362 N24 Na20 O162 S16 -","- C290 H204 N24 Na20 O114.4 S16 -","- C2320 H1632 N192 Na160 O915.2 S128 -","8","0.5","","Rita De Zorzi; Nicol Guidolin; Lucio Randaccio; Roberto Purrello; Silvano Geremia","Nanoporous Crystals of Calixarene/Porphyrin Supramolecular Complex Functionalized by Diffusion and Coordination of Metal Ions","Journal of the American Chemical Society","2009","131","","2487","2489","10.1021/ja808850d","","","1","","","0.1379","0.1173","","","0.3237","0.3567","","","","","","1.001","","","","has coordinates,has disorder","289031","2024-01-11","08:35:40",""
"4103952","49.14","0.0007","49.14","0.0007","49.8","0.0006","90","","90","","90","","120254","3","100","2","100","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C276 H354 Cl4 N24 Na16 O168 S16 Zn4 -","- C276 H204 Cl4 N24 Na16 O112 S16 Zn4 -","- C2208 H1632 Cl32 N192 Na128 O896 S128 Zn32 -","8","0.5","","Rita De Zorzi; Nicol Guidolin; Lucio Randaccio; Roberto Purrello; Silvano Geremia","Nanoporous Crystals of Calixarene/Porphyrin Supramolecular Complex Functionalized by Diffusion and Coordination of Metal Ions","Journal of the American Chemical Society","2009","131","","2487","2489","10.1021/ja808850d","","","1","","","0.1214","0.0985","","","0.2575","0.2825","","","","","","0.996","","","","has coordinates","289031","2024-01-11","08:35:45",""
"4103953","49.646","0.014","49.646","0.014","50.592","0.006","90","","90","","90","","124695","5","100","2","100","2","","","","","","","","7","I 41/a m d :2","-I 4bd 2","141","","","","- C69 H62 N6 Na3 Ni O28.75 S4 -","- C69 N6 Na3 Ni O25 S4 -","- C2208 N192 Na96 Ni32 O800 S128 -","32","1","","Rita De Zorzi; Nicol Guidolin; Lucio Randaccio; Roberto Purrello; Silvano Geremia","Nanoporous Crystals of Calixarene/Porphyrin Supramolecular Complex Functionalized by Diffusion and Coordination of Metal Ions","Journal of the American Chemical Society","2009","131","","2487","2489","10.1021/ja808850d","","","1","","","0.2453","0.218","","","0.4991","0.5358","","","","","","1.916","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103954","9.67","0.0002","8.9639","0.0002","16.6568","0.0003","90","","90","","90","","1443.83","0.05","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H19 N O3 S -","- C15 H19 N O3 S -","- C60 H76 N4 O12 S4 -","4","1","","Aaron R. Thornton; Véronique I. Martin; Simon B. Blakey","π-Nucleophile Traps for Metallonitrene/Alkyne Cascade Reactions: A Versatile Process for the Synthesis of α-Aminocyclopropanes and β-Aminostyrenes","Journal of the American Chemical Society","2009","131","","2434","2435","10.1021/ja809078d","","","0.71073","MoKα","","0.0373","0.0346","","","0.0871","0.0895","","","","","","1.004","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103955","7.3266","0.0003","25.3593","0.0012","8.0363","0.0004","90","","106.307","0.003","90","","1433.06","0.12","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 N O3 S -","- C15 H19 N O3 S -","- C60 H76 N4 O12 S4 -","4","1","","Aaron R. Thornton; Véronique I. Martin; Simon B. Blakey","π-Nucleophile Traps for Metallonitrene/Alkyne Cascade Reactions: A Versatile Process for the Synthesis of α-Aminocyclopropanes and β-Aminostyrenes","Journal of the American Chemical Society","2009","131","","2434","2435","10.1021/ja809078d","","","1.54178","CuKα","","0.04","0.0345","","","0.1101","0.1145","","","","","","1.068","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103956","8.3469","0.0004","14.3509","0.0007","10.0116","0.0005","90","","90.293","0.001","90","","1199.23","0.1","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 O3 -","- C13 H18 O3 -","- C52 H72 O12 -","4","1","","Rockford W. Coscia; Tristan H. Lambert","Development of a Formal [4 + 1] Cycloaddition: Pd(OAc)2-Catalyzed Intramolecular Cyclopropanation of 1,3-Dienyl β-Keto Esters and MgI2-Promoted Vinylcyclopropane-Cyclopentene Rearrangement","Journal of the American Chemical Society","2009","131","","2496","2498","10.1021/ja809226x","","","0.71073","MoKα","","0.0395","0.0361","","","0.1035","0.107","","","","","","1.042","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103957","11.783","0.004","13.808","0.005","14.15","0.005","61.399","0.008","73.84","0.008","76.439","0.007","1927.4","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H96 Cl8 Fe2 N10 O2 -","- C76 H96 Cl8 Fe2 N10 O2 -","- C76 H96 Cl8 Fe2 N10 O2 -","1","0.5","","Nan Xu; Adam L. O. Campbell; Douglas R. Powell; Jana Khandogin; George B. Richter-Addo","A Stable Hyponitrite-Bridged Iron Porphyrin Complex","Journal of the American Chemical Society","2009","131","","2460","2461","10.1021/ja809781r","","","0.71073","MoKα","","0.0504","0.0403","","","0.1056","0.1114","","","","","","1.013","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103958","30.984","0.0002","30.984","0.0002","30.984","0.0002","90","","90","","90","","29744.9","0.3","296","2","296","2","","","","","","","","6","I m -3 m","-I 4 2 3","229","","","","- C20 H16 In2 Mg N8 O22 -","- C20 H4 In2 Mg N8 O22 -","- C480 H96 In48 Mg24 N192 O528 -","24","0.25","","Farid Nouar; Juergen Eckert; Jarrod F. Eubank; Paul Forster; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) as Hydrogen Storage Platform: Lithium and Magnesium Ion-Exchange and H2-(rho-ZMOF) Interaction Studies","Journal of the American Chemical Society","2009","131","","2864","2870","10.1021/ja807229a","","","0.7749","Synchrotronx-ray","","0.0622","0.0543","","","0.1846","0.1944","","","","","","1.097","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103959","9.6382","0.0007","9.6449","0.0007","10.922","0.0007","103.46","0.001","100.068","0.001","93.397","0.001","966.9","0.12","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C35 H59 N5 O10 -","- C34 H53 N5 O8 -","- C34 H53 N5 O8 -","1","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0437","0.0429","","","0.1131","0.1141","","","","","","1.029","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103960","8.5572","0.001","27.653","0.003","36.266","0.004","90","","90","","90","","8581.7","1.7","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C40 H62 N6 O9 -","- C40 H62 N6 O9 -","- C320 H496 N48 O72 -","8","2","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0851","0.0559","","","0.1127","0.1228","","","","","","1.083","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4103961","21.942","0.002","25.008","0.003","10.216","0.0011","90","","90","","90","","5605.8","1","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C49 H74 Br Cl3 N8 O11 -","- C49 H74 Br Cl3 N8 O11 -","- C196 H296 Br4 Cl12 N32 O44 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0771","0.0705","","","0.2071","0.2144","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4103962","10.394","0.0007","33.58","0.002","21.7313","0.0015","90","","91.667","0.001","90","","7581.7","0.9","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C63 H96 Br Cl6 N11 O14 -","- C60.997 H93.994 Br N11 O14 -","- C243.988 H375.976 Br4 N44 O56 -","4","2","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.1003","0.0883","","","0.2418","0.2515","","","","","","1.036","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103963","18.5023","0.001","18.5023","0.001","32.418","0.004","90","","90","","120","","9611","1.4","100","2","100","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C49 H67 Br N6 O9 -","- C49 H67 Br N6 O9 -","- C294 H402 Br6 N36 O54 -","6","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0853","0.0782","","","0.2047","0.2105","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4103964","17.5704","0.0013","19.5584","0.0014","26.6849","0.0019","90","","90","","90","","9170.2","1.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C44.5 H68 N6 O9.5 -","- C44.5 H68 N6 O9.5 -","- C356 H544 N48 O76 -","8","2","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","MoKα","","0.0865","0.0541","","","0.1262","0.1435","","","","","","1.034","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4103965","12.226","0.003","10.535","0.003","20.547","0.005","90","","96.332","0.004","90","","2630.3","1.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C50 H77.5 Br N7 O10.75 -","- C47 H70 Br N7 O10 -","- C94 H140 Br2 N14 O20 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.1015","0.0709","","","0.1715","0.1863","","","","","","1.038","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103966","10.3917","0.0003","19.5378","0.0005","17.2657","0.0004","90","","96.8006","0.0004","90","","3480.81","0.16","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C66 H103 Br N10 O14 -","- C66 H103 Br N10 O14 -","- C132 H206 Br2 N20 O28 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0368","0.0352","","","0.0943","0.096","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4103967","11.2597","0.0016","18.861","0.003","18.883","0.003","90","","92.079","0.002","90","","4007.5","1.1","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C65.19 H97.19 Br Cl6.57 N10 O13 -","- C65.19 H97.19 Br Cl6.57 N10 O13 -","- C130.38 H194.38 Br2 Cl13.14 N20 O26 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0799","0.076","","","0.2117","0.2173","","","","","","1.124","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103968","18.2435","0.0011","10.1114","0.0006","21.7817","0.0014","90","","112.287","0.001","90","","3717.8","0.4","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C67 H109 Br N10 O16 -","- C67 H109 Br N10 O16 -","- C134 H218 Br2 N20 O32 -","2","1","","Soo Hyuk Choi; Ilia A. Guzei; Lara C. Spencer; Samuel H. Gellman","Crystallographic Characterization of Helical Secondary Structures in 2:1 and 1:2 α/β-Peptides","Journal of the American Chemical Society","2009","131","","2917","2924","10.1021/ja808168y","","","0.71073","Mo-Kα","","0.0493","0.0462","","","0.1319","0.1346","","","","","","1.007","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103969","14.3116","0.0016","14.3116","0.0016","13.612","0.002","90","","90","","120","","2414.5","0.5","183","2","183","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C48 H66 Ca2 O6 -","- C48 H66 Ca2 O6 -","- C96 H132 Ca4 O12 -","2","0.166667","","Sven Krieck; Helmar Görls; Lian Yu; Markus Reiher; Matthias Westerhausen","Stable ""Inverse"" Sandwich Complex with Unprecedented Organocalcium(I): Crystal Structures of [(thf)2Mg(Br)-C6H2-2,4,6-Ph3] and [(thf)3Ca{μ-C6H3-1,3,5-Ph3}Ca(thf)3]","Journal of the American Chemical Society","2009","131","","2977","2985","10.1021/ja808524y","","","0.71073","MoKα","","0.1435","0.1057","","","0.2877","0.3328","","","","","","1.07","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103970","8.7189","0.0002","20.6162","0.0005","30.8439","0.0006","90","","90","","90","","5544.2","0.2","183","2","183","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H33 Br Mg O2 -","- C32 H33 Br Mg O2 -","- C256 H264 Br8 Mg8 O16 -","8","1","","Sven Krieck; Helmar Görls; Lian Yu; Markus Reiher; Matthias Westerhausen","Stable ""Inverse"" Sandwich Complex with Unprecedented Organocalcium(I): Crystal Structures of [(thf)2Mg(Br)-C6H2-2,4,6-Ph3] and [(thf)3Ca{μ-C6H3-1,3,5-Ph3}Ca(thf)3]","Journal of the American Chemical Society","2009","131","","2977","2985","10.1021/ja808524y","","","0.71073","MoKα","","0.096","0.0456","","","0.0859","0.1014","","","","","","1.004","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4103971","11.285","0.002","10.405","0.003","13.546","0.002","90","","96.39","0.01","90","","1580.7","0.6","296.2","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 -","- C22 H22 -","- C88 H88 -","4","1","","Yoshikazu Horino; Takuya Yamamoto; Kohki Ueda; Shigeyasu Kuroda; F. Dean Toste","Au(I)-Catalyzed Cycloisomerizations Terminated by sp3 C-H Bond Insertion","Journal of the American Chemical Society","2009","131","","2809","2811","10.1021/ja808780r","","","0.7107","MoKα","","","0.0533","","","","0.1276","","","","","","1.398","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103972","25.078","0.003","7.7656","0.0012","11.962","0.002","90","","90","","90","","2329.5","0.6","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C10 H20 Cl O2 P -","- C10 H20 Cl O2 P -","- C80 H160 Cl8 O16 P8 -","8","2","","Monica Carreira; Manutsavin Charernsuk; Michael Eberhard; Natalie Fey; Roel van Ginkel; Alex Hamilton; Wilhelmus P. Mul; A. Guy Orpen; Hirihataya Phetmung; Paul G. Pringle","Anatomy of Phobanes. Diastereoselective Synthesis of the Three Isomers of n-Butylphobane and a Comparison of their Donor Properties","Journal of the American Chemical Society","2009","131","","3078","3092","10.1021/ja808807s","","","0.71073","MoKα","","0.0542","0.0464","","","0.1065","0.1128","","","","","","1.05","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103973","7.7585","0.0016","7.8401","0.0016","11.023","0.002","96.88","0.03","102.46","0.03","97.12","0.03","642.2","0.2","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H46 Cl2 P2 Pt -","- C24 H46 Cl2 P2 Pt1.0001 -","- C24 H46 Cl2 P2 Pt1.0001 -","1","0.5","","Monica Carreira; Manutsavin Charernsuk; Michael Eberhard; Natalie Fey; Roel van Ginkel; Alex Hamilton; Wilhelmus P. Mul; A. Guy Orpen; Hirihataya Phetmung; Paul G. Pringle","Anatomy of Phobanes. Diastereoselective Synthesis of the Three Isomers of n-Butylphobane and a Comparison of their Donor Properties","Journal of the American Chemical Society","2009","131","","3078","3092","10.1021/ja808807s","","x-ray","0.71074","MoKα","","0.0148","0.0148","","","0.0367","0.0367","","","","","","1.088","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103974","19.0791","0.001","8.1201","0.0003","19.1417","0.001","90","","116.866","0.002","90","","2645.4","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H46 Cl2 P2 Pt -","- C24 H46 Cl2 P2 Pt -","- C96 H184 Cl8 P8 Pt4 -","4","1","","Monica Carreira; Manutsavin Charernsuk; Michael Eberhard; Natalie Fey; Roel van Ginkel; Alex Hamilton; Wilhelmus P. Mul; A. Guy Orpen; Hirihataya Phetmung; Paul G. Pringle","Anatomy of Phobanes. Diastereoselective Synthesis of the Three Isomers of n-Butylphobane and a Comparison of their Donor Properties","Journal of the American Chemical Society","2009","131","","3078","3092","10.1021/ja808807s","","","0.71073","MoKα","","0.1064","0.0683","","","0.1203","0.1386","","","","","","1.131","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103975","11.2515","0.0006","14.1812","0.0004","14.6186","0.0005","82.687","0.026","70.963","0.035","76.951","0.034","2144.4","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H32 Cl2 O2 P2 Pt -","- C18 H31 Cl2 O2 P2 Pt -","- C72 H124 Cl8 O8 P8 Pt4 -","4","2","","Monica Carreira; Manutsavin Charernsuk; Michael Eberhard; Natalie Fey; Roel van Ginkel; Alex Hamilton; Wilhelmus P. Mul; A. Guy Orpen; Hirihataya Phetmung; Paul G. Pringle","Anatomy of Phobanes. Diastereoselective Synthesis of the Three Isomers of n-Butylphobane and a Comparison of their Donor Properties","Journal of the American Chemical Society","2009","131","","3078","3092","10.1021/ja808807s","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103976","15.511","0.002","11.7916","0.0016","11.173","0.0009","90","","97.031","0.009","90","","2028.2","0.4","250","2","250","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 N O4 -","- C22 H25 N O4 -","- C88 H100 N4 O16 -","4","1","","Gilles Lemière; Vincent Gandon; Kevin Cariou; Alexandra Hours; Takahide Fukuyama; Anne-Lise Dhimane; Louis Fensterbank; Max Malacria","Generation and Trapping of Cyclopentenylidene Gold Species: Four Pathways to Polycyclic Compounds","Journal of the American Chemical Society","2009","131","","2993","3006","10.1021/ja808872u","","","0.71073","MoKα","","0.1408","0.057","","","0.1444","0.1837","","","","","","1.016","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103977","7.2997","0.0009","11.4574","0.0018","13.348","0.002","107.252","0.011","92.656","0.011","99.208","0.012","1047.2","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H36 O2 Si -","- C20 H36 O2 Si -","- C40 H72 O4 Si2 -","2","1","","Gilles Lemière; Vincent Gandon; Kevin Cariou; Alexandra Hours; Takahide Fukuyama; Anne-Lise Dhimane; Louis Fensterbank; Max Malacria","Generation and Trapping of Cyclopentenylidene Gold Species: Four Pathways to Polycyclic Compounds","Journal of the American Chemical Society","2009","131","","2993","3006","10.1021/ja808872u","","","","","","","","","","","","","","","","","","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103978","11.2235","0.0019","7.0509","0.0004","22.37","0.003","90","","91.015","0.012","90","","1770","0.4","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N O4 -","- C19 H21 N O4 -","- C76 H84 N4 O16 -","4","1","","Gilles Lemière; Vincent Gandon; Kevin Cariou; Alexandra Hours; Takahide Fukuyama; Anne-Lise Dhimane; Louis Fensterbank; Max Malacria","Generation and Trapping of Cyclopentenylidene Gold Species: Four Pathways to Polycyclic Compounds","Journal of the American Chemical Society","2009","131","","2993","3006","10.1021/ja808872u","","","","","","","","","","","","","","","","","","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103979","14.028","0.003","14.204","0.003","18.556","0.004","90","","90","","90","","3697.4","1.4","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","08045m","","","- C12 H24 Cu F3 N4 O3 S -","- C12 H24 Cu F3 N4 O3 S -","- C96 H192 Cu8 F24 N32 O24 S8 -","8","1","","Itsik Bar-Nahum; Aalo K. Gupta; Stefan M. Huber; Mehmed Z. Ertem; Christopher J. Cramer; William B. Tolman","Reduction of Nitrous Oxide to Dinitrogen by a Mixed Valent Tricopper-Disulfido Cluster","Journal of the American Chemical Society","2009","131","","2812","2814","10.1021/ja808917k","","","0.71073","MoKα","","0.0754","0.0386","","","0.082","0.1003","","","","","","1.091","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103980","8.696","0.002","8.497","0.002","22.674","0.006","90","","92.565","0.004","90","","1673.7","0.7","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","08036","","","- C20 H42 Cu2 F6 N6 O6 S4 -","- C20 H42 Cu2 F6 N6 O6 S4 -","- C40 H84 Cu4 F12 N12 O12 S8 -","2","0.5","","Itsik Bar-Nahum; Aalo K. Gupta; Stefan M. Huber; Mehmed Z. Ertem; Christopher J. Cramer; William B. Tolman","Reduction of Nitrous Oxide to Dinitrogen by a Mixed Valent Tricopper-Disulfido Cluster","Journal of the American Chemical Society","2009","131","","2812","2814","10.1021/ja808917k","","","0.71073","MoKα","","0.085","0.0623","","","0.127","0.1361","","","","","","1.008","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103981","23.7547","0.0009","12.9647","0.0005","29.9129","0.0011","90","","96.992","0.001","90","","9143.8","0.6","173","2","173","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","08016","","","- C29 H63 Cu3 F6 N9 O6 S4 -","- C29 H63 Cu3 F6 N9 O6 S4 -","- C232 H504 Cu24 F48 N72 O48 S32 -","8","1","","Itsik Bar-Nahum; Aalo K. Gupta; Stefan M. Huber; Mehmed Z. Ertem; Christopher J. Cramer; William B. Tolman","Reduction of Nitrous Oxide to Dinitrogen by a Mixed Valent Tricopper-Disulfido Cluster","Journal of the American Chemical Society","2009","131","","2812","2814","10.1021/ja808917k","","","0.71073","MoKα","","0.0571","0.0353","","","0.0768","0.0884","","","","","","1.04","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103982","18.623","0.003","36.669","0.006","26.997","0.005","90","","107.203","0.002","90","","17611","5","80","2","80","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C114 H224 N46 Ni2 O74 Pd6 -","- C114 H156 N46 Ni2 O74 Pd6 -","- C456 H624 N184 Ni8 O296 Pd24 -","4","1","","Kosuke Ono; Michito Yoshizawa; Munetaka Akita; Tatsuhisa Kato; Yoshihide Tsunobuchi; Shin-ichi Ohkoshi; Makoto Fujita","Spin Crossover by Encapsulation","Journal of the American Chemical Society","2009","131","","2782","2783","10.1021/ja8089894","","","0.71073","MoKα","","0.0897","0.0505","","","0.1259","0.1475","","","","","","1.033","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103983","10.8568","0.0014","18.625","0.003","40.746","0.018","90","","90","","90","","8239","4","295","2","295","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C5 H9 Au N2 Sn -","- C5 H9 Au N2 Sn -","- C160 H288 Au32 N64 Sn32 -","32","2","","Andrea Deák; Tünde Tunyogi; Gábor Pálinkás","Synthesis and Structure of a Cyanoaurate-Based Organotin Polymer Exhibiting Unusual Ion-Exchange Properties","Journal of the American Chemical Society","2009","131","","2815","2817","10.1021/ja809067t","","","0.71073","MoKα","","0.0501","0.045","","","0.0922","0.0951","","","","","","1.179","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103984","18.206","0.014","11.118","0.008","6.579","0.004","90","","111.09","0.03","90","","1242.5","1.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H6 Au2 N4 Sn -","- C6 H6 Au2 N4 Sn -","- C24 H24 Au8 N16 Sn4 -","4","0.5","","Andrea Deák; Tünde Tunyogi; Gábor Pálinkás","Synthesis and Structure of a Cyanoaurate-Based Organotin Polymer Exhibiting Unusual Ion-Exchange Properties","Journal of the American Chemical Society","2009","131","","2815","2817","10.1021/ja809067t","","","0.7107","MoKα","","0.0393","0.0353","","","0.0796","0.0817","","","","","","1.053","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103985","10.221","0.003","16.359","0.005","13.852","0.004","90","","105.126","0.008","90","","2235.9","1.1","113.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 Cu F6 N3 P -","- C21 H28 Cu F6 N3 P -","- C84 H112 Cu4 F24 N12 P4 -","4","1","","Atsushi Kunishita; Minoru Kubo; Hideki Sugimoto; Takashi Ogura; Kazunobu Sato; Takeji Takui; Shinobu Itoh","Mononuclear Copper(II)-Superoxo Complexes that Mimic the Structure and Reactivity of the Active Centers of PHM and DβM","Journal of the American Chemical Society","2009","131","","2788","2789","10.1021/ja809464e","","","0.7107","MoKα","","","0.0671","","","","0.108","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103986","25.807","0.003","7.3456","0.0005","29.453","0.003","90","","111.978","0.004","90","","5177.6","0.9","113.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C23 H32 Cu F6 N4 O2.5 P -","- C23 H32 Cu F6 N4 O2.5 P -","- C184 H256 Cu8 F48 N32 O20 P8 -","8","1","","Atsushi Kunishita; Minoru Kubo; Hideki Sugimoto; Takashi Ogura; Kazunobu Sato; Takeji Takui; Shinobu Itoh","Mononuclear Copper(II)-Superoxo Complexes that Mimic the Structure and Reactivity of the Active Centers of PHM and DβM","Journal of the American Chemical Society","2009","131","","2788","2789","10.1021/ja809464e","","","0.7107","MoKα","","","0.0684","","","","0.0747","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103987","10.163","0.014","17.316","0.016","14.633","0.015","90","","110.49","0.04","90","","2412","5","153.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H31 Cu F6 N3 O P -","- C22 H31 Cu F6 N3 O P -","- C88 H124 Cu4 F24 N12 O4 P4 -","4","1","","Atsushi Kunishita; Minoru Kubo; Hideki Sugimoto; Takashi Ogura; Kazunobu Sato; Takeji Takui; Shinobu Itoh","Mononuclear Copper(II)-Superoxo Complexes that Mimic the Structure and Reactivity of the Active Centers of PHM and DβM","Journal of the American Chemical Society","2009","131","","2788","2789","10.1021/ja809464e","","","0.71075","MoKα","","","0.0496","","","","0.0519","","","","","","0.965","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103988","9.235","0.008","11.661","0.012","12.165","0.009","84.78","0.03","71.72","0.03","78.39","0.03","1217.9","1.9","153.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C21 H28 Cl Cu F6 N4 O2 P -","- C21 H26 Cl Cu F6 N4 O2 P -","- C42 H52 Cl2 Cu2 F12 N8 O4 P2 -","2","1","","Atsushi Kunishita; Minoru Kubo; Hideki Sugimoto; Takashi Ogura; Kazunobu Sato; Takeji Takui; Shinobu Itoh","Mononuclear Copper(II)-Superoxo Complexes that Mimic the Structure and Reactivity of the Active Centers of PHM and DβM","Journal of the American Chemical Society","2009","131","","2788","2789","10.1021/ja809464e","","","0.71075","MoKα","","","0.0428","","","","0.0567","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103989","10.327","0.009","10.895","0.011","12.985","0.011","84.88","0.03","73.51","0.03","71.53","0.03","1329","2","153.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C24 H32 Cl Cu F6 N4 O4 P -","- C23 H31 Cu F6 N4 O4 P -","- C46 H62 Cu2 F12 N8 O8 P2 -","2","1","","Atsushi Kunishita; Minoru Kubo; Hideki Sugimoto; Takashi Ogura; Kazunobu Sato; Takeji Takui; Shinobu Itoh","Mononuclear Copper(II)-Superoxo Complexes that Mimic the Structure and Reactivity of the Active Centers of PHM and DβM","Journal of the American Chemical Society","2009","131","","2788","2789","10.1021/ja809464e","","","0.71075","MoKα","","","0.0393","","","","0.0442","","","","","","0.954","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103990","8.982","0.006","16.187","0.011","12.881","0.009","90","0.004","92.017","0.004","90","0.004","1872","2","113","2","113","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C26 H18 N2 O -","- C26 H18 N2 O -","- C104 H72 N8 O4 -","4","1","","Takuya Kochi; Seiya Urano; Hajime Seki; Eiichiro Mizushima; Mitsuo Sato; Fumitoshi Kakiuchi","Ruthenium-Catalyzed Amino- and Alkoxycarbonylations with Carbamoyl Chlorides and Alkyl Chloroformates via Aromatic C-H Bond Cleavage","Journal of the American Chemical Society","2009","131","","2792","2793","10.1021/ja8097492","","","0.7107","MoKα","","0.0369","0.0344","","","0.0834","0.0853","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4103991","15.626","0.002","5.4881","0.0007","19.506","0.003","90","","96.142","0.002","90","","1663.2","0.4","149","2","149","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C46 H24 F6 -","- C46 H24 F6 -","- C92 H48 F12 -","2","0.5","","Zerubba U. Levi; T. Don Tilley","Versatile Synthesis of Pentalene Derivatives via the Pd-Catalyzed Homocoupling of Haloenynes","Journal of the American Chemical Society","2009","131","","2796","2797","10.1021/ja809930f","","","0.71073","MoKα","","0.083","0.0351","","","0.0517","0.0559","","","","","","0.692","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103992","21.051","0.002","19.381","0.002","9.0189","0.0009","90","","90","","90","","3679.6","0.6","150","2","150","2","","","","","","","","2","P b c n","-P 2n 2ab","60","tilley01","ZL141a","","- C50 H42 -","- C50 H42 -","- C200 H168 -","4","0.5","","Zerubba U. Levi; T. Don Tilley","Versatile Synthesis of Pentalene Derivatives via the Pd-Catalyzed Homocoupling of Haloenynes","Journal of the American Chemical Society","2009","131","","2796","2797","10.1021/ja809930f","","","0.7749","synchrotron","","0.0559","0.0456","","","0.1221","0.1311","","","","","","1.036","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4103993","14.4014","0.0001","15.7227","0.0001","21.6608","0.0002","93.2587","0.0003","100.404","0.0003","107.279","0.0004","4574.28","0.06","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","[K-(2,2,2-crypt)]3[Fe@Ge10]*2en","","- C58 H124 Fe Ge10 K3 N10 O18 -","- C58 H124.04 Fe Ge10 K3 N10 O18 -","- C116 H248.08 Fe2 Ge20 K6 N20 O36 -","2","1","","Binbin Zhou; Mark S. Denning; Deborah L. Kays; Jose M. Goicoechea","Synthesis and Isolation of [Fe@Ge10]3-: A Pentagonal Prismatic Zintl Ion Cage Encapsulating an Interstitial Iron Atom","Journal of the American Chemical Society","2009","131","","2802","2803","10.1021/ja900055j","","","0.71073","MoKα","","0.0572","0.0438","","","0.1188","0.1256","","","","","","1.047","","","","has coordinates,has disorder","178785","2020-10-21","18:00:00",""
"4103994","9.8","0.003","9.819","0.003","21.005","0.008","79.398","0.011","80.237","0.011","79.763","0.012","1935.4","1.1","150","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H18 F3 N O2 -","- C24 H18 F3 N O2 -","- C96 H72 F12 N4 O8 -","4","2","","Itaru Nakamura; Toshiharu Araki; Masahiro Terada","Five-Bond Cleavage in Copper-Catalyzed Skeletal Rearrangement of O-Propargyl Arylaldoximes to β-Lactams","Journal of the American Chemical Society","2009","131","","2804","2805","10.1021/ja900133m","","","0.7107","MoKα","","","0.0932","","","","0.2926","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103995","26.181","0.008","17.048","0.006","14.967","0.005","90","","90.074","0.005","90","","6680","4","198","2","198","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C64 H74 F6 Ir2 N4 O11 S4 -","- C64 H74 F6 Ir2 N4 O11 S4 -","- C256 H296 F24 Ir8 N16 O44 S16 -","4","1","","Zachariah M. Heiden; Thomas B. Rauchfuss","Proton-Assisted Activation of Dihydrogen: Mechanistic Aspects of Proton-Catalyzed Addition of H2 to Ru and Ir Amido Complexes","Journal of the American Chemical Society","2009","131","","3593","3600","10.1021/ja807277s","","","0.71073","MoKα","","0.0977","0.0624","","","0.1537","0.1653","","","","","","1.077","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4103996","13.178","0.002","9.9503","0.0012","19.912","0.003","90","","101.548","0.013","90","","2558.1","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H37 Cu F6 N4 O2 P -","- C22 H37 Cu F6 N4 O2 P -","- C88 H148 Cu4 F24 N16 O8 P4 -","4","1","","Abid Khan; Gary Nicholson; John Greenman; Leigh Madden; Graeme McRobbie; Christophe Pannecouque; Erik De Clercq; Robert Ullom; Danny L. Maples; Randall D. Maples; Jon D. Silversides; Timothy J. Hubin; Stephen J. Archibald","Binding Optimization through Coordination Chemistry: CXCR4 Chemokine Receptor Antagonists from Ultrarigid Metal Complexes","Journal of the American Chemical Society","2009","131","","3416","3417","10.1021/ja807921k","","","0.71073","MoKα","","0.1239","0.0416","","","0.0633","0.0755","","","","","","0.736","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103997","14.716","0.0002","9.741","0.0001","20.998","0.0003","90","","90","","90","","3010.03","0.07","293","","293","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H9 F3 I2 O -","- C14 H9 F3 I2 O -","- C112 H72 F24 I16 O8 -","8","2","","Shiro Matsukawa; Hideaki Yamamichi; Yohsuke Yamamoto; Kaori Ando","Pentacoordinate Organoantimony Compounds That Isomerize by Turnstile Rotation","Journal of the American Chemical Society","2009","131","","3418","3419","10.1021/ja808113q","","","0.71069","MoKα","","0.0452","0.0395","","","0.1193","0.1343","","","","","","1.171","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103998","8.865","0.0002","7.839","0.0001","28.107","0.0007","90","","94.973","0.001","90","","1945.88","0.07","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 Cl F3 O Sb -","- C22 H17 Cl F3 O Sb -","- C88 H68 Cl4 F12 O4 Sb4 -","4","1","","Shiro Matsukawa; Hideaki Yamamichi; Yohsuke Yamamoto; Kaori Ando","Pentacoordinate Organoantimony Compounds That Isomerize by Turnstile Rotation","Journal of the American Chemical Society","2009","131","","3418","3419","10.1021/ja808113q","","","0.71069","MoKα","","0.0474","0.0419","","","0.1134","0.1282","","","","","","1.121","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4103999","8.418","0.0002","10.079","0.0002","14.748","0.0004","96.205","0.001","100.733","0.001","93.319","0.001","1218.3","0.05","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H21 Cl F3 O Sb -","- C28 H21 Cl F3 O Sb -","- C56 H42 Cl2 F6 O2 Sb2 -","2","1","","Shiro Matsukawa; Hideaki Yamamichi; Yohsuke Yamamoto; Kaori Ando","Pentacoordinate Organoantimony Compounds That Isomerize by Turnstile Rotation","Journal of the American Chemical Society","2009","131","","3418","3419","10.1021/ja808113q","","","0.71069","MoKα","","0.0397","0.0384","","","0.1029","0.1038","","","","","","1.096","","","","has coordinates","178785","2020-10-21","18:00:00",""
"4104000","11.965","0.0006","13.375","0.0007","16.849","0.0008","100.104","0.002","104.778","0.002","101.806","0.002","2477.1","0.2","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H21 Cl F3 O Sb -","- C28 H21 Cl F3 O Sb -","- C112 H84 Cl4 F12 O4 Sb4 -","4","2","","Shiro Matsukawa; Hideaki Yamamichi; Yohsuke Yamamoto; Kaori Ando","Pentacoordinate Organoantimony Compounds That Isomerize by Turnstile Rotation","Journal of the American Chemical Society","2009","131","","3418","3419","10.1021/ja808113q","","","0.71069","MoKα","","0.1562","0.0811","","","0.2043","0.2409","","","","","","1.114","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104001","3.7551","0.0005","11.2066","0.0013","27.322","0.003","90","","92.947","0.007","90","","1148.2","0.2","180","","180","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 N2 O4 -","- C14 H10 N2 O4 -","- C56 H40 N8 O16 -","4","1","","David M. S. Martins; Derek S. Middlemiss; Colin R. Pulham; Chick C. Wilson; Mark T. Weller; Paul F. Henry; Norman Shankland; Kenneth Shankland; William G. Marshall; Richard M. Ibberson; Kevin Knight; Stephen Moggach; Michela Brunelli; Carole A. Morrison","Temperature- and Pressure-Induced Proton Transfer in the 1:1 Adduct Formed between Squaric Acid and 4,4'-Bipyridine","Journal of the American Chemical Society","2009","131","","3884","3893","10.1021/ja8082973","","","0.71073","MoKα","","0.0524","0.042","","0.113","0.1064","0.113","","","","","","1.0145","","","","has coordinates,has Fobs","201982","2020-10-21","18:00:00",""
"4104002","3.7975","0.0001","11.1996","0.0003","27.4424","0.0007","90","","92.236","0.002","90","","1166.25","0.05","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 N2 O4 -","- C14 H10 N2 O4 -","- C56 H40 N8 O16 -","4","1","","David M. S. Martins; Derek S. Middlemiss; Colin R. Pulham; Chick C. Wilson; Mark T. Weller; Paul F. Henry; Norman Shankland; Kenneth Shankland; William G. Marshall; Richard M. Ibberson; Kevin Knight; Stephen Moggach; Michela Brunelli; Carole A. Morrison","Temperature- and Pressure-Induced Proton Transfer in the 1:1 Adduct Formed between Squaric Acid and 4,4'-Bipyridine","Journal of the American Chemical Society","2009","131","","3884","3893","10.1021/ja8082973","","","0.71073","MoKα","","0.0501","0.0449","","0.1064","0.1035","0.1064","","","","","","1.0528","","","","has coordinates,has Fobs","201982","2020-10-21","18:00:00",""
"4104003","12.359","0.008","11.287","0.007","9.061","0.006","90","","109.139","0.01","90","","1194.1","1.3","453","","453","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 N2 O4 -","- C14 H8 N2 O4 -","- C56 H32 N8 O16 -","4","0.5","","David M. S. Martins; Derek S. Middlemiss; Colin R. Pulham; Chick C. Wilson; Mark T. Weller; Paul F. Henry; Norman Shankland; Kenneth Shankland; William G. Marshall; Richard M. Ibberson; Kevin Knight; Stephen Moggach; Michela Brunelli; Carole A. Morrison","Temperature- and Pressure-Induced Proton Transfer in the 1:1 Adduct Formed between Squaric Acid and 4,4'-Bipyridine","Journal of the American Chemical Society","2009","131","","3884","3893","10.1021/ja8082973","","","0.71073","MoKα","","0.1031","0.0665","","0.1841","0.1671","0.1841","","","","","","1.0152","","","","has coordinates,has Fobs","178786","2020-10-21","18:00:00",""
"4104004","10.6478","0.0003","16.6197","0.0004","26.3441","0.0004","90","","90","","90","","4661.94","0.19","150","1","150","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H15 Cl6 N2 P3 -","- C18 H15 Cl6 N2 P3 -","- C144 H120 Cl48 N16 P24 -","8","1","","Vivienne Blackstone; Alan J. Lough; Martin Murray; Ian Manners","Probing the Mechanism of the PCl5-Initiated Living Cationic Polymerization of the Phosphoranimine Cl3P=NSiMe3 using Model Compound Chemistry","Journal of the American Chemical Society","2009","131","","3658","3667","10.1021/ja808517d","","","0.71073","MoKα","","0.0888","0.0459","","","0.1015","0.1218","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104005","11.3728","0.0004","17.6718","0.0007","13.0181","0.0003","90","","107.735","0.002","90","","2492.01","0.15","150","1","150","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H32 Cl12 N3 P5 -","- C37 H32 Cl12 N3 P5 -","- C74 H64 Cl24 N6 P10 -","2","1","","Vivienne Blackstone; Alan J. Lough; Martin Murray; Ian Manners","Probing the Mechanism of the PCl5-Initiated Living Cationic Polymerization of the Phosphoranimine Cl3P=NSiMe3 using Model Compound Chemistry","Journal of the American Chemical Society","2009","131","","3658","3667","10.1021/ja808517d","","","0.71073","MoKα","","0.1052","0.0723","","","0.1921","0.2165","","","","","","1.036","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104006","18.0588","0.0003","7.7422","0.0001","29.3146","0.0004","90","","103.245","0.0009","90","","3989.59","0.1","150","1","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 Cl8 N2 P4 -","- C36 H30 Cl8 N2 P4 -","- C144 H120 Cl32 N8 P16 -","4","1","","Vivienne Blackstone; Alan J. Lough; Martin Murray; Ian Manners","Probing the Mechanism of the PCl5-Initiated Living Cationic Polymerization of the Phosphoranimine Cl3P=NSiMe3 using Model Compound Chemistry","Journal of the American Chemical Society","2009","131","","3658","3667","10.1021/ja808517d","","","0.71073","MoKα","","0.0886","0.0424","","","0.099","0.117","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104007","27.423","","6.004","","20.005","","90","","109.79","","90","","3099.25","","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(RS)-tert-butyl 2-oxo-1,2-dihydrospiro[benzo[d][1,3]oxazine-4,3'-pyrrolidine] -1'-carboxylate","","- C16 H20 N2 O4 -","- C16 H20 N2 O4 -","- C128 H160 N16 O32 -","8","1","","K. C. Nicolaou; Arkady Krasovskiy; Utpal Majumder; Vincent É. Trépanier; David Y.-K. Chen","New Synthetic Technologies for the Construction of Heterocycles and Tryptamines","Journal of the American Chemical Society","2009","131","","3690","3699","10.1021/ja808692j","","x-ray","0.7107","MoKα","","0.1604","0.1128","","","0.2364","0.3274","","","","","","0.941","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104008","9.91","0.0009","10.54","0.0005","17.14","0.0012","90","","106.04","0.004","90","","1720.6","0.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 N2 O4 -","- C17 H22 N2 O4 -","- C68 H88 N8 O16 -","4","1","","K. C. Nicolaou; Arkady Krasovskiy; Utpal Majumder; Vincent É. Trépanier; David Y.-K. Chen","New Synthetic Technologies for the Construction of Heterocycles and Tryptamines","Journal of the American Chemical Society","2009","131","","3690","3699","10.1021/ja808692j","","x-ray","0.7107","MoKα","","0.1159","0.0743","","","0.1578","0.183","","","","","","0.998","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104009","9.331","0.002","16.104","0.003","10.041","0.002","90","","97.237","0.014","90","","1496.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","tert-butyl 4-(2-aminophenyl)-2,3-dihydro-1H-pyrrole-1-carboxylate","","- C15 H20 N2 O2 -","- C15 H20 N1.97 O2 -","- C60 H80 N7.88 O8 -","4","1","","K. C. Nicolaou; Arkady Krasovskiy; Utpal Majumder; Vincent É. Trépanier; David Y.-K. Chen","New Synthetic Technologies for the Construction of Heterocycles and Tryptamines","Journal of the American Chemical Society","2009","131","","3690","3699","10.1021/ja808692j","","x-ray","0.7107","MoKα","","0.1013","0.0969","","","0.2064","0.2114","","","","","","1.091","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104010","17.6524","0.0005","15.9364","0.0006","12.7876","0.0004","90","","117.878","0.002","90","","3179.86","0.19","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Fe2 N10 O14 -","- C18 H32 Fe2 N10 O14 -","- C72 H128 Fe8 N40 O56 -","4","0.5","","Fu-Te Tsai; Ting-Shen Kuo; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Bearing O-Bound Nitrito Ligand: Reversible Transformation between the Six-Coordinate {Fe(NO)2}9[(1-MeIm)2(η2-ONO)Fe(NO)2] (g= 2.013) and Four-Coordinate {Fe(NO)2}9[(1-MeIm)(ONO)Fe(NO)2] (g= 2.03)","Journal of the American Chemical Society","2009","131","","3426","3427","10.1021/ja808743g","","","0.71073","MoKα","","0.0694","0.045","","","0.101","0.1127","","","","","","1.047","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104011","13.2996","0.0003","13.4256","0.0003","15.8455","0.0003","90","","97.951","0.001","90","","2802.1","0.1","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Fe N7 O10 -","- C20 H36 Fe N7 O10 -","- C80 H144 Fe4 N28 O40 -","4","1","","Fu-Te Tsai; Ting-Shen Kuo; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Bearing O-Bound Nitrito Ligand: Reversible Transformation between the Six-Coordinate {Fe(NO)2}9[(1-MeIm)2(η2-ONO)Fe(NO)2] (g= 2.013) and Four-Coordinate {Fe(NO)2}9[(1-MeIm)(ONO)Fe(NO)2] (g= 2.03)","Journal of the American Chemical Society","2009","131","","3426","3427","10.1021/ja808743g","","","0.71073","MoKα","","0.0624","0.0493","","","0.1245","0.1343","","","","","","1.04","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104012","9.5191","0.0002","19.0746","0.0004","13.2434","0.0003","90","","92.521","0.001","90","","2402.32","0.09","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H21 Fe N4 O2 P -","- C22 H21 Fe N4 O2 P -","- C88 H84 Fe4 N16 O8 P4 -","4","1","","Fu-Te Tsai; Ting-Shen Kuo; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Bearing O-Bound Nitrito Ligand: Reversible Transformation between the Six-Coordinate {Fe(NO)2}9[(1-MeIm)2(η2-ONO)Fe(NO)2] (g= 2.013) and Four-Coordinate {Fe(NO)2}9[(1-MeIm)(ONO)Fe(NO)2] (g= 2.03)","Journal of the American Chemical Society","2009","131","","3426","3427","10.1021/ja808743g","","","0.71073","MoKα","","0.0617","0.0508","","","0.1418","0.1474","","","","","","1.13","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104013","13.8153","0.0005","26.2742","0.0007","14.8383","0.0006","90","","108.159","0.004","90","","5117.8","0.3","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C86 H126 Ag17 F3 O6 S -","- C86 H126 Ag17 F3 O6 S -","- C172 H252 Ag34 F6 O12 S2 -","2","0.5","","Shu-Dan Bian; Jian-Hua Jia; Quan-Ming Wang","High-Nuclearity Silver Clusters Templated by Carbonates Generated from Atmospheric Carbon Dioxide Fixation","Journal of the American Chemical Society","2009","131","","3422","3423","10.1021/ja8087696","","","0.71073","MoKα","","0.2079","0.0452","","","0.0648","0.0817","","","","","","0.682","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104014","21.7271","0.0004","15.8981","0.0002","34.0433","0.0005","90","","93.151","0.002","90","","11741.4","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C98 H148 Ag19 B F4 O4 -","- C98 H144 Ag19 B F4 O4 -","- C392 H576 Ag76 B4 F16 O16 -","4","1","","Shu-Dan Bian; Jian-Hua Jia; Quan-Ming Wang","High-Nuclearity Silver Clusters Templated by Carbonates Generated from Atmospheric Carbon Dioxide Fixation","Journal of the American Chemical Society","2009","131","","3422","3423","10.1021/ja8087696","","","0.71073","MoKα","","0.1668","0.0649","","","0.1309","0.1527","","","","","","0.919","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104015","8.7442","0.0004","27.4138","0.0014","9.2149","0.0004","90","","113.809","0.002","90","","2020.93","0.17","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 Fe N6 -","- C24 H20 Fe N6 -","- C96 H80 Fe4 N24 -","4","1","","Brenda A. Frazier; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Unusual Electronic Features and Reactivity of the Dipyridylazaallyl Ligand: Characterizations of (smif)2M [M = Fe, Co, Co+, Ni; smif = {(2-py)CH}2N] and [(TMS)2NFe]2(smif)2","Journal of the American Chemical Society","2009","131","","3428","3429","10.1021/ja8089747","","","0.71073","MoKα","","0.0586","0.0424","","","0.0932","0.1001","","","","","","1.041","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104016","9.0129","0.0008","14.4774","0.0012","17.0517","0.0014","94.368","0.003","97.829","0.003","97.521","0.003","2175.2","0.3","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C25.5 H21.5 N6 Ni -","- C25.5 H21.5 N6 Ni -","- C102 H86 N24 Ni4 -","4","2","","Brenda A. Frazier; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Unusual Electronic Features and Reactivity of the Dipyridylazaallyl Ligand: Characterizations of (smif)2M [M = Fe, Co, Co+, Ni; smif = {(2-py)CH}2N] and [(TMS)2NFe]2(smif)2","Journal of the American Chemical Society","2009","131","","3428","3429","10.1021/ja8089747","","","0.71073","MoKα","","0.088","0.0435","","","0.0842","0.1006","","","","","","0.946","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104017","8.0558","0.0005","10.8367","0.0007","14.3114","0.0009","72.491","0.003","85.244","0.004","81.614","0.004","1177.73","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H28 Fe N4 Si2 -","- C18 H28 Fe N4 Si2 -","- C36 H56 Fe2 N8 Si4 -","2","1","","Brenda A. Frazier; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Unusual Electronic Features and Reactivity of the Dipyridylazaallyl Ligand: Characterizations of (smif)2M [M = Fe, Co, Co+, Ni; smif = {(2-py)CH}2N] and [(TMS)2NFe]2(smif)2","Journal of the American Chemical Society","2009","131","","3428","3429","10.1021/ja8089747","","","0.71073","MoKα","","0.0533","0.0389","","","0.0963","0.1018","","","","","","1.048","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104018","8.5577","0.0004","16.6991","0.0006","30.5536","0.0012","90","","90","","90","","4366.3","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 Fe N6 -","- C24 H24 Fe N6 -","- C192 H192 Fe8 N48 -","8","2","","Brenda A. Frazier; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Unusual Electronic Features and Reactivity of the Dipyridylazaallyl Ligand: Characterizations of (smif)2M [M = Fe, Co, Co+, Ni; smif = {(2-py)CH}2N] and [(TMS)2NFe]2(smif)2","Journal of the American Chemical Society","2009","131","","3428","3429","10.1021/ja8089747","","","0.71073","MoKα","","0.056","0.0388","","","0.0708","0.0769","","","","","","1.035","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104019","30.8068","0.0012","14.4243","0.0005","18.5224","0.0007","90","","126.141","0.002","90","","6646.9","0.5","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C29 H28 Co F3 N6 O4 S -","- C29 H28 Co F3 N6 O4 S -","- C232 H224 Co8 F24 N48 O32 S8 -","8","1","","Brenda A. Frazier; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Unusual Electronic Features and Reactivity of the Dipyridylazaallyl Ligand: Characterizations of (smif)2M [M = Fe, Co, Co+, Ni; smif = {(2-py)CH}2N] and [(TMS)2NFe]2(smif)2","Journal of the American Chemical Society","2009","131","","3428","3429","10.1021/ja8089747","","","0.71073","MoKα","","0.0782","0.0551","","","0.1424","0.1543","","","","","","1.055","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104020","9.028","0.006","14.398","0.009","16.882","0.009","93.92","0.05","98.35","0.05","97.35","0.04","2145","2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H20 Co N6 -","- C24 H20 Co N6 -","- C96 H80 Co4 N24 -","4","2","","Brenda A. Frazier; Peter T. Wolczanski; Emil B. Lobkovsky; Thomas R. Cundari","Unusual Electronic Features and Reactivity of the Dipyridylazaallyl Ligand: Characterizations of (smif)2M [M = Fe, Co, Co+, Ni; smif = {(2-py)CH}2N] and [(TMS)2NFe]2(smif)2","Journal of the American Chemical Society","2009","131","","3428","3429","10.1021/ja8089747","","","0.9789","","","0.0488","0.0474","","","0.1325","0.1349","","","","","","1.03","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104021","23.936","0.005","6.8126","0.0014","12.455","0.003","90","","118.2","0.03","90","","1789.9","0.8","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Bis(2-methylpropyldimethylsilyl)telluride","Bis(2-methylpropyldimethylsilyl)telluride","","- C12 H30 Si2 Te -","- C12 H30 Si2 Te -","- C48 H120 Si8 Te4 -","4","0.5","","Viljami Pore; Timo Hatanpää; Mikko Ritala; Markku Leskelä","Atomic Layer Deposition of Metal Tellurides and Selenides Using Alkylsilyl Compounds of Tellurium and Selenium","Journal of the American Chemical Society","2009","131","","3478","3480","10.1021/ja8090388","","","0.71073","MoKα","","0.0415","0.0356","","","0.1079","0.1097","","","","","","1.427","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104022","8.1232","0.0004","14.3079","0.0006","17.301","0.0008","101.95","0.003","92.574","0.003","94.037","0.003","1958.72","0.16","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H48 Cl4 S Si2 -","- C42 H48 Cl4 S Si2 -","- C84 H96 Cl8 S2 Si4 -","2","1","","Ming Lee Tang; Joon Hak Oh; Anna Devi Reichardt; Zhenan Bao","Chlorination: A General Route toward Electron Transport in Organic Semiconductors","Journal of the American Chemical Society","2009","131","","3733","3740","10.1021/ja809045s","","","1.54178","CuKα","","0.0829","0.0488","","","0.1156","0.1345","","","","","","0.929","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104023","10.22","0.0014","15.396","0.003","19.845","0.003","101.182","0.004","90.581","0.004","100.776","0.004","3005.8","0.9","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C33 H40 N4 O4 -","- C33 H40 N4 O4 -","- C132 H160 N16 O16 -","4","2","","Leigh, David A.; Lusby, Paul J.; McBurney, Roy T.; Morelli, Alessandra; Slawin, Alexandra M. Z.; Thomson, Andrew R.; Walker, D. Barney","Getting Harder: Cobalt(III)-Template Synthesis of Catenanes and Rotaxanes","Journal of the American Chemical Society","2009","131","10","3762","3771","10.1021/ja809627j","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","219207","2020-10-21","18:00:00",""
"4104024","15.4921","0.0006","19.1721","0.0008","21.3192","0.0009","90","","100.176","0.002","90","","6232.5","0.4","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C68 H86 Co N7 O8 -","- C68 H86 Co N7 O8 -","- C272 H344 Co4 N28 O32 -","4","1","","Leigh, David A.; Lusby, Paul J.; McBurney, Roy T.; Morelli, Alessandra; Slawin, Alexandra M. Z.; Thomson, Andrew R.; Walker, D. Barney","Getting Harder: Cobalt(III)-Template Synthesis of Catenanes and Rotaxanes","Journal of the American Chemical Society","2009","131","10","3762","3771","10.1021/ja809627j","","","0.71073","MoKα","","0.0711","0.0666","","","0.1759","0.1807","","","","","","1.033","","","","has coordinates","219207","2020-10-21","18:00:00",""
"4104025","14.142","0.004","20.476","0.007","23.569","0.011","90","","90","","90","","6825","4","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C70.5 H90 Cl Co N7 O8.5 -","- C70.5 H90 Cl Co N7 O8.5 -","- C282 H360 Cl4 Co4 N28 O34 -","4","1","","Leigh, David A.; Lusby, Paul J.; McBurney, Roy T.; Morelli, Alessandra; Slawin, Alexandra M. Z.; Thomson, Andrew R.; Walker, D. Barney","Getting Harder: Cobalt(III)-Template Synthesis of Catenanes and Rotaxanes","Journal of the American Chemical Society","2009","131","10","3762","3771","10.1021/ja809627j","","","","","","0.135","","","","","","","","","","","","","","","has coordinates","219207","2020-10-21","18:00:00",""
"4104026","10.0482","0.001","14.0223","0.0014","21.011","0.002","94.687","0.002","103.329","0.002","91.388","0.002","2868.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H69 Cl4 N5 P2 Zr -","- C59 H69 Cl4 N5 P2 Zr -","- C118 H138 Cl8 N10 P4 Zr2 -","2","1","","Pascal Oulié; Noel Nebra; Nathalie Saffon; Laurent Maron; Blanca Martin-Vaca; Didier Bourissou","2-Indenylidene Pincer Complexes of Zirconium and Palladium","Journal of the American Chemical Society","2009","131","","3493","3498","10.1021/ja809892a","","","0.71073","MoKα","","0.0777","0.0465","","","0.1011","0.1137","","","","","","1.006","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104027","12.8825","0.0014","23.109","0.002","17.1419","0.0018","90","","110.034","0.002","90","","4794.4","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C55 H58 N4 P2 Zr -","- C55 H58 N4 P2 Zr -","- C220 H232 N16 P8 Zr4 -","4","1","","Pascal Oulié; Noel Nebra; Nathalie Saffon; Laurent Maron; Blanca Martin-Vaca; Didier Bourissou","2-Indenylidene Pincer Complexes of Zirconium and Palladium","Journal of the American Chemical Society","2009","131","","3493","3498","10.1021/ja809892a","","","0.71073","MoKα","","0.1062","0.0452","","","0.071","0.0858","","","","","","0.753","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104028","11.3074","0.0004","14.8453","0.0005","25.2573","0.0007","90","","90.58","0.002","90","","4239.5","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H51 N O0.5 P2 Pd S2 -","- C47 H51 N O0.5 P2 Pd S2 -","- C188 H204 N4 O2 P8 Pd4 S8 -","4","1","","Pascal Oulié; Noel Nebra; Nathalie Saffon; Laurent Maron; Blanca Martin-Vaca; Didier Bourissou","2-Indenylidene Pincer Complexes of Zirconium and Palladium","Journal of the American Chemical Society","2009","131","","3493","3498","10.1021/ja809892a","","","0.71073","MoKα","","0.1535","0.0485","","","0.0779","0.1069","","","","","","0.979","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104029","8.5993","0.0002","17.291","0.0005","10.7919","0.0003","90","","100.022","0.002","90","","1580.17","0.07","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 N -","- C18 H23 N -","- C72 H92 N4 -","4","1","","Kirill V. Axenov; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Catalytic Hydrogenation of Sensitive Organometallic Compounds by Antagonistic N/B Lewis Pair Catalyst Systems","Journal of the American Chemical Society","2009","131","","3454","3455","10.1021/ja8100006","","","1.54178","CuKα","","0.0514","0.0457","","","0.1175","0.1233","","","","","","1.063","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104030","13.6288","0.0002","17.8192","0.0003","14.1609","0.0002","90","","91.922","0.001","90","","3437.1","0.09","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H48 Cl2 N2 Zr -","- C36 H48 Cl2 N2 Zr -","- C144 H192 Cl8 N8 Zr4 -","4","1","","Kirill V. Axenov; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Catalytic Hydrogenation of Sensitive Organometallic Compounds by Antagonistic N/B Lewis Pair Catalyst Systems","Journal of the American Chemical Society","2009","131","","3454","3455","10.1021/ja8100006","","","0.71073","MoKα","","0.0822","0.0438","","","0.0866","0.099","","","","","","1.028","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104031","30.1073","0.0002","30.1073","0.0002","30.1073","0.0002","90","","90","","90","","27290.7","0.3","100","2","100","2","","","","","","","","6","F m -3","-F 2 2 3","202","","","","- C192 H240 Br6 Co9 N84 O74 -","- C192 H240 Br6 Co9 N84 O74.04 -","- C768 H960 Br24 Co36 N336 O296.16 -","4","0.0416667","","Man-Li Cao; Jin-Ji Wu; Hao-Jun Mo; Bao-Hui Ye","Template Trapping and Crystal Structure of the Magic Number (H2O)21 Cluster in the Tetrahedral Hole of a Nanoscale Global Ion Packed in a Face-Centered cubic Pattern","Journal of the American Chemical Society","2009","131","","3458","3459","10.1021/ja810107a","","","0.71073","MoKα","","0.1192","0.0682","","","0.1794","0.2023","","","","","","1.005","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104032","30.165","0.003","30.165","0.003","30.165","0.003","90","","90","","90","","27448","5","100","2","100","2","","","","","","","","6","F m -3","-F 2 2 3","202","","","","- C192 H240 Cl6 Co9 N84 O76 -","- C192 H240 Cl6 Co9 N84 O75.956 -","- C768 H960 Cl24 Co36 N336 O303.824 -","4","0.0416667","","Man-Li Cao; Jin-Ji Wu; Hao-Jun Mo; Bao-Hui Ye","Template Trapping and Crystal Structure of the Magic Number (H2O)21 Cluster in the Tetrahedral Hole of a Nanoscale Global Ion Packed in a Face-Centered cubic Pattern","Journal of the American Chemical Society","2009","131","","3458","3459","10.1021/ja810107a","","","0.71073","MoKα","","0.0812","0.0523","","","0.1592","0.173","","","","","","1.009","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104033","18.8589","0.0008","10.4859","0.0005","18.3537","0.0008","90","","104.335","0.003","90","","3516.5","0.3","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N2 O3 -","- C18 H22 N2 O3 -","- C144 H176 N16 O24 -","8","2","","Akihiro Nojiri; Naoya Kumagai; Masakatsu Shibasaki","Linking Structural Dynamics and Functional Diversity in Asymmetric Catalysis","Journal of the American Chemical Society","2009","131","","3779","3784","10.1021/ja900084k","","","1.54187","CuKα","","0.1722","0.1422","","","0.3281","0.3444","","","","","","1.059","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104034","10.3937","0.0003","11.6798","0.0004","45.6145","0.0014","90","","90","","90","","5537.4","0.3","143.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H21 Cl N2 O3 -","- C18 H21 Cl N2 O3 -","- C216 H252 Cl12 N24 O36 -","12","3","","Akihiro Nojiri; Naoya Kumagai; Masakatsu Shibasaki","Linking Structural Dynamics and Functional Diversity in Asymmetric Catalysis","Journal of the American Chemical Society","2009","131","","3779","3784","10.1021/ja900084k","","","1.54187","CuKα","","","0.0849","","","","0.2432","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104035","6.5984","0.0011","12.125","0.002","26.515","0.005","90","","90","","90","","2121.3","0.6","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H25 Br O3 -","- C24 H25 Br O3 -","- C96 H100 Br4 O12 -","4","1","","Minoru Uemura; Iain D. G. Watson; Mikimoto Katsukawa; F. Dean Toste","Gold(I)-Catalyzed Enantioselective Synthesis of Benzopyrans via Rearrangement of Allylic Oxonium Intermediates","Journal of the American Chemical Society","2009","131","","3464","3465","10.1021/ja900155x","","","0.71073","MoKα","","0.0657","0.0387","","","0.0815","0.0935","","","","","","1.007","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104036","8.1385","0.0002","18.5203","0.0006","20.3914","0.0006","90","","90","","90","","3073.54","0.15","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H15 N O2 S -","- C18 H15 N O2 S -","- C144 H120 N8 O16 S8 -","8","1","","Xiaodan Zhao; Elena Dimitrijević; Vy M. Dong","Palladium-Catalyzed C-H Bond Functionalization with Arylsulfonyl Chlorides","Journal of the American Chemical Society","2009","131","","3466","3467","10.1021/ja900200g","","","","","","","","","","","","","","","","","","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104037","12.8108","0.0004","13.4663","0.0004","13.3937","0.0004","90","","100.156","0.002","90","","2274.4","0.12","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H9 B F15 N -","- C25 H9 B F15 N -","- C100 H36 B4 F60 N4 -","4","1","","Stephen J. Geier; Douglas W. Stephan","Lutidine/B(C6F5)3: At the Boundary of Classical and Frustrated Lewis Pair Reactivity","Journal of the American Chemical Society","2009","131","","3476","3477","10.1021/ja900572x","","","0.71073","MoKα","","0.0709","0.0494","","","0.1275","0.1475","","","","","","1.055","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104038","17.8525","0.0012","9.8407","0.0007","15.2683","0.001","90","","115.01","0.003","90","","2430.8","0.3","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H11 B F15 N -","- C25 H11 B F15 N -","- C100 H44 B4 F60 N4 -","4","1","","Stephen J. Geier; Douglas W. Stephan","Lutidine/B(C6F5)3: At the Boundary of Classical and Frustrated Lewis Pair Reactivity","Journal of the American Chemical Society","2009","131","","3476","3477","10.1021/ja900572x","","","0.71073","MoKα","","0.1085","0.0516","","","0.1311","0.168","","","","","","1.005","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104039","17.4334","0.0009","10.6793","0.0006","14.4679","0.0008","90","","90","","90","","2693.6","0.3","150","","150","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C29 H17 B F15 N O -","- C29 H17 B F15 N O -","- C116 H68 B4 F60 N4 O4 -","4","1","","Stephen J. Geier; Douglas W. Stephan","Lutidine/B(C6F5)3: At the Boundary of Classical and Frustrated Lewis Pair Reactivity","Journal of the American Chemical Society","2009","131","","3476","3477","10.1021/ja900572x","","","0.71073","MoKα","","0.0524","0.0389","","","0.1063","0.1146","","","","","","1.046","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104040","6.6317","0.0003","13.2907","0.0007","13.6951","0.0007","63.1627","0.0005","76.1838","0.0006","88.7493","0.0006","1040.75","0.09","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H30 N2 O Si -","- C22 H30 N2 O Si -","- C44 H60 N4 O2 Si2 -","2","1","","David B. C. Martin; Christopher D. Vanderwal","Efficient Access to the Core of the Strychnos, Aspidosperma and Iboga Alkaloids. A Short Synthesis of Norfluorocurarine","Journal of the American Chemical Society","2009","131","","3472","3473","10.1021/ja900640v","","","","","","","","","","","","","","","","","","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104041","17.66","0.006","26.919","0.008","18.596","0.006","90","","105.08","0.005","90","","8536","5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C174 H242 K2 O28 Ta4 -","- C174 H242 K2 O28 Ta4 -","- C348 H484 K4 O56 Ta8 -","2","0.5","","Takahito Watanabe; Yutaka Ishida; Tsukasa Matsuo; Hiroyuki Kawaguchi","Reductive Coupling of Six Carbon Monoxides by a Ditantalum Hydride Complex","Journal of the American Chemical Society","2009","131","","3474","3475","10.1021/ja9007276","","","0.7107","MoKα","","0.1216","0.1003","","","0.1868","0.1975","","","","","","1.261","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104042","13.695","0.005","18.865","0.007","19.053","0.008","115.639","0.003","106.946","0.004","97.7005","0.0016","4047","3","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C166 H220 O24 Ta4 -","- C166 H220 O24 Ta4 -","- C166 H220 O24 Ta4 -","1","0.5","","Takahito Watanabe; Yutaka Ishida; Tsukasa Matsuo; Hiroyuki Kawaguchi","Reductive Coupling of Six Carbon Monoxides by a Ditantalum Hydride Complex","Journal of the American Chemical Society","2009","131","","3474","3475","10.1021/ja9007276","","","0.7107","MoKα","","0.096","0.0754","","","0.1954","0.2089","","","","","","1.08","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104043","20.306","0.002","24.091","0.003","34.887","0.004","80.559","0.004","78.017","0.004","73.103","0.003","15876","3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C155 H200 O20 Ta4 -","- C155 H200 O20 Ta4 -","- C620 H800 O80 Ta16 -","4","2","","Takahito Watanabe; Yutaka Ishida; Tsukasa Matsuo; Hiroyuki Kawaguchi","Reductive Coupling of Six Carbon Monoxides by a Ditantalum Hydride Complex","Journal of the American Chemical Society","2009","131","","3474","3475","10.1021/ja9007276","","","0.7107","MoKα","","0.1047","0.0699","","","0.1623","0.1784","","","","","","1.073","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104044","11.1616","0.0009","11.9919","0.0009","15.6096","0.001","90","","90","","90","","2089.3","0.3","85","2","85","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C19 H26 Cl2 F2 N2 Pd -","- C19 H26 Cl2 F2 N2 Pd -","- C76 H104 Cl8 F8 N8 Pd4 -","4","0.5","","Nicholas D. Ball; Melanie S. Sanford","Synthesis and Reactivity of a Mono-σ-Aryl Palladium(IV) Fluoride Complex","Journal of the American Chemical Society","2009","131","","3796","3797","10.1021/ja8054595","","","0.71073","MoKα","","0.0507","0.0386","","","0.1032","0.1102","","","","","","1.095","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104045","17.9592","0.0012","17.5332","0.0012","20.295","0.0014","90","","95.135","0.001","90","","6364.9","0.8","85","2","85","2","","","","","","","","5","I 1 a 1","I -2ya","9","","","","- C57 H65 F4 N4 Pd2 -","- C57 H65 F4 N4 Pd2 -","- C228 H260 F16 N16 Pd8 -","4","1","","Nicholas D. Ball; Melanie S. Sanford","Synthesis and Reactivity of a Mono-σ-Aryl Palladium(IV) Fluoride Complex","Journal of the American Chemical Society","2009","131","","3796","3797","10.1021/ja8054595","","","0.71073","MoKα","","0.07","0.0552","","","0.1553","0.1651","","","","","","1.135","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104046","9.6894","0.0007","12.7681","0.0009","13.8914","0.001","73.672","0.001","77.18","0.001","69.587","0.001","1530.97","0.19","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H41 F5 N2 O2 Pd -","- C30 H41 F5 N2 O2 Pd -","- C60 H82 F10 N4 O4 Pd2 -","2","1","","Nicholas D. Ball; Melanie S. Sanford","Synthesis and Reactivity of a Mono-σ-Aryl Palladium(IV) Fluoride Complex","Journal of the American Chemical Society","2009","131","","3796","3797","10.1021/ja8054595","","","0.71073","MoKα","","0.0526","0.0448","","","0.1019","0.1088","","","","","","1.105","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104047","22.5453","0.0007","10.6236","0.0003","17.5931","0.0006","90","","116.324","0.002","90","","3776.8","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H18 N4 O6 -","- C17 H18 N4 O6 -","- C136 H144 N32 O48 -","8","1","","J. Craig Ruble; Alexander R. Hurd; Timothy A. Johnson; Debra A. Sherry; Michael R. Barbachyn; Peter L. Toogood; Gordon L. Bundy; David R. Graber; Gregg M. Kamilar","Synthesis of (-)-PNU-286607 by Asymmetric Cyclization of Alkylidene Barbiturates","Journal of the American Chemical Society","2009","131","","3991","3997","10.1021/ja808014h","","","1.54178","CuKα","","0.0612","0.0431","","","0.1113","0.1269","","","","","","0.864","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104048","23.5028","0.0004","23.5028","0.0004","12.4607","0.0003","90","","90","","90","","6883.1","0.2","293","2","293","2","","","","","","","","4","I 41 c d","I 4bw -2c","110","Zinc imidazolate 3D framework","","","- C12 H12 N8 Zn2 -","- C12 H12 N8 Zn2 -","- C192 H192 N128 Zn32 -","16","1","","Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard","Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study","Journal of the American Chemical Society","2009","131","","4022","4026","10.1021/ja808531m","","","0.71073","MoKα","","0.0485","0.0276","","","0.0401","0.0428","","","","","","0.884","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104049","23.4856","0.0006","23.4856","0.0006","12.4521","0.0007","90","","90","","90","","6868.2","0.5","298","2","298","2","100","1","100","1","","","","4","I 41 c d","I 4bw -2c","110","Zinc Imidazolate","","","- C12 H12 N8 Zn2 -","- C12 H12 N8 Zn2 -","- C192 H192 N128 Zn32 -","16","1","","Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard","Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study","Journal of the American Chemical Society","2009","131","","4022","4026","10.1021/ja808531m","","x-ray","0.71073","MoKα","","0.2482","0.0757","","","0.0953","0.1303","","","","","","0.924","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104050","23.3569","0.0005","23.3569","0.0005","12.4441","0.0006","90","","90","","90","","6788.8","0.4","298","2","298","2","92000","5000","92000","5000","","","","4","I 41 c d","I 4bw -2c","110","Zinc Imidazolate","","","- C12 H12 N8 Zn2 -","- C12 H12 N8 Zn2 -","- C192 H192 N128 Zn32 -","16","1","","Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard","Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study","Journal of the American Chemical Society","2009","131","","4022","4026","10.1021/ja808531m","","x-ray","0.71073","MoKα","","0.1549","0.056","","","0.0594","0.0794","","","","","","0.839","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104051","23.2297","0.0004","23.2297","0.0004","12.4296","0.0005","90","","90","","90","","6707.2","0.3","298","2","298","2","295000","6000","295000","6000","","","","4","I 41 c d","I 4bw -2c","110","Zinc Imidazolate","","","- C12 H12 N8 Zn2 -","- C12 H12 N8 Zn2 -","- C192 H192 N128 Zn32 -","16","1","","Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard","Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study","Journal of the American Chemical Society","2009","131","","4022","4026","10.1021/ja808531m","","x-ray","0.71073","MoKα","","0.2073","0.0552","","","0.0447","0.0584","","","","","","0.854","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104052","23.0474","0.0006","23.0474","0.0006","12.402","0.0007","90","","90","","90","","6587.7","0.4","298","2","298","2","543000","5000","547000","5000","","","","4","I 41 c d","I 4bw -2c","110","Zinc Imidazolate","","","- C12 H12 N8 Zn2 -","- C12 H12 N8 Zn2 -","- C192 H192 N128 Zn32 -","16","1","","Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard","Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study","Journal of the American Chemical Society","2009","131","","4022","4026","10.1021/ja808531m","","x-ray","0.71073","MoKα","","0.2677","0.0694","","","0.0818","0.1115","","","","","","0.87","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104053","22.7482","0.0003","22.7482","0.0003","13.0168","0.0003","90","","90","","90","","6735.9","0.2","298","2","298","2","","","","","","","","4","I 41","I 4bw","80","Zinc imidazolate 3D framework","","","- C12 H12 N8 Zn2 -","- C12 H12 N8 Zn2 -","- C192 H192 N128 Zn32 -","16","2","","Elinor C. Spencer; Ross J. Angel; Nancy L. Ross; Brian E. Hanson; Judith A. K. Howard","Pressure-Induced Cooperative Bond Rearrangement in a Zinc Imidazolate Framework: A High-Pressure Single-Crystal X-Ray Diffraction Study","Journal of the American Chemical Society","2009","131","","4022","4026","10.1021/ja808531m","","","0.71073","MoKα","","0.0524","0.0382","","","0.0516","0.054","","","","","","0.9","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104054","48.527","0.006","48.527","0.006","48.527","0.006","90","","90","","90","","114275","2","90","2","90","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C29 H27 Cd O6.75 -","- C29 H27 Cd O6.75 -","- C2784 H2592 Cd96 O648 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.90002","synchrotron","","0.0376","0.0369","","","0.0981","0.0989","","","","","","1.062","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104055","48.325","0.006","48.325","0.006","48.325","0.006","90","","90","","90","","112854","2","90","2","90","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C29 H26 Cd O9.25 -","- C29 H26 Cd O9.25 -","- C2784 H2496 Cd96 O888 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.90002","synchrotron","","0.0753","0.0674","","","0.1925","0.1996","","","","","","1.097","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104056","48.85","0.006","48.85","0.006","48.85","0.006","90","","90","","90","","116572","2","90","2","90","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C336 H312 O219 Pb12 -","- C336 H312 O219 Pb12 -","- C2688 H2496 O1752 Pb96 -","8","0.0416667","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.8","synchrotron","","0.0625","0.0612","","","0.1658","0.1672","","","","","","1.042","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4104057","48.535","0.006","48.535","0.006","48.535","0.006","90","","90","","90","","114331","2","90","2","90","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C336 H312 O123 Pb12 -","- C336 H312 O123 Pb12 -","- C2688 H2496 O984 Pb96 -","8","0.0416667","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.9","synchrotron","","0.0959","0.0871","","","0.2487","0.2681","","","","","","1.044","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4104058","48.436","0.006","48.436","0.006","48.436","0.006","90","","90","","90","","113633","2","90","2","90","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C28 H26 Cd O8.25 -","- C28 H26 Cd O8.25 -","- C2688 H2496 Cd96 O792 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.85","synchrotron","","0.0451","0.0434","","","0.1266","0.1282","","","","","","1.088","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104059","48.686","0.006","48.686","0.006","48.686","0.006","90","","90","","90","","115402","2","90","2","90","2","","","","","","","","5","F m -3 c","-F 4a 2 3","226","","","","- C28 H26 Cd0.76 O6.75 Pb0.24 -","- C28 H26 Cd0.76 O6.75 Pb0.24 -","- C2688 H2496 Cd72.96 O648 Pb23.04 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.9","synchrotron","","0.0875","0.08","","","0.2276","0.2398","","","","","","1.077","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104060","48.673","0.006","48.673","0.006","48.673","0.006","90","","90","","90","","115309","2","90","2","90","2","","","","","","","","5","F m -3 c","-F 4a 2 3","226","","","","- C28 H26 Cd0.66 O6.25 Pb0.34 -","- C28 H26 Cd0.66 O6.25 Pb0.34 -","- C2688 H2496 Cd63.36 O600 Pb32.64 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.9","synchrotron","","0.0864","0.0793","","","0.2261","0.2368","","","","","","1.076","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104061","48.827","0.006","48.827","0.006","48.827","0.006","90","","90","","90","","116407","2","90","2","90","2","","","","","","","","5","F m -3 c","-F 4a 2 3","226","","","","- C28 H26 Cd0.58 O7.75 Pb0.42 -","- C28 H26 Cd0.58 O7.75 Pb0.42 -","- C2688 H2496 Cd55.68 O744 Pb40.32 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.9","synchrotron","","0.0882","0.0782","","","0.2247","0.24","","","","","","1.098","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104062","48.947","0.006","48.947","0.006","48.947","0.006","90","","90","","90","","117268","2","90","2","90","2","","","","","","","","5","F m -3 c","-F 4a 2 3","226","","","","- C28 H26 Cd0.38 O5.75 Pb0.62 -","- C28 H26 Cd0.38 O5.75 Pb0.62 -","- C2688 H2496 Cd36.48 O552 Pb59.52 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.9","synchrotron","","0.0873","0.0829","","","0.2395","0.2482","","","","","","1.093","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104063","48.829","0.006","48.829","0.006","48.829","0.006","90","","90","","90","","116422","2","90","2","90","2","","","","","","","","5","F m -3 c","-F 4a 2 3","226","","","","- C28 H26 Cd0.16 O6.25 Pb0.84 -","- C28 H26 Cd0.16 O6.25 Pb0.84 -","- C2688 H2496 Cd15.36 O600 Pb80.64 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.9","synchrotron","","0.0795","0.0765","","","0.2151","0.2209","","","","","","1.101","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104064","48.793","0.006","48.793","0.006","48.793","0.006","90","","90","","90","","116164","2","298","2","298","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C336 H312 O51 Pb12 -","- C336 H312 O51 Pb12 -","- C2688 H2496 O408 Pb96 -","8","0.0416667","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.90001","synchrotron","","0.0824","0.0669","","","0.1801","0.1938","","","","","","1.05","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4104065","49.267","0.006","49.267","0.006","49.267","0.006","90","","90","","90","","119583","3","90","2","90","2","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","","","- C29 H26 Dy O6.75 -","- C29 H26 Dy O6.75 -","- C2784 H2496 Dy96 O648 -","96","0.5","","Sunirban Das; Hyunuk Kim; Kimoon Kim","Metathesis in Single Crystal: Complete and Reversible Exchange of Metal Ions Constituting the Frameworks of Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","3814","3815","10.1021/ja808995d","","","0.89999","synchrotron","","0.0856","0.0839","","","0.23","0.2324","","","","","","1.114","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104066","15.6934","0.0014","17.4648","0.0014","84.055","0.007","90","","90","","90","","23038","3","115","2","115","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C185 H305 N37 O58 S6 -","- C185 H291 N37 O58 S6 -","- C740 H1164 N148 O232 S24 -","4","1","","Naoki Ousaka; Tomohiro Sato; Reiko Kuroda","Total Helical-Sense Bias of an Achiral Peptide Main Chain Induced by a Chiral Side-Chain Bridge","Journal of the American Chemical Society","2009","131","","3820","3821","10.1021/ja8091714","","","0.71073","MoKα","","0.1218","0.0985","","","0.2056","0.2186","","","","","","1.072","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104067","9.041","0.005","10.005","0.005","12.145","0.005","62.119","0.005","70.696","0.005","85.276","0.005","913","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","dienol","","","- C22 H21 F N0 O3 -","- C22 H21 F O3 -","- C44 H42 F2 O6 -","2","1","","Naohiko Yoshikai; Song-Lin Zhang; Ken-ichi Yamagata; Hayato Tsuji; Eiichi Nakamura","Mechanistic Study of the Manganese-Catalyzed [2 + 2 + 2] Annulation of 1,3-Dicarbonyl Compounds and Terminal Alkynes","Journal of the American Chemical Society","2009","131","","4099","4109","10.1021/ja809202y","","","0.71069","MoKα","","0.0337","0.0314","","","0.0778","0.0798","","","","","","1.012","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104068","13.262","0.0007","13.9991","0.0006","18.9895","0.0008","100.216","0.002","102.279","0.002","102.329","0.002","3272.5","0.3","100","","100","","","","","","","","dichloromethane/pentane","5","P -1","-P 1","2","","tris[2'-(1-adamantylcarbonyl)oxy-1,1'-biphenyl-2-yl]phosphite oxide tris-dichloromethane solute","","- C72 H75 Cl6 O10 P -","- C72 H75 Cl6 O10 P -","- C144 H150 Cl12 O20 P2 -","2","1","","Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott","Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis","Journal of the American Chemical Society","2009","131","","4136","4142","10.1021/ja809297a","","","1.54178","CuKα","","0.1906","0.0973","","","0.2505","0.3124","","","","","","0.977","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104069","23.9458","0.0003","23.9458","0.0003","10.7465","0.0002","90","","90","","120","","5336.5","0.14","100","","100","","","","","","","","dichloromethane/pentane","4","R 3 :H","R 3","146","","anti-tris[(R)-2'-(1-adamantylcarbonyl)oxy-1,1'-binaphthyl-2-yl]phosphite","","- C93 H81 O9 P -","- C93 H81 O9 P0.99 -","- C279 H243 O27 P2.97 -","3","0.333333","","Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott","Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis","Journal of the American Chemical Society","2009","131","","4136","4142","10.1021/ja809297a","","","1.54178","CuKα","","0.0304","0.0302","","","0.0805","0.0806","","","","","","1.06","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104070","23.8503","0.0006","23.8503","0.0006","10.7465","0.0003","90","","90","","120","","5294","0.2","100","","100","","","","","","","","dichloromethane/ethylacetate/hexane","4","R 3 :H","R 3","146","","anti-tris[(S)-2'-(1-adamantylcarbonyl)oxy-1,1'-binaphthyl-2-yl]phosphite","","- C93 H81 O9 P -","- C93 H81 O9 P0.99 -","- C279 H243 O27 P2.97 -","3","0.333333","","Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott","Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis","Journal of the American Chemical Society","2009","131","","4136","4142","10.1021/ja809297a","","","0.71073","MoKα","","0.0531","0.0502","","","0.1368","0.1401","","","","","","1.051","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104071","20.6143","0.0002","20.6143","0.0002","17.9025","0.0003","90","","90","","120","","6588.42","0.14","100","","100","","","","","","","","dichloromethane/pentane","5","P 63","P 6c","173","","tris((2'-phenylcarboxy-1,1'-(S)binaphthalen-2-yl)-oxy)phosphine dichloromethane solute","","- C82 H53 Cl2 O9 P -","- C81 H51 Cl1.995 O9 P -","- C324 H204 Cl7.98 O36 P4 -","4","0.666667","","Manfred T. Reetz; Hongchao Guo; Jun-An Ma; Richard Goddard; Richard J. Mynott","Helical Triskelion Monophosphites as Ligands in Asymmetric Catalysis","Journal of the American Chemical Society","2009","131","","4136","4142","10.1021/ja809297a","","","0.71073","MoKα","","0.0966","0.0765","","","0.1671","0.1784","","","","","","1.077","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104072","22.369","0.003","10.9191","0.0015","19.087","0.003","90","","110.827","0.002","90","","4357.4","1.1","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","jonjt01","","","- C40 H74 Ni2 P4 S -","- C40 H74 Ni2 P4 S -","- C160 H296 Ni8 P16 S4 -","4","1","","Jorge Torres-Nieto; William W. Brennessel; William D. Jones; Juventino J. García","Mechanistic Insights on the Hydrodesulfurization of Biphenyl-2-thiol with Nickel Compounds","Journal of the American Chemical Society","2009","131","","4120","4126","10.1021/ja809457s","","","0.71073","MoKα","","0.0791","0.0447","","","0.0931","0.1079","","","","","","1.02","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104073","30.896","0.004","50.891","0.007","9.0942","0.0013","90","","90","","90","","14299","3","105","0.1","105","0.1","","","","","","","","5","F d d 2","F 2 -2d","43","jonjt03","","","- C38 H50 Ni P2 S2 -","- C38 H50 Ni P2 S2 -","- C608 H800 Ni16 P32 S32 -","16","1","","Jorge Torres-Nieto; William W. Brennessel; William D. Jones; Juventino J. García","Mechanistic Insights on the Hydrodesulfurization of Biphenyl-2-thiol with Nickel Compounds","Journal of the American Chemical Society","2009","131","","4120","4126","10.1021/ja809457s","","","0.71073","MoKα","","0.0758","0.0471","","","0.0768","0.0863","","","","","","1.012","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104074","11.564","0.004","23.307","0.008","14.844","0.006","90","","102.17","0.006","90","","3911","2","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H33 B Cu F4 N5 -","- C50 H33 B Cu F4 N5 -","- C200 H132 B4 Cu4 F16 N20 -","4","1","","Kuniharu Nomoto; Shoko Kume; Hiroshi Nishihara","A Single Molecular System Gating Electron Transfer by Ring Inversion of a Methylpyridylpyrimidine Ligand on Copper","Journal of the American Chemical Society","2009","131","","3830","3831","10.1021/ja8097564","","","0.71073","MoKα","","0.1095","0.094","","","0.2512","0.2656","","","","","","1.14","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104075","12.9114","0.0009","16.8578","0.0012","17.6005","0.0012","79.481","0.001","74.323","0.001","80.225","0.001","3596.9","0.4","100","2","293","2","","","","","","","","8","P -1","-P 1","2","{[BP2]Cu(NTol2)}{Li(12-crown-4)2}","","","- C70.57 H118.12 B Cu Li N O10.02 P2 -","- C70.568 H118.12 B Cu Li N O10.019 P2 -","- C141.136 H236.24 B2 Cu2 Li2 N2 O20.038 P4 -","2","1","","Neal P. Mankad; William E. Antholine; Robert K. Szilagyi; Jonas C. Peters","Three-Coordinate Copper(I) Amido and Aminyl Radical Complexes","Journal of the American Chemical Society","2009","131","","3878","3880","10.1021/ja809834k","","","0.71073","MoKα","","0.082","0.0518","","","0.1274","0.1458","","","","","","1.015","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104076","16.3201","0.0018","16.3538","0.0018","18.849","0.002","90","","91.277","0.002","90","","5029.5","0.9","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[BP2]Cu(NTol2)","","","- C52.42 H80.84 B Cu N P2 -","- C52.42 H80.84 B Cu N P2 -","- C209.68 H323.36 B4 Cu4 N4 P8 -","4","1","","Neal P. Mankad; William E. Antholine; Robert K. Szilagyi; Jonas C. Peters","Three-Coordinate Copper(I) Amido and Aminyl Radical Complexes","Journal of the American Chemical Society","2009","131","","3878","3880","10.1021/ja809834k","","","0.71073","MoKα","","0.0807","0.0606","","","0.1667","0.1813","","","","","","1.282","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104077","10.575","0.015","21.6","0.03","16.5","0.02","90","","96.41","0.02","90","","3745","9","100","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H59 B Cu N P2 -","- C42 H59 B Cu N P2 -","- C168 H236 B4 Cu4 N4 P8 -","4","1","","Neal P. Mankad; William E. Antholine; Robert K. Szilagyi; Jonas C. Peters","Three-Coordinate Copper(I) Amido and Aminyl Radical Complexes","Journal of the American Chemical Society","2009","131","","3878","3880","10.1021/ja809834k","","","0.71073","MoKα","","0.2077","0.1187","","","0.2839","0.3511","","","","","","1.021","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104078","11.3014","0.0011","15.7553","0.0013","15.7553","0.0013","90","","90","","90","","2805.3","0.4","100","2","100","2","","","","","","","","5","P m m m","-P 2 2","47","","","","- C65 H113 N15 O19 Zn -","- C24 H17 N O6 Zn -","- C48 H34 N2 O12 Zn2 -","2","0.25","","Karen L. Mulfort; Omar K. Farha; Charlotte L. Stern; Amy A. Sarjeant; Joseph T. Hupp","Post-Synthesis Alkoxide Formation Within Metal-Organic Framework Materials: A Strategy for Incorporating Highly Coordinatively Unsaturated Metal Ions","Journal of the American Chemical Society","2009","131","","3866","3868","10.1021/ja809954r","","","0.71073","MoKα","","0.1477","0.1078","","","0.2575","0.2723","","","","","","0.793","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104079","5.916","0.004","7.695","0.005","21.225","0.013","90","","92.434","0.008","90","","965.4","1.1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H21 Br O3 -","- C22 H21 Br O3 -","- C44 H42 Br2 O6 -","2","1","","Ismail Ibrahem; Miao Yu; Richard R. Schrock; Amir H. Hoveyda","Highly Z- and Enantioselective Ring-Opening/Cross-Metathesis Reactions Catalyzed by Stereogenic-at-Mo Adamantylimido Complexes","Journal of the American Chemical Society","2009","131","","3844","3845","10.1021/ja900097n","","","0.71073","MoKα","","0.0438","0.0378","","","0.0899","0.0931","","","","","","1.011","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104080","9.6892","0.001","9.9873","0.001","10.4863","0.0011","78.256","0.002","64.72","0.001","75.357","0.002","882.45","0.16","130","2","130","2","","","","","","","","6","P 1","P 1","1","KB-VI-67","ellman01","","- C16 H24 Cl N O S -","- C16 H24 Cl N O S -","- C32 H48 Cl2 N2 O2 S2 -","2","2","","Katrien Brak; Jonathan A. Ellman","Asymmetric Synthesis of α-Branched Allylic Amines by the Rh(I)-Catalyzed Addition of Alkenyltrifluoroborates to N-tert-Butanesulfinyl Aldimines","Journal of the American Chemical Society","2009","131","","3850","3851","10.1021/ja9002603","","","0.71073","MoKα","","0.0841","0.0534","","","0.1047","0.1213","","","","","","1.033","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104081","10.4365","0.0007","17.1594","0.0012","20.0884","0.0013","90","","90","","90","","3597.5","0.4","153","1","153","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H39 N2 O7 P S2 -","- C36 H39 N2 O7 P S2 -","- C144 H156 N8 O28 P4 S8 -","4","1","","Jiming Zhang; Hua Wang; Ming Xian","An Unexpected Bis-ligation of S-Nitrosothiols","Journal of the American Chemical Society","2009","131","","3854","3855","10.1021/ja900370y","","","0.71073","MoKα","","0.0457","0.0447","","","0.1175","0.1184","","","","","","1.123","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104082","30.36","0.001","12.775","0.0004","13.5826","0.0004","90","","90","","90","","5268","0.3","","","623","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C18 I3 N6 Zn1.5 -","- C18 I3 N6 Zn1.25 -","- C144 I24 N48 Zn10 -","8","1","","Kazuaki Ohara; Javier Martí-Rujas; Tsuyoshi Haneda; Masaki Kawano; Daisuke Hashizume; Fujio Izumi; Makoto Fujita","Formation of a Thermally Stable, Porous Coordination Network via a Crystalline-to-Amorphous-to-Crystalline Phase Transition","Journal of the American Chemical Society","2009","131","","3860","3861","10.1021/ja9005145","powder diffraction","","0.9948","Synchrotron","","","0.0159","","","0.0209","","","","","","","","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104083","12.8366","0.0006","33.108","0.001","6.2214","0.0003","90","","99.818","0.003","90","","2605.33","0.19","","","95","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 I6 N13 O2 Zn3 -","- C42 I6 N13 O2 Zn3 -","- C84 I12 N26 O4 Zn6 -","2","1","","Kazuaki Ohara; Javier Martí-Rujas; Tsuyoshi Haneda; Masaki Kawano; Daisuke Hashizume; Fujio Izumi; Makoto Fujita","Formation of a Thermally Stable, Porous Coordination Network via a Crystalline-to-Amorphous-to-Crystalline Phase Transition","Journal of the American Chemical Society","2009","131","","3860","3861","10.1021/ja9005145","powder diffraction","","0.99967","Synchrotron","","","0.0262","","","0.0364","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104084","26.251","0.002","9.4449","0.0008","18.2801","0.0016","90","","105.527","0.002","90","","4366.9","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 B10 Zr -","- C18 H30 B10 Zr -","- C144 H240 B80 Zr8 -","8","1","","Shikuo Ren; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, and Reactivity of Zirconacyclopentene Incorporating a Carboranyl Unit","Journal of the American Chemical Society","2009","131","","3862","3863","10.1021/ja900563u","","","0.71073","MoKα","","0.041","0.0315","","","0.0782","0.0844","","","","","","1.048","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104085","10.182","0.002","17.545","0.004","10.182","0.002","90","","107.19","","90","","1737.7","0.6","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 B10 -","- C14 H24 B10 -","- C56 H96 B40 -","4","1","","Shikuo Ren; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, and Reactivity of Zirconacyclopentene Incorporating a Carboranyl Unit","Journal of the American Chemical Society","2009","131","","3862","3863","10.1021/ja900563u","","","0.71073","MoKα","","0.1112","0.0665","","","0.1594","0.1813","","","","","","1.019","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104086","10.2301","0.0017","18.885","0.003","16.192","0.003","90","","100.104","0.003","90","","3079.7","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28.5 H39 B10 N Zr -","- C28.5 H35 B10 N Zr -","- C114 H140 B40 N4 Zr4 -","4","1","","Shikuo Ren; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, and Reactivity of Zirconacyclopentene Incorporating a Carboranyl Unit","Journal of the American Chemical Society","2009","131","","3862","3863","10.1021/ja900563u","","","0.71073","MoKα","","0.0618","0.0419","","","0.1056","0.1195","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104087","8.217","0.0002","9.3974","0.0002","21.2212","0.0006","96.417","0.001","95.858","0.001","110.434","0.001","1508.32","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H39 B10 N Zr -","- C27 H39 B10 N Zr -","- C54 H78 B20 N2 Zr2 -","2","1","","Shikuo Ren; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, and Reactivity of Zirconacyclopentene Incorporating a Carboranyl Unit","Journal of the American Chemical Society","2009","131","","3862","3863","10.1021/ja900563u","","","0.71073","MoKα","","0.0358","0.0282","","","0.0703","0.0742","","","","","","1.017","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104088","7.3767","0.0006","10.9197","0.0009","15.7341","0.0014","90","","90","","90","","1267.4","0.19","153","1","153","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H9 N O4 S -","- C14 H9 N O4 S -","- C56 H36 N4 O16 S4 -","4","1","","Takeo Fukuzumi; Jeffrey W. Bode","A Reagent for the Convenient, Solid-Phase Synthesis of N-Terminal Peptide Hydroxylamines for Chemoselective Ligations","Journal of the American Chemical Society","2009","131","","3864","3865","10.1021/ja900601c","","","0.71073","MoKα","","0.029","0.0284","","","0.0684","0.0692","","","","","","1.123","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104089","9.819","0.002","10.829","0.002","11.772","0.003","90.172","0.004","105.664","0.003","102.286","0.003","1175.2","0.4","193","2","193","2","","","","","","","","2","P -1","-P 1","2","","","","- C32 H30 -","- C32 H30 -","- C64 H60 -","2","1","","Andrea Lucotti; Matteo Tommasini; Daniele Fazzi; Mirella Del Zoppo; Wesley A. Chalifoux; Michael J. Ferguson; Giuseppe Zerbi; Rik R. Tykwinski","Evidence for Solution-State Nonlinearity of sp-Carbon Chains Based on IR and Raman Spectroscopy: Violation of Mutual Exclusion","Journal of the American Chemical Society","2009","131","","4239","4244","10.1021/ja078198b","","","0.71073","MoKα","","0.0816","0.0544","","","0.1346","0.1551","","","","","","1.04","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104090","17.0112","0.0015","12.7895","0.0012","11.8476","0.0011","90","","97.322","0.001","90","","2556.6","0.4","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C32 H38 O -","- C32 H38 O -","- C128 H152 O4 -","4","0.5","","Andrea Lucotti; Matteo Tommasini; Daniele Fazzi; Mirella Del Zoppo; Wesley A. Chalifoux; Michael J. Ferguson; Giuseppe Zerbi; Rik R. Tykwinski","Evidence for Solution-State Nonlinearity of sp-Carbon Chains Based on IR and Raman Spectroscopy: Violation of Mutual Exclusion","Journal of the American Chemical Society","2009","131","","4239","4244","10.1021/ja078198b","","","0.71073","MoKα","","0.0828","0.0658","","","0.1856","0.2112","","","","","","1.047","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104091","9.439","0.0019","17.257","0.004","13.365","0.003","90","","93.96","0.03","90","","2171.8","0.8","301","2","301","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C41 H64 N2 O7 Ru -","- C41 H52 N2 O7 Ru -","- C82 H104 N4 O14 Ru2 -","2","1","","Zhen-Jiang Xu; Ran Fang; Cunyuan Zhao; Jie-Sheng Huang; Gong-Yong Li; Nianyong Zhu; Chi-Ming Che","cis-β-Bis(carbonyl) Ruthenium-Salen Complexes: X-ray Crystal Structures and Remarkable Catalytic Properties toward Asymmetric Intramolecular Alkene Cyclopropanation","Journal of the American Chemical Society","2009","131","","4405","4417","10.1021/ja8086399","","","0.71073","MoKα","","0.0731","0.0497","","","0.1118","0.1194","","","","","","0.816","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104092","11.893","0.002","12.535","0.003","19.076","0.004","90","","90","","90","","2843.8","1","301","2","301","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H36 N2 O4 Ru -","- C30 H36 N2 O4 Ru -","- C120 H144 N8 O16 Ru4 -","4","1","","Zhen-Jiang Xu; Ran Fang; Cunyuan Zhao; Jie-Sheng Huang; Gong-Yong Li; Nianyong Zhu; Chi-Ming Che","cis-β-Bis(carbonyl) Ruthenium-Salen Complexes: X-ray Crystal Structures and Remarkable Catalytic Properties toward Asymmetric Intramolecular Alkene Cyclopropanation","Journal of the American Chemical Society","2009","131","","4405","4417","10.1021/ja8086399","","","0.71073","MoKα","","0.0268","0.0261","","","0.0765","0.077","","","","","","1.172","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104093","15.678","0.003","16.111","0.003","20.109","0.004","85.14","0.03","88.56","0.03","68.73","0.03","4716.2","1.9","301","2","301","2","","","","","","","","6","P -1","-P 1","2","","","","- C52.5 H55 Cl N2 O4 Ru -","- C52.5 H55 Cl N2 O4 Ru -","- C210 H220 Cl4 N8 O16 Ru4 -","4","2","","Zhen-Jiang Xu; Ran Fang; Cunyuan Zhao; Jie-Sheng Huang; Gong-Yong Li; Nianyong Zhu; Chi-Ming Che","cis-β-Bis(carbonyl) Ruthenium-Salen Complexes: X-ray Crystal Structures and Remarkable Catalytic Properties toward Asymmetric Intramolecular Alkene Cyclopropanation","Journal of the American Chemical Society","2009","131","","4405","4417","10.1021/ja8086399","","","0.71073","MoKα","","0.0873","0.0421","","","0.0928","0.0989","","","","","","0.76","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104094","13.807","0.002","37.015","0.005","25.127","0.005","90","","100.764","0.009","90","","12616","4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C128 H182 Br3 N20 O3 Tb -","- C128 H182 Br3 N20 O3 Tb -","- C512 H728 Br12 N80 O12 Tb4 -","4","1","","Francesca Branzoli; Pietro Carretta; Marta Filibian; Giorgio Zoppellaro; Michael J. Graf; Jose R. Galan-Mascaros; Olaf Fuhr; Susan Brink; Mario Ruben","Spin Dynamics in the Negatively Charged Terbium (III) Bis-phthalocyaninato Complex","Journal of the American Chemical Society","2009","131","","4387","4396","10.1021/ja808649g","","","0.3425","synchrotron","","0.1136","0.0679","","","0.1569","0.1753","","","","","","1.03","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104095","9.7076","0.0004","16.4786","0.0007","12.0871","0.0006","90","","101.802","0.004","90","","1892.67","0.15","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 Hf -","- C24 H32 Hf -","- C96 H128 Hf4 -","4","1","","Torsten Beweries; Christian Fischer; Stephan Peitz; Vladimir V. Burlakov; Perdita Arndt; Wolfgang Baumann; Anke Spannenberg; Detlef Heller; Uwe Rosenthal","Combination of Spectroscopic Methods: In Situ NMR and UV/Vis Measurements To Understand the Formation of Group 4 Metallacyclopentanes from the Corresponding Metallacyclopropenes","Journal of the American Chemical Society","2009","131","","4463","4469","10.1021/ja809368s","","","0.71073","MoKα","","0.0227","0.017","","","0.0384","0.0393","","","","","","1.026","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104096","38.6584","0.0015","38.6584","0.0015","38.6584","0.0015","90","","90","","90","","57774","4","150","2","150","2","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C176 H532 Ge7 Mn12 N44 O360 W72 -","- C193.2 Ge7 Mn12 O286 W72 -","- C772.8 Ge28 Mn48 O1144 W288 -","4","0.0833333","","Johannes Thiel; Chris Ritchie; Carsten Streb; De-Liang Long; Leroy Cronin","Heteroatom-Controlled Kinetics of Switchable Polyoxometalate Frameworks","Journal of the American Chemical Society","2009","131","","4180","4181","10.1021/ja809422k","","","0.71073","MoKα","","0.0792","0.0572","","","0.1464","0.1545","","","","","","0.929","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104097","39.2899","0.0006","39.2899","0.0006","39.2899","0.0006","90","","90","","90","","60651.7","1.6","150","2","150","2","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C190 H538 Ge7 Mn12 N40 O386 W72 -","- C228 Ge7 Mn12 O275.2 W72 -","- C912 Ge28 Mn48 O1100.8 W288 -","4","0.0833333","","Johannes Thiel; Chris Ritchie; Carsten Streb; De-Liang Long; Leroy Cronin","Heteroatom-Controlled Kinetics of Switchable Polyoxometalate Frameworks","Journal of the American Chemical Society","2009","131","","4180","4181","10.1021/ja809422k","","","1.54184","CuKα","","0.1766","0.12","","","0.3157","0.3592","","","","","","1.084","","","","has coordinates","178786","2020-10-21","18:00:00",""
"4104098","42.1589","0.0008","42.1589","0.0008","52.5682","0.001","90","","90","","120","","80916","3","95","2","95","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C132 H66 O39 S6 Zn12 -","- C130.928 H66 O39 S7.072 Zn12 -","- C785.568 H396 O234 S42.432 Zn72 -","6","0.5","","Kyoungmoo Koh; Antek G. Wong-Foy; Adam J. Matzger","A Porous Coordination Copolymer with over 5000 m2/g BET Surface Area","Journal of the American Chemical Society","2009","131","","4184","4185","10.1021/ja809985t","","","1.54187","CuKα","","0.132","0.0773","","","0.1899","0.2136","","","","","","0.979","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4104099","15.619","0.004","13.467","0.003","18.643","0.005","90","","113.326","0.003","90","","3600.9","1.6","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H37 N5 -","- C48 H37 N5 -","- C192 H148 N20 -","4","1","","Yuta Kishimoto; Jiro Abe","A Fast Photochromic Molecule That Colors Only under UV Light","Journal of the American Chemical Society","2009","131","","4227","4229","10.1021/ja810032t","","","0.71073","MoKα","","0.0562","0.0414","","","0.0936","0.1014","","","","","","0.999","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104100","5.6878","0.0002","5.6878","0.0002","8.2258","0.0002","90","","90","","90","","266.113","0.015","294","2","294","2","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","","","- Eu K Na O5 Ta -","- Eu K Na O5 Ta -","- Eu2 K2 Na2 O10 Ta2 -","2","0.125","","Irina P. Roof; Mark D. Smith; Sangmoon Park; Hans-Conrad zur Loye","EuKNaTaO5: Crystal Growth, Structure and Photoluminescence Property","Journal of the American Chemical Society","2009","131","","4202","4203","10.1021/ja8100769","","","0.71073","MoKα","","0.0202","0.018","","","0.0389","0.0401","","","","","","1.168","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104101","6.2669","","9.2991","","15.9031","","69.1766","","80.9397","","86.5353","","855.423","","173.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H18 N2 O2 -","- C23 H18 N2 O2 -","- C46 H36 N4 O4 -","2","1","","Itaru Nakamura; Yusuke Sato; Masahiro Terada","Platinum-Catalyzed Dehydroalkoxylation-Cyclization Cascade via N-O Bond Cleavage","Journal of the American Chemical Society","2009","131","","4198","4199","10.1021/ja900174t","","","0.7107","MoKα","","","0.0645","","","","0.2228","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104102","11.569","0.013","15.447","0.016","21.19","0.02","76.794","0.012","79.025","0.014","89.615","0.011","3617","7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H48 F10 N8 O11 Zn3 -","- C82 H48 F10 N8 O11 Zn3 -","- C82 H48 F10 N8 O11 Zn3 -","1","0.5","","Abraham M. Shultz; Omar K. Farha; Joseph T. Hupp; SonBinh T. Nguyen","A Catalytically Active, Permanently Microporous MOF with Metalloporphyrin Struts","Journal of the American Chemical Society","2009","131","","4204","4205","10.1021/ja900203f","","","0.71073","MoKα","","0.2097","0.1095","","","0.3315","0.3818","","","","","","1.095","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104103","14.4252","0.0008","14.2019","0.0008","26.7176","0.0015","90","","94.957","0.003","90","","5453","0.5","89","2","89","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C58 H82 Mg2 N4 -","- C58 H82 Mg2 N4 -","- C232 H328 Mg8 N16 -","4","1","","Jacob Overgaard; Cameron Jones; Andreas Stasch; Bo B. Iversen","Experimental Electron Density Study of the Mg-Mg Bonding Character in a Magnesium(I) Dimer","Journal of the American Chemical Society","2009","131","","4208","4209","10.1021/ja900385u","","x-ray","0.71073","MoKα","","0.0475","0.037","","","","0.0678","","","","","","1.476","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104104","13.138","0.002","13.301","0.002","15.464","0.004","105.16","0.003","100.332","0.003","115.281","0.002","2223.5","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H144 K2 Mg2 N4 O8 -","- C88 H144 K2 Mg2 N4 O8 -","- C88 H144 K2 Mg2 N4 O8 -","1","0.5","","Yanyan Liu; Shaoguang Li; Xiao-Juan Yang; Peiju Yang; Biao Wu","Magnesium-Magnesium Bond Stabilized by a Doubly Reduced α-Diimine: Synthesis and Structure of [K(THF)3]2[LMg-MgL] (L = [(2,6-iPr2C6H3)NC(Me)]22-)","Journal of the American Chemical Society","2009","131","","4210","4211","10.1021/ja900568c","","","0.71073","MoKα","","0.1019","0.0633","","","0.1723","0.2011","","","","","","1.033","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104105","9.3464","0.0012","9.6524","0.0012","17.381","0.002","91.468","0.002","99.123","0.002","95.298","0.002","1540.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H30 F3 P2 Rh -","- C37 H30 F3 P2 Rh -","- C74 H60 F6 P4 Rh2 -","2","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3Rh(X)]: The Extreme Case of X = CF3","Journal of the American Chemical Society","2009","131","","4236","4238","10.1021/ja9005699","","","0.71073","MoKα","","0.05","0.0388","","","0.0935","0.0997","","","","","","1.031","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104106","9.1363","0.0005","37.72","0.002","9.7614","0.0006","90","","110.106","0.001","90","","3159","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H30 F3 P2 Rh -","- C37 H30 F3 P2 Rh -","- C148 H120 F12 P8 Rh4 -","4","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3Rh(X)]: The Extreme Case of X = CF3","Journal of the American Chemical Society","2009","131","","4236","4238","10.1021/ja9005699","","","0.71073","MoKα","","0.0996","0.0505","","","0.0992","0.1189","","","","","","1.04","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104107","19.926","0.003","12.729","0.0016","17.631","0.002","90","","90","","90","","4471.9","1","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C55 H45 F3 P3 Rh -","- C55 H45 F3 P3 Rh -","- C220 H180 F12 P12 Rh4 -","4","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3Rh(X)]: The Extreme Case of X = CF3","Journal of the American Chemical Society","2009","131","","4236","4238","10.1021/ja9005699","","","0.71073","MoKα","","0.0333","0.027","","","0.0569","0.0598","","","","","","1.031","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104108","9.261","0.004","10.51","0.004","18.064","0.007","76.432","0.008","80.403","0.019","65.506","0.008","1550.5","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H30 F O P2 Rh -","- C37 H30 F O P2 Rh -","- C74 H60 F2 O2 P4 Rh2 -","2","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3Rh(X)]: The Extreme Case of X = CF3","Journal of the American Chemical Society","2009","131","","4236","4238","10.1021/ja9005699","","","0.71073","MoKα","","0.0427","0.034","","","0.0849","0.0899","","","","","","1.057","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104109","11.4848","0.0014","18.012","0.002","17.4575","0.0017","90","","114.692","0.006","90","","3281.1","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H33 F O P2 Rh -","- C40 H33 F O P2 Rh -","- C160 H132 F4 O4 P8 Rh4 -","4","1","","Jenni Goodman; Vladimir V. Grushin; Roman B. Larichev; Stuart A. Macgregor; William J. Marshall; D. Christopher Roe","Fluxionality of [(Ph3P)3Rh(X)]: The Extreme Case of X = CF3","Journal of the American Chemical Society","2009","131","","4236","4238","10.1021/ja9005699","","","0.71073","MoKα","","0.044","0.0318","","","0.0745","0.0806","","","","","","1.043","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104110","9.1637","0.0012","7.3171","0.0008","10.012","0.0014","90","","99.744","0.01","90","","661.64","0.15","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H18 Br N O -","- C13 H18 Br N O -","- C26 H36 Br2 N2 O2 -","2","1","","Jian-Hua Xie; Sheng Liu; Wei-Ling Kong; Wen-Ju Bai; Xiao-Chen Wang; Li-Xin Wang; Qi-Lin Zhou","Highly Enantioselective and Diastereoselective Synthesis of Chiral Amino Alcohols by Ruthenium-Catalyzed Asymmetric Hydrogenation of α-Amino Aliphatic Ketones","Journal of the American Chemical Society","2009","131","","4222","4223","10.1021/ja901058u","","","0.7107","MoKα","","0.0601","0.0273","","","0.0509","0.0594","","","","","","0.861","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104111","9.232","0.003","9.528","0.003","11.026","0.004","90","","93.783","0.005","90","","967.8","0.6","113","2","113","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C19 H23 Br N2 O2 S -","- C19 H23 Br N2 O2 S -","- C38 H46 Br2 N4 O4 S2 -","2","1","","Jian-Hua Xie; Sheng Liu; Wei-Ling Kong; Wen-Ju Bai; Xiao-Chen Wang; Li-Xin Wang; Qi-Lin Zhou","Highly Enantioselective and Diastereoselective Synthesis of Chiral Amino Alcohols by Ruthenium-Catalyzed Asymmetric Hydrogenation of α-Amino Aliphatic Ketones","Journal of the American Chemical Society","2009","131","","4222","4223","10.1021/ja901058u","","","0.7107","MoKα","","0.0378","0.0255","","","0.0472","0.0492","","","","","","0.856","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104112","7.6356","0.0015","11.305","0.002","28.065","0.006","90","","93.03","0.03","90","","2419.2","0.8","85","2","85","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C112 H96 Cl8 N8 O16 -","8","2","","Vilmalí López-Mejías; Jeff W. Kampf; Adam J. Matzger","Polymer-Induced Heteronucleation of Tolfenamic Acid: Structural Investigation of a Pentamorph","Journal of the American Chemical Society","2009","131","","4554","4555","10.1021/ja806289a","","","0.71073","MoKα","","0.0488","0.0448","","","0.1169","0.1208","","","","","","1.057","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104113","7.5237","0.0008","14.3308","0.0016","17.592","0.002","103.68","0.002","98.253","0.002","93.038","0.002","1816.4","0.3","85","2","85","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C84 H72 Cl6 N6 O12 -","6","3","","Vilmalí López-Mejías; Jeff W. Kampf; Adam J. Matzger","Polymer-Induced Heteronucleation of Tolfenamic Acid: Structural Investigation of a Pentamorph","Journal of the American Chemical Society","2009","131","","4554","4555","10.1021/ja806289a","","","0.71073","MoKα","","0.0888","0.0723","","","0.1658","0.1752","","","","","","1.109","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104114","7.6488","0.0013","9.016","0.0015","9.4184","0.0015","107.385","0.003","92.062","0.003","101.662","0.003","603.81","0.17","85","2","85","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C28 H24 Cl2 N2 O4 -","2","1","","Vilmalí López-Mejías; Jeff W. Kampf; Adam J. Matzger","Polymer-Induced Heteronucleation of Tolfenamic Acid: Structural Investigation of a Pentamorph","Journal of the American Chemical Society","2009","131","","4554","4555","10.1021/ja806289a","","","0.71073","MoKα","","0.0933","0.0658","","","0.1257","0.1374","","","","","","1.037","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104115","13.8094","0.0009","15.6034","0.0008","15.091","0.001","90","","100.736","0.004","90","","3194.8","0.3","93.1","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C31 H29 Br4 Fe N4 O2 -","- C31 H29 Br4 Fe N4 O2 -","- C124 H116 Br16 Fe4 N16 O8 -","4","1","","Yuki Masuda; Masato Kuratsu; Shuichi Suzuki; Masatoshi Kozaki; Daisuke Shiomi; Kazunobu Sato; Takeji Takui; Yuko Hosokoshi; Xiao-Zheng Lan; Yuji Miyazaki; Akira Inaba; Keiji Okada","A New Ferrimagnet Based on a Radical-Substituted Radical Cation Salt","Journal of the American Chemical Society","2009","131","","4670","4673","10.1021/ja808093z","","","0.7107","MoKα","","","0.0443","","","","0.067","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104116","8.092","0.0002","9.351","0.0003","13.391","0.0004","96.331","0.0011","100.918","0.0011","94.608","0.0014","983.53","0.05","130","2","130","2","","","","","","","","7","P -1","-P 1","2","etsai1","etsai1","","- C20 H16 B F4 N4 O2 V -","- C20 H16 B F4 N4 O2 V -","- C40 H32 B2 F8 N8 O4 V2 -","2","1","","Christopher R. Waidmann; Xin Zhou; Erin A. Tsai; Werner Kaminsky; David A. Hrovat; Weston Thatcher Borden; James M. Mayer","Slow Hydrogen Atom Transfer Reactions of Oxo- and Hydroxo-Vanadium Compounds: The Importance of Intrinsic Barriers","Journal of the American Chemical Society","2009","131","","4729","4743","10.1021/ja808698x","","","0.71073","MoKα","","0.0592","0.0443","","","0.1132","0.1228","","","","","","1.047","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104117","11.677","0.002","16.749","0.003","20.009","0.004","90","","94.81","0.03","90","","3899.5","1.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 N2 O3 -","- C23 H22 N2 O3 -","- C184 H176 N16 O24 -","8","2","","Pauline N. Wyrembak; Andrew D. Hamilton","Alkyne-Linked 2,2-Disubstituted-indolin-3-one Oligomers as Extended β-Strand Mimetics","Journal of the American Chemical Society","2009","131","","4566","4567","10.1021/ja809245t","","","0.71073","MoKα","","0.1773","0.0628","","","0.099","0.1213","","","","","","1.011","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104118","16.3702","0.0003","17.3857","0.0003","10.7245","0.0002","90","","106.041","0.001","90","","2933.43","0.09","93.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 N3 O4 -","- C35 H31 N3 O4 -","- C140 H124 N12 O16 -","4","1","","Pauline N. Wyrembak; Andrew D. Hamilton","Alkyne-Linked 2,2-Disubstituted-indolin-3-one Oligomers as Extended β-Strand Mimetics","Journal of the American Chemical Society","2009","131","","4566","4567","10.1021/ja809245t","","","0.71075","MoKα","","","0.0952","","","","0.2779","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104119","18.2715","0.0003","18.2715","0.0003","17.0912","0.0003","90","","90","","90","","5705.86","0.17","143","2","143","2","","","","","","","","4","P 4","P 4","75","","","","- C28 H6 Cu2 O11 -","- C28 H6 Cu2 O11 -","- C112 H24 Cu8 O44 -","4","1","","Liqing Ma; David J. Mihalcik; Wenbin Lin","Highly Porous and Robust 4,8-Connected Metal-Organic Frameworks for Hydrogen Storage","Journal of the American Chemical Society","2009","131","","4610","4612","10.1021/ja809590n","","","1.54178","CuKα","","0.0697","0.0563","","","0.1473","0.1564","","","","","","0.936","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104120","18.2959","0.0003","18.2959","0.0003","17.1099","0.0003","90","","90","","90","","5727.37","0.17","200","2","200","2","","","","","","","","4","P 4","P 4","75","","","","- C28 H6 Cu2 O11 -","- C28 H6 Cu2 O11 -","- C112 H24 Cu8 O44 -","4","1","","Liqing Ma; David J. Mihalcik; Wenbin Lin","Highly Porous and Robust 4,8-Connected Metal-Organic Frameworks for Hydrogen Storage","Journal of the American Chemical Society","2009","131","","4610","4612","10.1021/ja809590n","","","1.54178","CuKα","","0.065","0.0546","","","0.1519","0.1606","","","","","","1.02","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104121","18.0725","0.0009","18.0725","0.0009","17.1854","0.0011","90","","90","","90","","5613","0.5","200","2","200","2","","","","","","","","4","P 4","P 4","75","","","","- C26 H6 Cu2 O11 -","- C26 H6 Cu2 O11 -","- C104 H24 Cu8 O44 -","4","1","","Liqing Ma; David J. Mihalcik; Wenbin Lin","Highly Porous and Robust 4,8-Connected Metal-Organic Frameworks for Hydrogen Storage","Journal of the American Chemical Society","2009","131","","4610","4612","10.1021/ja809590n","","","1.54178","CuKα","","0.1262","0.0644","","","0.1424","0.1614","","","","","","0.842","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104122","18.0648","0.0012","18.0648","0.0012","17.1132","0.0012","90","","90","","90","","5584.7","0.7","200","2","200","2","","","","","","","","4","P 4","P 4","75","","","","- C33 H6 Cu2 O11 -","- C33 H6 Cu2 O11 -","- C132 H24 Cu8 O44 -","4","1","","Liqing Ma; David J. Mihalcik; Wenbin Lin","Highly Porous and Robust 4,8-Connected Metal-Organic Frameworks for Hydrogen Storage","Journal of the American Chemical Society","2009","131","","4610","4612","10.1021/ja809590n","","","1.54178","CuKα","","0.1295","0.0774","","","0.1899","0.2113","","","","","","1.012","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104123","28.127","0.013","28.127","","8.879","0.0026","90","","90","","90","","7024","4","298","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C41 H28 N4 -","- C41 H28 N4 -","- C164 H112 N16 -","4","0.25","","Fernando J. Uribe-Romo; Joseph R. Hunt; Hiroyasu Furukawa; Cornelius Klöck; Michael O'Keeffe; Omar M. Yaghi","A Crystalline Imine-Linked 3-D Porous Covalent Organic Framework","Journal of the American Chemical Society","2009","131","","4570","4571","10.1021/ja8096256","powder diffraction","x-ray","1.54059","Kα~1~","","","","","","","","11.91","","11.91","","","","","","","has coordinates,has Fobs","178787","2020-10-21","18:00:00",""
"4104124","6.8576","0.0002","6.8576","0.0002","8.2251","0.0004","90","","90","","120","","334.98","0.02","295","","295","","","","","","","","","5","P 3 1 2","P 3 2","149","","","","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","1","0.166667","","Jasmine L. Korčok; Michael J. Katz; Daniel B. Leznoff","Impact of Metallophilicity on ""Colossal"" Positive and Negative Thermal Expansion in a Series of Isostructural Dicyanometallate Coordination Polymers","Journal of the American Chemical Society","2009","131","","4866","4871","10.1021/ja809631r","","","0.71073","MoKα","","0.033","0.019","","0.0225","0.0198","0.0193","","","","","","0.4331","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104125","6.7652","0.0001","6.7652","0.0001","8.3094","0.0004","90","","90","","120","","329.353","0.017","100","","100","","","","","","","","","5","P 3 1 2","P 3 2","149","","","","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","1","0.166667","","Jasmine L. Korčok; Michael J. Katz; Daniel B. Leznoff","Impact of Metallophilicity on ""Colossal"" Positive and Negative Thermal Expansion in a Series of Isostructural Dicyanometallate Coordination Polymers","Journal of the American Chemical Society","2009","131","","4866","4871","10.1021/ja809631r","","","0.71073","MoKα","","0.0266","0.0194","","0.0212","0.02","0.0194","","","","","","0.47","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104126","6.8107","0.0001","6.8107","0.0001","8.2665","0.0003","90","","90","","120","","332.075","0.014","205","","205","","","","","","","","","5","P 3 1 2","P 3 2","149","","","","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","1","0.166667","","Jasmine L. Korčok; Michael J. Katz; Daniel B. Leznoff","Impact of Metallophilicity on ""Colossal"" Positive and Negative Thermal Expansion in a Series of Isostructural Dicyanometallate Coordination Polymers","Journal of the American Chemical Society","2009","131","","4866","4871","10.1021/ja809631r","","","0.71073","MoKα","","0.032","0.0185","","0.018","0.0161","0.0156","","","","","","0.4574","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104127","6.9098","0.0002","6.9098","0.0002","8.1724","0.0004","90","","90","","120","","337.92","0.02","395","","395","","","","","","","","","5","P 3 1 2","P 3 2","149","","","","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","- C6 Au3 Cd K N6 -","1","0.166667","","Jasmine L. Korčok; Michael J. Katz; Daniel B. Leznoff","Impact of Metallophilicity on ""Colossal"" Positive and Negative Thermal Expansion in a Series of Isostructural Dicyanometallate Coordination Polymers","Journal of the American Chemical Society","2009","131","","4866","4871","10.1021/ja809631r","","","0.71073","MoKα","","0.0575","0.0244","","0.0356","0.0246","0.0233","","","","","","0.5305","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104128","6.2981","0.0014","7.551","0.0016","25.114","0.006","90","","90","","90","","1194.3","0.5","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H10 Cl N O4 -","- C12 H10 Cl N O4 -","- C48 H40 Cl4 N4 O16 -","4","1","","Barry M. Trost; Julien Hitce","Direct Asymmetric Michael Addition to Nitroalkenes: Vinylogous Nucleophilicity under Dinuclear Zinc Catalysis","Journal of the American Chemical Society","2009","131","","4572","4573","10.1021/ja809723u","","","0.71073","MoKα","","0.0304","0.0275","","","0.0692","0.0706","","","","","","1.053","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104129","6.064","0.0009","10.0246","0.0015","19.24","0.003","90","","90","","90","","1169.6","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","08237b","","","- C12 H13 N O6 -","- C12 H13 N O6 -","- C48 H52 N4 O24 -","4","1","","Barry M. Trost; Julien Hitce","Direct Asymmetric Michael Addition to Nitroalkenes: Vinylogous Nucleophilicity under Dinuclear Zinc Catalysis","Journal of the American Chemical Society","2009","131","","4572","4573","10.1021/ja809723u","","","0.71073","MoKα","","0.0337","0.0293","","","0.0752","0.0785","","","","","","1.048","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104130","9.4272","0.0019","20.353","0.004","27.946","0.006","90","","90","","90","","5362","1.9","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C50 H65 N7 O10 -","- C50 H65 N7 O10 -","- C200 H260 N28 O40 -","4","1","","Hayato Ishikawa; David A. Colby; Shigeki Seto; Porino Va; Annie Tam; Hiroyuki Kakei; Thomas J. Rayl; Inkyu Hwang; Dale L. Boger","Total Synthesis of Vinblastine, Vincristine, Related Natural Products, and Key Structural Analogues","Journal of the American Chemical Society","2009","131","","4904","4916","10.1021/ja809842b","","","0.71073","MoKα","","0.1648","0.0997","","","0.24","0.2796","","","","","","1.075","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104131","8.341","0.0002","17.2024","0.0004","27.0985","0.0006","90","","91.702","0.001","90","","3886.52","0.16","127.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C51 H50 Zr -","- C51 H50 Zr -","- C204 H200 Zr4 -","4","1","","Adam D. Miller; John F. Tannaci; Samuel A. Johnson; Hyuk Lee; Jennifer L. McBee; T. Don Tilley","Mesityl Alkyne Substituents for Control of Regiochemistry and Reversibility in Zirconocene Couplings: New Synthetic Strategies for Unsymmetrical Zirconacyclopentadienes and Conjugated Polymers","Journal of the American Chemical Society","2009","131","","4917","4927","10.1021/ja809896t","","","0.7107","MoKα","","","0.0403","","","","0.045","","","","","","1.4","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104132","20.786","0.007","17.808","0.006","8.229","0.003","90","","90","","90","","3046","1.8","140","2","140","2","","","","","","","","3","P n n a","-P 2a 2bc","52","","","","- C38 H46 Zr -","- C38 H46 Zr -","- C152 H184 Zr4 -","4","0.5","","Adam D. Miller; John F. Tannaci; Samuel A. Johnson; Hyuk Lee; Jennifer L. McBee; T. Don Tilley","Mesityl Alkyne Substituents for Control of Regiochemistry and Reversibility in Zirconocene Couplings: New Synthetic Strategies for Unsymmetrical Zirconacyclopentadienes and Conjugated Polymers","Journal of the American Chemical Society","2009","131","","4917","4927","10.1021/ja809896t","","","0.71073","MoKα","","0.0973","0.0371","","","0.0641","0.0719","","","","","","0.708","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104133","10.4214","0.0015","7.429","0.0011","14.284","0.002","90","","92.094","0.002","90","","1105.1","0.3","146","2","146","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C30 H26 -","- C30 H26 -","- C60 H52 -","2","0.5","","Adam D. Miller; John F. Tannaci; Samuel A. Johnson; Hyuk Lee; Jennifer L. McBee; T. Don Tilley","Mesityl Alkyne Substituents for Control of Regiochemistry and Reversibility in Zirconocene Couplings: New Synthetic Strategies for Unsymmetrical Zirconacyclopentadienes and Conjugated Polymers","Journal of the American Chemical Society","2009","131","","4917","4927","10.1021/ja809896t","","","0.71073","MoKα","","0.0826","0.0556","","","0.1423","0.1563","","","","","","1.169","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104134","8.35","0.003","11.514","0.004","17.134","0.007","74.7","0.005","80.995","0.005","79.982","0.006","1554","1","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H46 Zr -","- C38 H46 Zr -","- C76 H92 Zr2 -","2","1","","Adam D. Miller; John F. Tannaci; Samuel A. Johnson; Hyuk Lee; Jennifer L. McBee; T. Don Tilley","Mesityl Alkyne Substituents for Control of Regiochemistry and Reversibility in Zirconocene Couplings: New Synthetic Strategies for Unsymmetrical Zirconacyclopentadienes and Conjugated Polymers","Journal of the American Chemical Society","2009","131","","4917","4927","10.1021/ja809896t","","","0.71073","MoKα","","0.0998","0.0555","","","0.1149","0.1313","","","","","","0.972","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104135","20.1802","0.0005","28.0519","0.0008","29.3278","0.0008","90","","108.36","0.01","90","","15757.1","1.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C152 H135 F48 N25 O4 P8 -","- C152 H135 F48 N25 O4 P8 -","- C608 H540 F192 N100 O16 P32 -","4","1","","Asha Brown; Kathleen M. Mullen; Jay Ryu; Michał J. Chmielewski; Sérgio M. Santos; Vitor Felix; Amber L. Thompson; John E. Warren; Sofia I. Pascu; Paul D. Beer","Interlocked Host Anion Recognition by an Indolocarbazole-Containing [2]Rotaxane","Journal of the American Chemical Society","2009","131","","4937","4952","10.1021/ja809905x","","","0.6942","synchrotron","","0.2148","0.1422","","0.1927","0.157","0.157","","","","","","1.0987","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104136","23.8889","0.0002","8.2835","0.0001","29.5789","0.0003","90","","107.818","0.0004","90","","5572.41","0.1","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H48 F24 N8 O2 P4 -","- C46 H48 F24 N8 O2 P4 -","- C184 H192 F96 N32 O8 P16 -","4","1","","Asha Brown; Kathleen M. Mullen; Jay Ryu; Michał J. Chmielewski; Sérgio M. Santos; Vitor Felix; Amber L. Thompson; John E. Warren; Sofia I. Pascu; Paul D. Beer","Interlocked Host Anion Recognition by an Indolocarbazole-Containing [2]Rotaxane","Journal of the American Chemical Society","2009","131","","4937","4952","10.1021/ja809905x","","","0.71073","MoKα","","0.1427","0.0737","","0.1133","0.0739","0.0739","","","","","","0.9625","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104137","17.3377","0.0006","17.3377","0.0006","14.7455","0.0005","90","","90","","90","","4432.4","0.3","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C60 H80 Cu4 N8 O26 -","- C60 H80 Cu4 N8 O26 -","- C120 H160 Cu8 N16 O52 -","2","0.25","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.0998","0.0699","","","0.1511","0.1662","","","","","","1.074","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104138","17.4666","0.0007","17.4666","0.0007","14.7514","0.0006","90","","90","","90","","4500.4","0.3","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C60 H80 Cu4 N8 O32 -","- C60 H80 Cu4 N8 O32 -","- C120 H160 Cu8 N16 O64 -","2","0.25","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.1004","0.0749","","","0.1591","0.172","","","","","","1.105","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104139","17.363","0.003","17.363","0.003","14.709","0.003","90","","90","","90","","4434.4","1.4","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C60 H80 Cu4 N8 O36 -","- C60 H80 Cu4 N8 O36 -","- C120 H160 Cu8 N16 O72 -","2","0.25","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.1234","0.0722","","","0.1651","0.1916","","","","","","1.033","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104140","17.5453","0.0011","17.5453","0.0011","14.7194","0.0011","90","","90","","90","","4531.2","0.5","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C60 H80 Cu4 N8 O24 -","- C60 H80 Cu4 N8 O24 -","- C120 H160 Cu8 N16 O48 -","2","0.25","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.1035","0.0482","","","0.1031","0.1165","","","","","","0.881","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104141","17.267","0.002","17.267","0.002","14.68","0.003","90","","90","","90","","4376.8","1.1","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C60 H80 Cu4 N8 O26 -","- C60 H80 Cu4 N8 O26 -","- C120 H160 Cu8 N16 O52 -","2","0.25","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.1016","0.0767","","","0.1919","0.2101","","","","","","1.062","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104142","17.3525","0.0006","17.3525","0.0006","14.7188","0.0005","90","","90","","90","","4432","0.3","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C15 H20 Cu N2 O9 -","- C15 H20 Cu N2 O9 -","- C120 H160 Cu8 N16 O72 -","8","1","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.0655","0.0511","","","0.1193","0.1255","","","","","","1.045","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104143","17.1318","0.0005","17.1318","0.0005","15.0575","0.0005","90","","90","","90","","4419.4","0.2","293","2","293","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C56 H80 Cu4 N8 O30 -","- C56 H80 Cu4 N8 O30 -","- C112 H160 Cu8 N16 O60 -","2","0.25","","Cristian D. Ene; Augustin M. Madalan; Catalin Maxim; Bogdan Jurca; Narcis Avarvari; Marius Andruh","Constructing Robust Channel Structures by Packing Metallacalixarenes: Reversible Single-Crystal-to-Single-Crystal Dehydration","Journal of the American Chemical Society","2009","131","","4586","4587","10.1021/ja900416e","","","0.71073","MoKα","","0.0814","0.0643","","","0.1721","0.1839","","","","","","1.088","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104144","10.696","0.009","11.903","0.009","17.801","0.014","96.228","0.013","102.202","0.012","99.063","0.014","2164","3","193.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C41 H55 N3 O6 Rh2 S3 -","- C41 H31 N3 O6 Rh2 S3 -","- C82 H62 N6 O12 Rh4 S6 -","2","1","","Koji Ishiwata; Shigeki Kuwata; Takao Ikariya","Hydrogen- and Oxygen-Driven Interconversion between Imido-Bridged Dirhodium(III) and Amido-Bridged Dirhodium(II) Complexes","Journal of the American Chemical Society","2009","131","","5001","5009","10.1021/ja900650j","","","0.7107","MoKα","","","0.1067","","","","0.2378","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104145","4.962","0.003","13.451","0.005","34.045","0.01","90","","90","","90","","2272.3","1.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","benzyl-6-chloro-2-phenyl-1,2,3,4-tetrahydroquinolin-4-ylcarbamate","","- C24.44 H25.32 Cl N2 O2.72 -","- C23 H21 Cl N2 O2 -","- C92 H84 Cl4 N8 O8 -","4","1","","Hua Liu; Guillaume Dagousset; Géraldine Masson; Pascal Retailleau; Jieping Zhu","Chiral Brønsted Acid-Catalyzed Enantioselective Three-Component Povarov Reaction","Journal of the American Chemical Society","2009","131","","4598","4599","10.1021/ja900806q","","","0.71069","MoKα","","0.0823","0.0656","","","0.1635","0.1749","","","","","","1.105","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104146","15.529","0.003","17.296","0.004","20.897","0.004","90","","90","","90","","5613","2","133","2","133","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C29 H43 N3 Si -","- C29 H43 N3 Si -","- C232 H344 N24 Si8 -","8","1","","Anukul Jana; Carola Schulzke; Herbert W. Roesky","Oxidative Addition of Ammonia at a Silicon(II) Center and an Unprecedented Hydrogenation Reaction of Compounds with Low-Valent Group 14 Elements Using Ammonia Borane","Journal of the American Chemical Society","2009","131","","4600","4601","10.1021/ja900880z","","","0.71073","MoKα","","0.0782","0.0625","","","0.1443","0.1523","","","","","","1.112","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104147","13.512","0.0002","22.591","0.0003","14.469","0.0002","90","","92.453","0.001","90","","4412.61","0.11","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C48 H51 B F4 N2 O P2 Ru -","- C48 H51 B F4 N2 O P2 Ru -","- C192 H204 B4 F16 N8 O4 P8 Ru4 -","4","1","","L. Jonas L. Häller; Michael J. Page; Stuart A. Macgregor; Mary F. Mahon; Michael K. Whittlesey","Activation of an Alkyl C-H Bond Geminal to an Agostic Interaction: An Unusual Mode of Base-Induced C-H Activation","Journal of the American Chemical Society","2009","131","","4604","4605","10.1021/ja900953d","","","0.71073","MoKα","","0.1118","0.0777","","","0.1426","0.1537","","","","","","1.212","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104148","10.951","0.0001","12.577","0.0002","18.74","0.0004","104.068","0.001","97.078","0.001","110.121","0.001","2289.44","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H58 N2 O2 P2 Ru -","- C52 H58 N2 O2 P2 Ru -","- C104 H116 N4 O4 P4 Ru2 -","2","1","","L. Jonas L. Häller; Michael J. Page; Stuart A. Macgregor; Mary F. Mahon; Michael K. Whittlesey","Activation of an Alkyl C-H Bond Geminal to an Agostic Interaction: An Unusual Mode of Base-Induced C-H Activation","Journal of the American Chemical Society","2009","131","","4604","4605","10.1021/ja900953d","","","0.71073","MoKα","","0.0605","0.0418","","","0.0976","0.1062","","","","","","1.027","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104149","9.0526","0.001","14.0417","0.0016","28.238","0.003","90","","99.027","0.002","90","","3545","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H60 Os P Sn -","- C34 H61 Os P Sn -","- C136 H244 Os4 P4 Sn4 -","4","1","","Paul G. Hayes; Christopher W. Gribble; Rory Waterman; T. Don Tilley","A Hydrogen-Substituted Osmium Stannylene Complex: Isomerization to a Metallostannylene Complex via an Unusual α-Hydrogen Migration from Tin to Osmium","Journal of the American Chemical Society","2009","131","","4606","4607","10.1021/ja901050m","","","0.71073","MoKα","","0.0704","0.0481","","","0.1081","0.1165","","","","","","0.924","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104150","36.34","0.06","10.129","0.016","11.281","0.018","90","","97.7","0.04","90","","4115","11","202","2","202","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C47 H55 N3 -","- C47 H55 N3 -","- C188 H220 N12 -","4","0.5","","Titel Jurca; Justin Lummiss; Tara J. Burchell; Serge I. Gorelsky; Darrin S. Richeson","Capturing In+ Monomers in a Neutral Weakly Coordinating Environment","Journal of the American Chemical Society","2009","131","","4608","4609","10.1021/ja901128q","","","0.71073","MoKα","","0.1037","0.0572","","","0.1307","0.1543","","","","","","1.054","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104151","11.344","0.002","14.775","0.003","15.361","0.003","78.425","0.003","69.913","0.003","74.98","0.003","2317.6","0.8","202","2","202","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H55 F3 In N3 O3 S -","- C48 H55 F3 In N3 O3 S -","- C96 H110 F6 In2 N6 O6 S2 -","2","1","","Titel Jurca; Justin Lummiss; Tara J. Burchell; Serge I. Gorelsky; Darrin S. Richeson","Capturing In+ Monomers in a Neutral Weakly Coordinating Environment","Journal of the American Chemical Society","2009","131","","4608","4609","10.1021/ja901128q","","","0.71073","MoKα","","0.1052","0.0737","","","0.1856","0.2024","","","","","","1.054","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104152","18.2104","0.0013","16.5153","0.0012","20.0394","0.0015","90","","100.628","0.001","90","","5923.5","0.7","202","2","202","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57.5 H67 Cl6 In2 N3 -","- C57.5 H67 Cl6 In2 N3 -","- C230 H268 Cl24 In8 N12 -","4","1","","Titel Jurca; Justin Lummiss; Tara J. Burchell; Serge I. Gorelsky; Darrin S. Richeson","Capturing In+ Monomers in a Neutral Weakly Coordinating Environment","Journal of the American Chemical Society","2009","131","","4608","4609","10.1021/ja901128q","","","0.71073","MoKα","","0.1669","0.0646","","","0.135","0.176","","","","","","1.018","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104153","10.116","0.0019","13.004","0.003","10.385","0.002","90","","97.72","0.004","90","","1353.7","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","undeca-methoxo-octa-oxo-hexavanadium","","- C11 H33 O19 V6 -","- C11 H33 O19 V6 -","- C22 H66 O38 V12 -","2","0.5","","Charles Daniel; Hans Hartl","A Mixed-Valence VIV/VV Alkoxo-polyoxovanadium Cluster Series [V6O8(OCH3)11]n+/-: Exploring the Influence of a μ-Oxo Ligand in a Spin Frustrated Structure","Journal of the American Chemical Society","2009","131","","5101","5114","10.1021/ja8073648","","","0.71073","MoKα","","0.0385","0.0318","","","0.0819","0.0887","","","","","","0.898","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104154","10.074","0.002","13.066","0.003","15.085","0.003","90.041","0.005","103.88","0.005","91.872","0.005","1926.5","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Dodeca-methoxo-hepta-oxo-hexa-vanadium-hexochloroantimonat","","- C12 H35 Cl8 O19 Sb V6 -","- C12 H35 Cl8 O19 Sb V6 -","- C24 H70 Cl16 O38 Sb2 V12 -","2","1","","Charles Daniel; Hans Hartl","A Mixed-Valence VIV/VV Alkoxo-polyoxovanadium Cluster Series [V6O8(OCH3)11]n+/-: Exploring the Influence of a μ-Oxo Ligand in a Spin Frustrated Structure","Journal of the American Chemical Society","2009","131","","5101","5114","10.1021/ja8073648","","","0.71073","MoKα","","0.0884","0.0544","","","0.1305","0.1434","","","","","","0.977","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104155","6.6344","0.0002","10.9383","0.0002","27.119","0.0006","90","","90","","90","","1968","0.08","296","2","296","2","","","","","","","synthesized","4","P 21 21 21","P 2ac 2ab","19","4-O-benzyl-6-O-tert-butyldimethylsilyl-D-(-)-glucal","","","- C19 H30 O4 Si -","- C19 H30 O4 Si -","- C76 H120 O16 Si4 -","4","1","","Dusan Hesek; Mijoon Lee; Weilie Zhang; Bruce C. Noll; Shahriar Mobashery","Total Synthesis of N-Acetylglucosamine-1,6-anhydro-N-acetylmuramylpentapeptide and Evaluation of Its Turnover by AmpD from Escherichia coli","Journal of the American Chemical Society","2009","131","","5187","5193","10.1021/ja808498m","","x-ray","1.54178","CuKα","","0.0273","0.0265","","","0.0683","0.0686","","","","","","1.055","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104156","4.57","0.0001","13.9439","0.0003","21.6237","0.0005","90","","90","","90","","1377.94","0.05","296","2","296","2","","","","","","","synthesized","3","P 21 21 21","P 2ac 2ab","19","4-O-benzyl-D-(-)-glucal","","","- C15 H18 O4 -","- C15 H16 O4 -","- C60 H64 O16 -","4","1","","Dusan Hesek; Mijoon Lee; Weilie Zhang; Bruce C. Noll; Shahriar Mobashery","Total Synthesis of N-Acetylglucosamine-1,6-anhydro-N-acetylmuramylpentapeptide and Evaluation of Its Turnover by AmpD from Escherichia coli","Journal of the American Chemical Society","2009","131","","5187","5193","10.1021/ja808498m","","x-ray","1.54178","CuKα","","0.0521","0.0504","","","0.1476","0.15","","","","","","0.935","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104157","6.1718","0.0004","7.5275","0.0005","13.9663","0.0006","91.577","0.001","92.433","0.005","91.599","0.005","647.74","0.07","100","2","100","2","","","","","","","synthesized","4","P 1","P 1","1","1,6-Anhydro-2-iodo-4-O-benzyl-2-deoxy-β-D-glucopyranose","","","- C13 H15 I O4 -","- C13 H15 I O4 -","- C26 H30 I2 O8 -","2","2","","Dusan Hesek; Mijoon Lee; Weilie Zhang; Bruce C. Noll; Shahriar Mobashery","Total Synthesis of N-Acetylglucosamine-1,6-anhydro-N-acetylmuramylpentapeptide and Evaluation of Its Turnover by AmpD from Escherichia coli","Journal of the American Chemical Society","2009","131","","5187","5193","10.1021/ja808498m","","x-ray","0.71073","MoKα","","0.016","0.016","","","0.0584","0.0584","","","","","","1.303","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104158","6.7203","0.0003","10.1187","0.0004","18.5765","0.0008","90","","90","","90","","1263.21","0.09","100","2","100","2","","","","","","","synthesized","4","P 21 21 21","P 2ac 2ab","19","1,6-anhydro-2-azido-4-O-benzyl-2-deoxy-β-D-glucopyranose","","","- C13 H15 N3 O4 -","- C13 H15 N3 O4 -","- C52 H60 N12 O16 -","4","1","","Dusan Hesek; Mijoon Lee; Weilie Zhang; Bruce C. Noll; Shahriar Mobashery","Total Synthesis of N-Acetylglucosamine-1,6-anhydro-N-acetylmuramylpentapeptide and Evaluation of Its Turnover by AmpD from Escherichia coli","Journal of the American Chemical Society","2009","131","","5187","5193","10.1021/ja808498m","","x-ray","1.54178","CuKα","","0.0259","0.0259","","","0.066","0.066","","","","","","1.106","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104159","10.9272","0.0012","19.943","0.002","11.0323","0.0011","90","","110.217","0.006","90","","2256.1","0.4","101","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","2-O-Benzyl-1,6:3,4-dianhydro-β-D-altropyranose","","","- C13 H14 O4 -","- C13 H14 O4 -","- C104 H112 O32 -","8","4","","Dusan Hesek; Mijoon Lee; Weilie Zhang; Bruce C. Noll; Shahriar Mobashery","Total Synthesis of N-Acetylglucosamine-1,6-anhydro-N-acetylmuramylpentapeptide and Evaluation of Its Turnover by AmpD from Escherichia coli","Journal of the American Chemical Society","2009","131","","5187","5193","10.1021/ja808498m","","x-ray","0.71073","MoKα","","0.0961","0.082","","","0.2267","0.2494","","","","","","1.098","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104160","17.5877","0.0002","21.7941","0.0002","5.7479","0.0001","90","","90","","90","","2203.22","0.05","291","2","291","2","","","","","","","synthesized","4","P 21 21 2","P 2 2ab","18","Azido tetraacetyl 2-deoxy-β-D-glucopyranose","","","- C18 H22 N4 O9 -","- C18 H22 N4 O9 -","- C72 H88 N16 O36 -","4","1","","Dusan Hesek; Mijoon Lee; Weilie Zhang; Bruce C. Noll; Shahriar Mobashery","Total Synthesis of N-Acetylglucosamine-1,6-anhydro-N-acetylmuramylpentapeptide and Evaluation of Its Turnover by AmpD from Escherichia coli","Journal of the American Chemical Society","2009","131","","5187","5193","10.1021/ja808498m","","x-ray","1.54178","CuKα","","0.0398","0.0324","","","0.0856","0.0899","","","","","","1.045","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104161","36.104","0.005","11.621","0.005","16.841","0.005","90","0.005","97.646","0.005","90","0.005","7003","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H36 N4 S2 Zn -","- C41 H36 N4 S2 Zn -","- C328 H288 N32 S16 Zn8 -","8","1","","Yuanhao Gao; Jieying Wu; Yiming Li; Pingping Sun; Hongping Zhou; Jiaxiang Yang; Shengyi Zhang; Baokang Jin; Yupeng Tian","A Sulfur-Terminal Zn(II) Complex and Its Two-Photon Microscopy Biological Imaging Application","Journal of the American Chemical Society","2009","131","","5208","5213","10.1021/ja808606d","","","0.71069","MoKα","","0.0934","0.0618","","","0.1977","0.2198","","","","","","1.433","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104162","13.119","0.005","22.715","0.008","11.114","0.004","90","","106.552","0.005","90","","3175","2","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C41 H36 N4 -","- C41 H36 N4 -","- C164 H144 N16 -","4","1","","Yuanhao Gao; Jieying Wu; Yiming Li; Pingping Sun; Hongping Zhou; Jiaxiang Yang; Shengyi Zhang; Baokang Jin; Yupeng Tian","A Sulfur-Terminal Zn(II) Complex and Its Two-Photon Microscopy Biological Imaging Application","Journal of the American Chemical Society","2009","131","","5208","5213","10.1021/ja808606d","","","0.71073","MoKα","","0.1646","0.0666","","","0.1738","0.2755","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104163","9.1381","0.0018","9.1761","0.0018","13.632","0.003","103.2","0.03","91.95","0.03","114.33","0.03","1003.4","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H66 Ge2 Si8 -","- C22 H66 Ge2 Si8 -","- C22 H66 Ge2 Si8 -","1","0.5","","Harald Wagner; Judith Baumgartner; Thomas Müller; Christoph Marschner","Shuttling Germanium Atoms into Branched Polysilanes","Journal of the American Chemical Society","2009","131","","5022","5023","10.1021/ja809270m","","","0.71073","MoKα","","0.0528","0.0439","","","0.1157","0.1191","","","","","","0.937","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104164","9.1291","0.0018","9.1306","0.0018","13.694","0.003","92.2","0.03","103.02","0.03","114.18","0.03","1003.5","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H66 Ge4 Si6 -","- C22 H66 Ge4 Si6 -","- C22 H66 Ge4 Si6 -","1","0.5","","Harald Wagner; Judith Baumgartner; Thomas Müller; Christoph Marschner","Shuttling Germanium Atoms into Branched Polysilanes","Journal of the American Chemical Society","2009","131","","5022","5023","10.1021/ja809270m","","","0.71073","MoKα","","0.0425","0.0349","","","0.0865","0.0901","","","","","","1.062","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104165","7.6254","0.0002","7.8637","0.0002","16.4311","0.0004","101.522","0.0011","90.9684","0.0011","97.7622","0.0011","955.59","0.04","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H51 F S Si2 -","- C42 H51 F S Si2 -","- C42 H51 F S Si2 -","1","0.5","","Ming L. Tang; Anna D. Reichardt; Peng Wei; Zhenan Bao","Correlating Carrier Type with Frontier Molecular Orbital Energy Levels in Organic Thin Film Transistors of Functionalized Acene Derivatives","Journal of the American Chemical Society","2009","131","","5264","5273","10.1021/ja809659b","","","0.71073","MoKα","","0.0949","0.0676","","","0.1704","0.1877","","","","","","1.022","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104166","7.4762","0.0005","8.045","0.0006","16.43","0.0011","102.104","0.004","90.77","0.004","96.343","0.004","959.63","0.12","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H47 F5 S Si2 -","- C42 H47 F5 S Si2 -","- C42 H47 F5 S Si2 -","1","0.5","","Ming L. Tang; Anna D. Reichardt; Peng Wei; Zhenan Bao","Correlating Carrier Type with Frontier Molecular Orbital Energy Levels in Organic Thin Film Transistors of Functionalized Acene Derivatives","Journal of the American Chemical Society","2009","131","","5264","5273","10.1021/ja809659b","","","1.54178","CuKα","","0.0865","0.0634","","","0.1563","0.1793","","","","","","1.029","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104167","10.791","0.001","13.32","0.001","28.398","0.003","90","","91.066","0.002","90","","4081.1","0.7","100","1","100","1","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H21 B F20 Ti -","- C40 H21 B F20 Ti -","- C160 H84 B4 F80 Ti4 -","4","1","","Edwin Otten; Aurora A. Batinas; Auke Meetsma; Bart Hessen","Versatile Coordination of Cyclopentadienyl-Arene Ligands and Its Role in Titanium-Catalyzed Ethylene Trimerization","Journal of the American Chemical Society","2009","131","","5298","5312","10.1021/ja810089f","","","0.71073","MoKα","","0.116","0.0707","","","0.1726","0.1916","","","","","","1.041","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104168","12.0159","0.0009","19.541","0.001","15.977","0.001","90","","91.83","0.001","90","","3749.5","0.4","100","1","100","1","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H25 B F20 Ti -","- C42 H25 B F20 Ti -","- C168 H100 B4 F80 Ti4 -","4","1","","Edwin Otten; Aurora A. Batinas; Auke Meetsma; Bart Hessen","Versatile Coordination of Cyclopentadienyl-Arene Ligands and Its Role in Titanium-Catalyzed Ethylene Trimerization","Journal of the American Chemical Society","2009","131","","5298","5312","10.1021/ja810089f","","","0.71073","MoKα","","0.0954","0.0505","","","0.1036","0.1181","","","","","","1.021","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104169","14.173","0.003","18.378","0.003","29.769","0.005","90","","97.089","0.004","90","","7695","2","100","1","100","1","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H27 B F20 Ti -","- C43 H27 B F20 Ti -","- C344 H216 B8 F160 Ti8 -","8","2","","Edwin Otten; Aurora A. Batinas; Auke Meetsma; Bart Hessen","Versatile Coordination of Cyclopentadienyl-Arene Ligands and Its Role in Titanium-Catalyzed Ethylene Trimerization","Journal of the American Chemical Society","2009","131","","5298","5312","10.1021/ja810089f","","","0.71073","MoKα","","0.1613","0.0636","","","0.1156","0.1449","","","","","","0.95","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104170","9.647","0.0008","12.96","0.001","17.683","0.002","102.781","0.001","90.754","0.002","96.832","0.002","2139","0.3","100","1","100","1","","","","","","","see text","6","P -1","-P 1","2","","","","- C45 H33 B F20 Si Ti -","- C45 H33 B F20 Si Ti -","- C90 H66 B2 F40 Si2 Ti2 -","2","1","","Edwin Otten; Aurora A. Batinas; Auke Meetsma; Bart Hessen","Versatile Coordination of Cyclopentadienyl-Arene Ligands and Its Role in Titanium-Catalyzed Ethylene Trimerization","Journal of the American Chemical Society","2009","131","","5298","5312","10.1021/ja810089f","","","0.71073","MoKα","","0.0967","0.0559","","","0.116","0.1311","","","","","","1.026","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104171","15.902","0.002","17.78","0.002","17.1","0.002","90","","115.144","0.002","90","","4376.7","0.9","100","1","100","1","","","","","","","see text","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H24 B Br F20 O2 Ti -","- C48 H24 B Br F20 O2 Ti -","- C192 H96 B4 Br4 F80 O8 Ti4 -","4","1","","Edwin Otten; Aurora A. Batinas; Auke Meetsma; Bart Hessen","Versatile Coordination of Cyclopentadienyl-Arene Ligands and Its Role in Titanium-Catalyzed Ethylene Trimerization","Journal of the American Chemical Society","2009","131","","5298","5312","10.1021/ja810089f","","","0.71073","MoKα","","0.0798","0.0495","","","0.1131","0.1261","","","","","","1.036","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104172","15.858","0.002","15.996","0.002","20.876","0.002","90","","104.36","0.002","90","","5130.1","1","100","1","100","1","","","","","","","see text","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H40 B F20 N2 V -","- C53 H40 B F20 N2 V -","- C212 H160 B4 F80 N8 V4 -","4","1","","Edwin Otten; Aurora A. Batinas; Auke Meetsma; Bart Hessen","Versatile Coordination of Cyclopentadienyl-Arene Ligands and Its Role in Titanium-Catalyzed Ethylene Trimerization","Journal of the American Chemical Society","2009","131","","5298","5312","10.1021/ja810089f","","","0.71073","MoKα","","0.0597","0.0432","","","0.1041","0.1106","","","","","","1.026","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104173","11.5182","0.0008","12.3831","0.0008","12.4144","0.0008","99.737","0.003","92.627","0.004","92.065","0.004","1741.6","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36.5 H49.5 Cl2 N2 O Ru -","- C36.5 H49.5 Cl2 N2 O Ru -","- C73 H99 Cl4 N4 O2 Ru2 -","2","1","","Kevin M. Kuhn; Jean-Baptiste Bourg; Cheol K. Chung; Scott C. Virgil; Robert H. Grubbs","Effects of NHC-Backbone Substitution on Efficiency in Ruthenium-Based Olefin Metathesis","Journal of the American Chemical Society","2009","131","","5313","5320","10.1021/ja900067c","","","0.71073","MoKα","","0.0797","0.0605","","","0.0916","0.0928","","","","","","2.665","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4104174","9.1757","0.0003","10.613","0.0004","16.2638","0.0006","85.33","0.001","77.265","0.001","72.206","0.001","1470.76","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H38 Cl2 N2 O Ru -","- C31 H38 Cl2 N2 O Ru -","- C62 H76 Cl4 N4 O2 Ru2 -","2","1","","Kevin M. Kuhn; Jean-Baptiste Bourg; Cheol K. Chung; Scott C. Virgil; Robert H. Grubbs","Effects of NHC-Backbone Substitution on Efficiency in Ruthenium-Based Olefin Metathesis","Journal of the American Chemical Society","2009","131","","5313","5320","10.1021/ja900067c","","","0.71073","MoKα","","0.0677","0.0444","","","0.0893","0.0937","","","","","","1.187","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4104175","9.2776","0.0002","10.3304","0.0003","12.6608","0.0003","98.689","0.002","101.268","0.002","101.819","0.002","1141.5","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H80 N2 O4 Pd -","- C46 H80 N2 O4 Pd -","- C46 H80 N2 O4 Pd -","1","0.5","","Yang-Hui Zhang; Bing-Feng Shi; Jin-Quan Yu","Pd(II)-Catalyzed Olefination of Electron-Deficient Arenes Using 2,6-Dialkylpyridine Ligands","Journal of the American Chemical Society","2009","131","","5072","5074","10.1021/ja900327e","","","1.54178","CuKα","","0.0645","0.0627","","","0.162","0.1642","","","","","","1.134","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104176","11.853","0.004","19.502","0.007","9.979","0.003","90","","106.351","0.007","90","","2213.4","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H28 N2 O5 -","- C21 H28 N2 O5 -","- C84 H112 N8 O20 -","4","1","","Jubi John; Indu U.; Eringathodi Suresh; K. V. Radhakrishnan","Palladium Catalyzed Tandem Ring Opening-Ring Closing Reaction of Diazabicyclic Alkenes: A Facile One Pot Strategy for Cyclopentannulation of Heterocycles","Journal of the American Chemical Society","2009","131","","5042","5043","10.1021/ja900477e","","","0.71073","MoKα","","0.1741","0.1168","","","0.2187","0.2431","","","","","","1.235","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104177","10.5676","0.0018","13.375","0.002","15.023","0.003","103.159","0.003","95.365","0.002","106.548","0.002","1953.3","0.6","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C26 H19 N O S -","- C26 H19 N O S -","- C104 H76 N4 O4 S4 -","4","4","","Jonathan Clayden; Stephen P. Fletcher; Joseph J. W. McDouall; Stephen J. M. Rowbottom","Controlling Axial Conformation in 2-Arylpyridines and 1-Arylisoquinolines: Application to the Asymmetric Synthesis of QUINAP by Dynamic Thermodynamic Resolution","Journal of the American Chemical Society","2009","131","","5331","5343","10.1021/ja900722q","","","0.71073","MoKα","","0.0322","0.0316","","","0.0795","0.08","","","","","","1.047","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104178","18.2859","0.0007","11.0179","0.0005","14.8299","0.0006","90","","108.605","0.002","90","","2831.7","0.2","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Cl3 N3 O9 S -","- C26 H26 Cl3 N3 O9 S -","- C104 H104 Cl12 N12 O36 S4 -","4","1","","Eduardas Skucas; Jason R. Zbieg; Michael J. Krische","anti-Aminoallylation of Aldehydes via Ruthenium-Catalyzed Transfer Hydrogenative Coupling of Sulfonamido Allenes: 1,2-Aminoalcohols","Journal of the American Chemical Society","2009","131","","5054","5055","10.1021/ja900827p","","","0.71069","MoKα","","0.0988","0.0545","","","0.1146","0.1321","","","","","","1.063","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104179","15.7991","0.0012","8.3868","0.0009","21.179","0.002","90","","90","","90","","2806.3","0.5","153","2","153","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C14 H19 N O3 -","- C14 H19 N O3 -","- C112 H152 N8 O24 -","8","2","","Eduardas Skucas; Jason R. Zbieg; Michael J. Krische","anti-Aminoallylation of Aldehydes via Ruthenium-Catalyzed Transfer Hydrogenative Coupling of Sulfonamido Allenes: 1,2-Aminoalcohols","Journal of the American Chemical Society","2009","131","","5054","5055","10.1021/ja900827p","","","0.7107","MoKα","","0.158","0.0895","","","0.1909","0.2199","","","","","","1.2","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104180","8.3047","0.0009","20.426","0.002","14.9273","0.0015","90","","99.6683","0.0014","90","","2496.2","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H15 As Cl3 Sb -","- C6 H15 As Cl3 Sb -","- C48 H120 As8 Cl24 Sb8 -","8","2","","Eamonn Conrad; Neil R. Burford; Robert McDonald; Michael J. Ferguson","Coordination of Arsine Ligands as a General Synthetic Approach to Rare Examples of Arsenic-Antimony and Arsenic-Bismuth Bonds","Journal of the American Chemical Society","2009","131","","5066","5067","10.1021/ja900968j","","","0.71073","MoKα","","0.0605","0.0494","","","0.1193","0.1245","","","","","","1.157","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104181","10.7183","0.0015","11.0815","0.0016","12.3185","0.0017","90","","114.214","0.002","90","","1334.4","0.3","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C4 H9 As Cl2 F3 O3 S Sb -","- C4 H9 As Cl2 F3 O3 S Sb -","- C16 H36 As4 Cl8 F12 O12 S4 Sb4 -","4","1","","Eamonn Conrad; Neil R. Burford; Robert McDonald; Michael J. Ferguson","Coordination of Arsine Ligands as a General Synthetic Approach to Rare Examples of Arsenic-Antimony and Arsenic-Bismuth Bonds","Journal of the American Chemical Society","2009","131","","5066","5067","10.1021/ja900968j","","","0.71073","MoKα","","0.0345","0.0297","","","0.0761","0.0779","","","","","","1.01","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104182","31.0351","0.0019","11.9521","0.0007","15.0928","0.0009","90","","99.7641","0.0009","90","","5517.3","0.6","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 Al As Cl5 Sb -","- C24 H20 Al As Cl5 Sb -","- C192 H160 Al8 As8 Cl40 Sb8 -","8","1","","Eamonn Conrad; Neil R. Burford; Robert McDonald; Michael J. Ferguson","Coordination of Arsine Ligands as a General Synthetic Approach to Rare Examples of Arsenic-Antimony and Arsenic-Bismuth Bonds","Journal of the American Chemical Society","2009","131","","5066","5067","10.1021/ja900968j","","","0.71073","MoKα","","0.0394","0.0286","","","0.0701","0.0813","","","","","","1.114","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104183","22.023","0.002","16.6499","0.0017","22.883","0.002","90","","114.678","0.0013","90","","7624.4","1.2","193","2","193","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C37 H30 As2 Bi Cl2 F3 O3 S -","- C37 H30 As2 Bi Cl2 F3 O3 S -","- C296 H240 As16 Bi8 Cl16 F24 O24 S8 -","8","1","","Eamonn Conrad; Neil R. Burford; Robert McDonald; Michael J. Ferguson","Coordination of Arsine Ligands as a General Synthetic Approach to Rare Examples of Arsenic-Antimony and Arsenic-Bismuth Bonds","Journal of the American Chemical Society","2009","131","","5066","5067","10.1021/ja900968j","","","0.71073","MoKα","","0.0495","0.031","","","0.0652","0.0713","","","","","","1.039","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104184","11.139","0.0003","18.6226","0.0004","21.2712","0.0005","90","","90","","90","","4412.44","0.18","133","2","133","2","","","","","","","","6","P b c m","-P 2c 2b","57","(DIPP-nacnac)Ca(DIPP)N=BH2.THF","","","- C45 H68 B Ca N3 O -","- C45 H68 B Ca N3 O -","- C180 H272 B4 Ca4 N12 O4 -","4","0.5","","Jan Spielmann; Sjoerd Harder","Hydrogen Elimination in Bulky Calcium Amidoborane Complexes: Isolation of a Calcium Borylamide Complex","Journal of the American Chemical Society","2009","131","","5064","5065","10.1021/ja901073c","","","0.71073","MoKα","","0.0553","0.0429","","","0.1081","0.1144","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104185","11.9746","0.0006","22.8411","0.0012","17.0308","0.0008","90","","106.287","0.003","90","","4471.2","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(DIPP-nacnac)Ca(NH(DIPP)BH3).THF","","","- C45 H70 B Ca N3 O -","- C45 H70 B Ca N3 O -","- C180 H280 B4 Ca4 N12 O4 -","4","1","","Jan Spielmann; Sjoerd Harder","Hydrogen Elimination in Bulky Calcium Amidoborane Complexes: Isolation of a Calcium Borylamide Complex","Journal of the American Chemical Society","2009","131","","5064","5065","10.1021/ja901073c","","","0.71073","MoKα","","0.1062","0.0608","","","0.1361","0.1594","","","","","","1.031","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104186","16.5823","0.0015","17.0572","0.0015","26.097","0.003","90","","90","","90","","7381.5","1.3","173","2","173","2","","","","","","","","6","P b n a","-P 2ac 2b","60","DIPP-nacnac)CaN(DIPP)H-BH3.THF","","","- C36 H60 B Ca N3 O -","- C36 H60 B Ca N3 O -","- C288 H480 B8 Ca8 N24 O8 -","8","1","","Jan Spielmann; Sjoerd Harder","Hydrogen Elimination in Bulky Calcium Amidoborane Complexes: Isolation of a Calcium Borylamide Complex","Journal of the American Chemical Society","2009","131","","5064","5065","10.1021/ja901073c","","","0.71073","MoKα","","0.1012","0.0785","","","0.1813","0.1921","","","","","","1.129","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104187","11.9152","0.0004","18.0011","0.0006","31.6183","0.0009","90","","92.026","0.002","90","","6777.5","0.4","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[(DIPP-nacnac)Ca]2(iPrN=BH-N(iPr)-BH3).THF","","","- C68 H108 B2 Ca2 N6 O -","- C68 H108 B2 Ca2 N6 O -","- C272 H432 B8 Ca8 N24 O4 -","4","1","","Jan Spielmann; Sjoerd Harder","Hydrogen Elimination in Bulky Calcium Amidoborane Complexes: Isolation of a Calcium Borylamide Complex","Journal of the American Chemical Society","2009","131","","5064","5065","10.1021/ja901073c","","","0.71073","MoKα","","0.074","0.0498","","","0.1014","0.1144","","","","","","1.076","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104188","19.6891","0.0008","19.6891","0.0008","14.1971","0.0007","90","","90","","120","","4766.3","0.4","123","2","123","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6 H10 Cu N3 -","- C6 H10 Cu N3 -","- C108 H180 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0482","0.0402","","","0.0732","0.077","","","","","","1.014","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104189","19.5289","0.0008","19.5289","0.0008","14.2935","0.0008","90","","90","","120","","4720.9","0.4","123","2","123","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C8 H12 Cu N3 -","- C8 H12 Cu N3 -","- C144 H216 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0451","0.0393","","","0.0787","0.082","","","","","","1.028","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104190","19.6972","0.0009","19.6972","0.0009","14.2478","0.0008","90","","90","","120","","4787.3","0.4","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C8 H12 Cu N3 -","- C8 H12 Cu N3 -","- C144 H216 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0617","0.051","","","0.1104","0.1182","","","","","","1.021","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104191","19.6216","0.0012","19.6216","0.0012","14.2113","0.0009","90","","90","","120","","4738.4","0.5","123","2","123","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C7 H10 Cu N3 O2 -","- C7 H10 Cu N3 O2 -","- C126 H180 Cu18 N54 O36 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0571","0.0458","","","0.0957","0.1004","","","","","","1.016","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104192","19.7501","0.0013","19.7501","0.0013","14.1928","0.001","90","","90","","120","","4794.4","0.6","195","2","195","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6 H10 Cu N3 -","- C6 H10 Cu N3 -","- C108 H180 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0442","0.0364","","","0.0863","0.0919","","","","","","1.014","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104193","19.6052","0.0005","19.6052","0.0005","14.242","0.0004","90","","90","","120","","4740.7","0.2","93","2","93","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6 H10 Cu N4 -","- C6 H10 Cu N4 -","- C108 H180 Cu18 N72 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0367","0.0327","","","0.0734","0.0761","","","","","","1.015","","","","has coordinates,has disorder","178787","2020-10-21","18:00:00",""
"4104194","19.6808","0.0016","19.6808","0.0016","14.2153","0.0012","90","","90","","120","","4768.4","0.7","195","2","195","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6.08 H10.08 Cu N3 -","- C6.082 H10.082 Cu N3 -","- C109.476 H181.476 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0538","0.0415","","","0.0935","0.0998","","","","","","1.033","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104195","19.6307","0.0014","19.6307","0.0014","14.2594","0.0011","90","","90","","120","","4758.9","0.6","195","2","195","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6.21 H10.21 Cu N3 -","- C6.208 H10.208 Cu N3 -","- C111.744 H183.744 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0396","0.0329","","","0.0795","0.0845","","","","","","1.021","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104196","19.6035","0.0014","19.6035","0.0014","14.2793","0.0011","90","","90","","120","","4752.3","0.6","195","2","195","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6.39 H10.39 Cu N3 -","- C6.394 H10.394 Cu N3 -","- C115.092 H187.092 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0379","0.0324","","","0.0833","0.0878","","","","","","1.032","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104197","19.5947","0.0014","19.5947","0.0014","14.2851","0.001","90","","90","","120","","4750","0.6","195","2","195","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C6.84 H10.84 Cu N3 -","- C6.836 H10.836 Cu N3 -","- C123.048 H195.048 Cu18 N54 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0543","0.0407","","","0.092","0.0979","","","","","","1.043","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104198","19.7253","0.0014","19.7253","0.0014","14.1969","0.001","90","","90","","120","","4783.8","0.6","195","2","195","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C6.04 H10 Cu N3 O0.09 -","- C6.044 H10 Cu N3 O0.088 -","- C108.792 H180 Cu18 N54 O1.584 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0521","0.0388","","","0.0895","0.0986","","","","","","1.022","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104199","19.7013","0.0012","19.7013","0.0012","14.1981","0.0009","90","","90","","120","","4772.6","0.5","195","2","195","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C6.08 H10 Cu N3 O0.15 -","- C6.076 H10 Cu N3 O0.152 -","- C109.368 H180 Cu18 N54 O2.736 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0536","0.0386","","","0.0856","0.0936","","","","","","1.02","","","","has coordinates","178787","2020-10-21","18:00:00",""
"4104200","19.6828","0.0017","19.6828","0.0017","14.205","0.0012","90","","90","","120","","4765.9","0.7","195","2","195","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C6.25 H10 Cu N3 O0.5 -","- C6.247 H10 Cu N3 O0.494 -","- C112.446 H180 Cu18 N54 O8.892 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0461","0.0381","","","0.0926","0.0987","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104201","19.6798","0.0013","19.6798","0.0013","14.2054","0.001","90","","90","","120","","4764.6","0.6","195","2","195","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C6.42 H10 Cu N3 O0.84 -","- C6.42 H10 Cu N3 O0.84 -","- C115.56 H180 Cu18 N54 O15.12 -","18","1","","Jie-Peng Zhang; Xiao-Ming Chen","Optimized Acetylene/Carbon Dioxide Sorption in a Dynamic Porous Crystal","Journal of the American Chemical Society","2009","131","","5516","5521","10.1021/ja8089872","","","0.71073","MoKα","","0.0439","0.0369","","","0.0915","0.096","","","","","","1.026","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104202","12.13","0.03","13.84","0.04","16.24","0.04","112.53","0.03","110.86","0.03","90.76","0.03","2318","11","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C59 H66 O2 S2 -","- C59 H66 O2 S2 -","- C118 H132 O4 S4 -","2","1","","Hakan Usta; Chad Risko; Zhiming Wang; Hui Huang; Murat K. Deliomeroglu; Aleksandr Zhukhovitskiy; Antonio Facchetti; Tobin J. Marks","Design, Synthesis, and Characterization of Ladder-Type Molecules and Polymers. Air-Stable, Solution-Processablen-Channel and Ambipolar Semiconductors for Thin-Film Transistors via Experiment and Theory","Journal of the American Chemical Society","2009","131","","5586","5608","10.1021/ja809555c","","","","","","","","","","","","","","","","","","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104203","8.4993","0.0004","10.0232","0.0004","14.3879","0.0006","76.65","0.003","80.592","0.003","66.24","0.003","1088.08","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H56 Br2 N4 -","- C50 H56 Br2 N4 -","- C50 H56 Br2 N4 -","1","0.5","","Hakan Usta; Chad Risko; Zhiming Wang; Hui Huang; Murat K. Deliomeroglu; Aleksandr Zhukhovitskiy; Antonio Facchetti; Tobin J. Marks","Design, Synthesis, and Characterization of Ladder-Type Molecules and Polymers. Air-Stable, Solution-Processablen-Channel and Ambipolar Semiconductors for Thin-Film Transistors via Experiment and Theory","Journal of the American Chemical Society","2009","131","","5586","5608","10.1021/ja809555c","","","1.54178","CuKα","","0.0422","0.0365","","","0.0928","0.0955","","","","","","1.053","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104204","22.2091","0.0006","22.2174","0.0007","36.397","0.001","90","","90","","90","","17959.3","0.9","100","2","100","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C50 H45 Br2 Cl3 N4 -","- C50 H45 Br2 Cl3 N4 -","- C800 H720 Br32 Cl48 N64 -","16","2","","Hakan Usta; Chad Risko; Zhiming Wang; Hui Huang; Murat K. Deliomeroglu; Aleksandr Zhukhovitskiy; Antonio Facchetti; Tobin J. Marks","Design, Synthesis, and Characterization of Ladder-Type Molecules and Polymers. Air-Stable, Solution-Processablen-Channel and Ambipolar Semiconductors for Thin-Film Transistors via Experiment and Theory","Journal of the American Chemical Society","2009","131","","5586","5608","10.1021/ja809555c","","","0.71073","MoKα","","0.0837","0.0436","","","0.0684","0.072","","","","","","1.033","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104205","12.1161","0.0005","21.7964","0.0009","8.5633","0.0002","90","","93.448","0.002","90","","2257.37","0.14","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 F6 Hg N4 O8 S2 -","- C16 H12 F6 Hg N4 O8 S2 -","- C64 H48 F24 Hg4 N16 O32 S8 -","4","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.0751","0.0464","","","0.1032","0.1153","","","","","","1.028","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104206","8.9199","0.0003","25.1224","0.0011","14.8664","0.0004","90","","124.338","0.002","90","","2750.82","0.18","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 F6 Hg N6 O7 S2 -","- C20 H22 F6 Hg N6 O7 S2 -","- C80 H88 F24 Hg4 N24 O28 S8 -","4","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.0955","0.0456","","","0.1066","0.1439","","","","","","1.034","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104207","10.7211","0.0007","12.1059","0.0008","12.3438","0.0005","60.978","0.003","82.671","0.003","82.823","0.003","1385.79","0.15","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H21 F6 N7 O6 Pb S2 -","- C21 H21 F6 N7 O6 Pb S2 -","- C42 H42 F12 N14 O12 Pb2 S4 -","2","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.0494","0.0398","","","0.0959","0.1156","","","","","","1.145","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104208","8.1415","0.0005","11.7218","0.0007","13.3147","0.0006","74.683","0.003","88.334","0.003","77.536","0.003","1196.12","0.12","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C19 H21 Cl F3 N7 O3 Pb S -","- C19 H21 Cl F3 N7 O3 Pb S -","- C38 H42 Cl2 F6 N14 O6 Pb2 S2 -","2","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.0654","0.0539","","","0.1303","0.137","","","","","","1.027","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104209","8.3621","0.0002","30.3182","0.0007","17.062","0.0003","90","","112.59","0.001","90","","3993.75","0.15","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 F6 N8 O7 Pb S2 -","- C27 H30 F6 N8 O7 Pb S2 -","- C108 H120 F24 N32 O28 Pb4 S8 -","4","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.1348","0.0981","","","0.2565","0.2719","","","","","","1.155","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104210","28.179","0.002","12.7484","0.001","14.563","0.0006","90","","91.309","0.004","90","","5230.2","0.6","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 F6 N6 O8 S2 Zn -","- C18 H20 F6 N6 O8 S2 Zn -","- C144 H160 F48 N48 O64 S16 Zn8 -","8","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.1302","0.0763","","","0.2035","0.2417","","","","","","1.037","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104211","8.9789","0.0002","24.7904","0.0007","11.9554","0.0003","90","","92.939","0.002","90","","2657.66","0.12","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 F6 N6 O7 S2 Zn -","- C19 H20 F6 N6 O7 S2 Zn -","- C76 H80 F24 N24 O28 S8 Zn4 -","4","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.0766","0.0563","","","0.1477","0.1588","","","","","","1.028","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104212","9.4644","0.0006","17.9359","0.0006","15.7593","0.001","90","","101.591","0.002","90","","2620.6","0.3","173","2","173","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C20 H21 F6 N7 O6 S2 Zn -","- C20 H21 F6 N7 O6 S2 Zn -","- C80 H84 F24 N28 O24 S8 Zn4 -","4","1","","Sébastien Ulrich; Jean-Marie Lehn","Adaptation to Shape Switching by Component Selection in a Constitutional Dynamic System","Journal of the American Chemical Society","2009","131","","5546","5559","10.1021/ja809828g","","","0.71073","MoKα","","0.1422","0.0747","","","0.1966","0.2324","","","","","","1.043","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104213","19.0721","0.001","19.0721","0.001","22.468","0.0007","90","","90","","120","","7077.7","0.6","100","2","100","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C44 H50 Al N4 O3 -","- C44 H45 Al N4 O3 -","- C264 H270 Al6 N24 O18 -","6","1","","Tomasz Kaczorowski; Iwona Justyniak; Teodozja Lipińska; Janusz Lipkowski; Janusz Lewiński","Metal Complexes of Cinchonine as Chiral Building Blocks: A Strategy for the Construction of Nanotubular Architectures and Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","5393","5395","10.1021/ja8098867","","","0.71073","MoKα","","0.0953","0.0837","","","0.2185","0.2313","","","","","","1.046","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104214","19.1799","0.0012","19.1799","0.0012","22.436","0.0008","90","","90","","120","","7147.7","0.7","100","2","100","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C43 H53 Al N4 O3 -","- C43 H53 Al N4 O3 -","- C258 H318 Al6 N24 O18 -","6","1","","Tomasz Kaczorowski; Iwona Justyniak; Teodozja Lipińska; Janusz Lipkowski; Janusz Lewiński","Metal Complexes of Cinchonine as Chiral Building Blocks: A Strategy for the Construction of Nanotubular Architectures and Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","5393","5395","10.1021/ja8098867","","","0.71073","MoKα","","0.1052","0.0853","","","0.2106","0.2216","","","","","","1.084","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104215","12.3231","0.0003","13.8581","0.0004","25.9692","0.0006","90","","90","","90","","4434.9","0.2","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C42 H50 Al Cl3 N4 O3 Zn -","- C42 H50 Al Cl3 N4 O3 Zn -","- C168 H200 Al4 Cl12 N16 O12 Zn4 -","4","1","","Tomasz Kaczorowski; Iwona Justyniak; Teodozja Lipińska; Janusz Lipkowski; Janusz Lewiński","Metal Complexes of Cinchonine as Chiral Building Blocks: A Strategy for the Construction of Nanotubular Architectures and Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","5393","5395","10.1021/ja8098867","","","0.71073","MoKα","","0.0552","0.0495","","","0.1186","0.1234","","","","","","1.071","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104216","18.9541","0.0002","18.9541","0.0002","22.4362","0.0004","90","","90","","120","","6980.5","0.16","100","2","100","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C83 H92 Al2 Cl2 N8 O4 -","- C83 H92 Al2 Cl2 N8 O4 -","- C249 H276 Al6 Cl6 N24 O12 -","3","0.5","","Tomasz Kaczorowski; Iwona Justyniak; Teodozja Lipińska; Janusz Lipkowski; Janusz Lewiński","Metal Complexes of Cinchonine as Chiral Building Blocks: A Strategy for the Construction of Nanotubular Architectures and Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","5393","5395","10.1021/ja8098867","","","0.71073","MoKα","","0.0893","0.074","","","0.1796","0.2079","","","","","","1.058","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104217","12.259","0.005","14.235","0.004","17.56","0.001","98.111","0.002","103.836","0.005","111.26","0.008","2683.6","1.4","150","2","150","2","","","","","","","synthesis","6","P -1","-P 1","2","Dy(hfac)3(NITPhOEt)2","Tris(hexafluoroacetylacetonate) bis(2,4'-ethoxophenyl-4,4,5,5,-tetramethylimidazolidine -3-oxide-1-oxyl) dysprosium","","- C45 H45 Dy F18 N4 O12 -","- C45 H45 Dy F18 N4 O12 -","- C90 H90 Dy2 F36 N8 O24 -","2","1","","Kevin Bernot; Javier Luzon; Lapo Bogani; Mael Etienne; Claudio Sangregorio; Muralidharan Shanmugam; Andrea Caneschi; Roberta Sessoli; Dante Gatteschi","Magnetic Anisotropy of Dysprosium(III) in a Low-Symmetry Environment: A Theoretical and Experimental Investigation","Journal of the American Chemical Society","2009","131","","5573","5579","10.1021/ja8100038","","","0.71073","MoKα","","0.0959","0.0669","","","0.1667","0.1875","","","","","","0.948","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104218","6.9774","0.0005","7.2895","0.0006","15.4878","0.0011","79.058","0.003","78.262","0.002","71.287","0.003","723.87","0.1","123","1","123","1","","","","","","","","5","P -1","-P 1","2","Nb-complex","","","- C10 H20 Cl3 Nb O2 -","- C10 H20 Cl3 Nb O2 -","- C20 H40 Cl6 Nb2 O4 -","2","1","","Rocío Arteaga-Müller; Hayato Tsurugi; Teruhiko Saito; Masao Yanagawa; Seiji Oda; Kazushi Mashima","New Tantalum Ligand-Free Catalyst System for Highly Selective Trimerization of Ethylene Affording 1-Hexene: New Evidence of a Metallacycle Mechanism","Journal of the American Chemical Society","2009","131","","5370","5371","10.1021/ja8100837","","","0.71075","MoKα","","0.0242","0.021","","","0.0504","0.0632","","","","","","1.166","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104219","44.283","0.009","31.672","0.006","37.209","0.007","90","","105.33","0.03","90","","50330","18","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cucurbit[8]uril","","","- C348 H412.4 N198 O111.2 -","- C348 H412.4 N198 O111.2 -","- C1392 H1649.6 N792 O444.8 -","4","1","","David Bardelang; Karol Banaszak; Hakim Karoui; Antal Rockenbauer; Mélanie Waite; Konstantin Udachin; John A. Ripmeester; Christopher I. Ratcliffe; Olivier Ouari; Paul Tordo","Probing Cucurbituril Assemblies in Water with TEMPO-like Nitroxides: A Trinitroxide Supraradical with Spin-Spin Interactions","Journal of the American Chemical Society","2009","131","","5402","5404","10.1021/ja900306m","","","0.7107","MoKα","","0.128","0.1048","","","0.3196","0.3393","","","","","","1.361","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104220","7.9321","0.0002","14.3792","0.0003","19.7073","0.0004","90","","90","","90","","2247.76","0.09","193","2","193","2","","","","","","","chemical synthesis","4","P 21 21 21","P 2ac 2ab","19","MeOlBrEta","(3Z,5E,8S,11E,14S)-5-(4-Bromobenzoyl)-4-ethyl-8,14- dimethyloxacyclotetradeca-3,5,11-trien-2-one","","- C24 H29 Br O3 -","- C24 H29 Br O3 -","- C96 H116 Br4 O12 -","4","1","","Tuoping Luo; Stuart L. Schreiber","Gold(I)-Catalyzed Coupling Reactions for the Synthesis of Diverse Small Molecules Using the Build/Couple/Pair Strategy","Journal of the American Chemical Society","2009","131","","5667","5674","10.1021/ja900414s","","","0.71073","MoKα","","0.0432","0.0337","","","0.0794","0.0832","","","","","","1.028","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104221","9.2087","0.0004","10.9551","0.0005","14.8595","0.0008","110.493","0.003","92.371","0.003","108.7","0.002","1309.98","0.12","173","","","","","","","","","","LOC ETH Zurich","9","P -1","-P 1","2","","","","- C19 H18 Cl4 Cu F3 N2 O3 Pt S -","- C19 H18 Cl4 Cu F3 N2 O3 Pt S -","- C38 H36 Cl8 Cu2 F6 N4 O6 Pt2 S2 -","2","1","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.71073","MoKα","","0.0932","0.0816","","","0.2013","0.2142","","","","","","1.174","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104222","10.6556","0.0012","12.1622","0.0013","12.6936","0.0013","110.231","0.012","105.478","0.011","90.209","0.01","1479.2","0.3","220","2","220","2","","","","","","","","9","P -1","-P 1","2","","","","- C50 H48 Ag2 Cl8 F6 N4 O6 Pt2 S2 -","- C50 H48 Ag2 Cl8 F6 N4 O6 Pt2 S2 -","- C50 H48 Ag2 Cl8 F6 N4 O6 Pt2 S2 -","1","0.5","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.7107","MoKα","","0.0321","0.0302","","","0.0786","0.0801","","","","","","1.026","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104223","19.8903","0.0004","18.8114","0.0005","17.0905","0.0003","90","","110.037","0.0013","90","","6007.6","0.2","203","","","","","","","","","","LOC ETH Zurich","9","C 1 2/c 1","-C 2yc","15","","","","- C57 H44 Cl8 Cu F3 N4 O3 Pt2 S -","- C57 H44 Cl8 Cu F3 N4 O3 Pt2 S -","- C228 H176 Cl32 Cu4 F12 N16 O12 Pt8 S4 -","4","0.5","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.71073","MoKα","","0.0482","0.0381","","","0.1085","0.1218","","","","","","0.86","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104224","11.9459","0.0003","31.7926","0.0005","15.7455","0.0003","90","","95.2584","0.0007","90","","5954.8","0.2","223","","","","","","","","","","LOC laboratory","9","P 1 21/c 1","-P 2ybc","14","","","","- C57 H44 Ag2 Cl8 F3 N4 O3 Pt2 S -","- C57 H44 Ag Cl8 F3 N4 O3 Pt2 S -","- C228 H176 Ag4 Cl32 F12 N16 O12 Pt8 S4 -","4","1","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.71073","MoKα","","0.1143","0.0776","","","","0.221","","","","","","1.251","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104225","26.1863","0.0005","19.3506","0.0003","10.1987","0.0002","90","","90","","90","","5167.89","0.16","223","","","","","","","","","","LOC ETH Zurich","9","P n m a","-P 2ac 2n","62","","","","- C48 H40 Ag2 Cl4 F6 N2 O6 Pt S2 -","- C48 H40 Ag2 Cl4 F6 N2 O6 Pt S2 -","- C192 H160 Ag8 Cl16 F24 N8 O24 Pt4 S8 -","4","0.5","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.71073","MoKα","","0.0761","0.0517","","","0.1449","0.1608","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104226","12.618","0.0002","12.8711","0.0003","17.6498","0.0004","77.4279","0.0011","80.5915","0.001","69.5194","0.0009","2608.91","0.1","223","","","","","","","","","","LOC ETH Zurich","9","P -1","-P 1","2","","","","- C34 H28 Cl10 Cu3 F9 N2 O9 Pt S3 -","- C34 H28 Cl10 Cu3 F9 N2 O9 Pt S3 -","- C68 H56 Cl20 Cu6 F18 N4 O18 Pt2 S6 -","2","1","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.71073","MoKα","","0.0656","0.0522","","","0.1432","0.1555","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104227","10.1359","0.0002","14.4793","0.0002","19.7264","0.0003","90","","90","","90","","2895.06","0.08","173","","","","","","","","","","LOC ETH Zurich","8","P b c m","-P 2c 2b","57","","","","- C21 H23 Cl6 F3 N2 O3 Pt S -","- C21 H23 Cl6 F3 N2 O3 Pt S -","- C84 H92 Cl24 F12 N8 O12 Pt4 S4 -","4","0.5","","Marc-Etienne Moret; Peter Chen","Interaction of Organoplatinum(II) Complexes with Monovalent Coinage Metal Triflates","Journal of the American Chemical Society","2009","131","","5675","5690","10.1021/ja900449y","","","0.71073","MoKα","","0.0511","0.0456","","","0.1552","0.1604","","","","","","1.243","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104228","11.8953","0.0012","3.743","0.0003","11.61","0.001","90","","90","","90","","516.92","0.08","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","CaFe4As3","","","- As3 Ca Fe4 -","- As3 Ca Fe4 -","- As12 Ca4 Fe16 -","4","0.5","","Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis","CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties","Journal of the American Chemical Society","2009","131","","5405","5407","10.1021/ja900534h","","","0.71073","MoKα","","0.0527","0.0308","","","0.0628","0.0656","","","","","","0.843","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104229","11.8649","0.0006","3.7309","0.0002","11.5611","0.0007","90","","90","","90","","511.77","0.05","100","0.3","100","0.3","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- As3 Ca Fe4 -","- As3 Ca Fe4 -","- As12 Ca4 Fe16 -","4","0.5","","Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis","CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties","Journal of the American Chemical Society","2009","131","","5405","5407","10.1021/ja900534h","","","0.71073","MoKα","","0.052","0.0495","","","0.0909","0.0923","","","","","","1.188","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104230","11.8656","0.0007","3.7322","0.0002","11.5622","0.0007","90","","90","","90","","512.03","0.05","80","0.3","80","0.3","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- As3 Ca Fe4 -","- As3 Ca Fe4 -","- As12 Ca4 Fe16 -","4","0.5","","Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis","CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties","Journal of the American Chemical Society","2009","131","","5405","5407","10.1021/ja900534h","","","0.71073","MoKα","","0.0547","0.0516","","","0.0769","0.0783","","","","","","1.186","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104231","11.852","0.003","3.7352","0.0006","11.549","0.0018","90","","90","","90","","511.27","0.17","15","2","15","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- As3 Ca Fe4 -","- As3 Ca Fe4 -","- As12 Ca4 Fe16 -","4","0.5","","Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis","CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties","Journal of the American Chemical Society","2009","131","","5405","5407","10.1021/ja900534h","","","0.71073","MoKα","","0.0846","0.0724","","","0.1832","0.1999","","","","","","1.316","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104232","11.8724","0.0003","22.1908","0.0005","39.4936","0.0013","90","","90","","90","","10404.9","0.5","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Brom-penta(di-tert.-butylphosphan)alan(4)","","","- C40 H90 Al4 Br P5 -","- C40 H90 Al4 Br P5 -","- C320 H720 Al32 Br8 P40 -","8","1","","Patrick Henke; Michael Huber; Jochen Steiner; Kit Bowen; Bryan Eichhorn; Hansgeorg Schnöckel","Al4(PtBu2)6- a Derivative of Al4H6- and Other Al4 Species: A Challenge for Bonding Interpretation between Zintl Ions and Metalloid Clusters","Journal of the American Chemical Society","2009","131","","5698","5704","10.1021/ja9007563","","","0.71073","MoKα","","0.0563","0.0447","","","0.1093","0.1163","","","","","","1.059","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104233","21.104","0.0014","12.4808","0.0008","23.3842","0.0015","90","","96.406","0.005","90","","6120.8","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Hexa(di-tert.-butylphoshan)alan(4)","Hexa(di-tert.-butylphoshan)alan(4)","","- C48 H108 Al4 P6 -","- C48 H108 Al4 P6 -","- C192 H432 Al16 P24 -","4","1","","Patrick Henke; Michael Huber; Jochen Steiner; Kit Bowen; Bryan Eichhorn; Hansgeorg Schnöckel","Al4(PtBu2)6- a Derivative of Al4H6- and Other Al4 Species: A Challenge for Bonding Interpretation between Zintl Ions and Metalloid Clusters","Journal of the American Chemical Society","2009","131","","5698","5704","10.1021/ja9007563","","","0.71073","MoKα","","0.0796","0.0386","","","0.0746","0.0828","","","","","","0.827","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104234","11.666","0.002","12.902","0.003","18.331","0.004","90.96","0.03","106.39","0.03","99.6","0.03","2604","1.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Penta(di-tert.-butylphosphan)galan(3)","","","- C40 H90 Ga3 P5 -","- C40 H90 Ga3 P5 -","- C80 H180 Ga6 P10 -","2","1","","Patrick Henke; Michael Huber; Jochen Steiner; Kit Bowen; Bryan Eichhorn; Hansgeorg Schnöckel","Al4(PtBu2)6- a Derivative of Al4H6- and Other Al4 Species: A Challenge for Bonding Interpretation between Zintl Ions and Metalloid Clusters","Journal of the American Chemical Society","2009","131","","5698","5704","10.1021/ja9007563","","","0.71073","MoKα","","0.0648","0.0321","","","0.0681","0.0743","","","","","","0.827","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104235","6.436","0.003","11.931","0.006","8.232","0.004","90","","98.125","0.006","90","","625.8","0.5","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C28 H30 N2 O6 -","2","1","","Vinod Tarwade; Xiaozhong Liu; Ni Yan; Joseph M. Fox","Directed Carbozincation Reactions of Cyclopropene Derivatives","Journal of the American Chemical Society","2009","131","","5382","5383","10.1021/ja900949n","","","0.71073","MoKα","","0.0796","0.0615","","","0.1543","0.1691","","","","","","1.08","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104236","10.16","0.005","6.033","0.003","11.43","0.006","90","","104.658","0.006","90","","677.8","0.6","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C30 H34 N2 O6 -","2","1","","Vinod Tarwade; Xiaozhong Liu; Ni Yan; Joseph M. Fox","Directed Carbozincation Reactions of Cyclopropene Derivatives","Journal of the American Chemical Society","2009","131","","5382","5383","10.1021/ja900949n","","","0.71073","MoKα","","0.0467","0.0432","","","0.1075","0.1106","","","","","","1.07","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104237","8.21","0.003","7.441","0.002","12.614","0.004","90","","95.165","0.005","90","","767.5","0.4","170","2","170","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H16 I N O3 -","- C15 H16 I N O3 -","- C30 H32 I2 N2 O6 -","2","1","","Vinod Tarwade; Xiaozhong Liu; Ni Yan; Joseph M. Fox","Directed Carbozincation Reactions of Cyclopropene Derivatives","Journal of the American Chemical Society","2009","131","","5382","5383","10.1021/ja900949n","","","0.71073","MoKα","","0.044","0.0425","","","0.1075","0.1089","","","","","","1.056","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104238","7.597","0.003","8.055","0.003","14.471","0.006","90","","95.477","0.009","90","","881.5","0.6","170","2","170","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H21 N O3 -","- C21 H21 N O3 -","- C42 H42 N2 O6 -","2","1","","Vinod Tarwade; Xiaozhong Liu; Ni Yan; Joseph M. Fox","Directed Carbozincation Reactions of Cyclopropene Derivatives","Journal of the American Chemical Society","2009","131","","5382","5383","10.1021/ja900949n","","","0.71073","MoKα","","0.0788","0.0554","","","0.1255","0.14","","","","","","1.054","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104239","12.8381","0.0006","14.0439","0.0007","17.3667","0.0008","102.684","0.001","90.381","0.001","106.738","0.001","2917.1","0.2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H59 B F15 N4 O0.5 U -","- C56 H59 B F15 N4 O0.5 U -","- C112 H118 B2 F30 N8 O U2 -","2","1","","Alexander R. Fox; Christopher C. Cummins","Uranium-Nitrogen Multiple Bonding: The Case of a Four-Coordinate Uranium(VI) Nitridoborate Complex","Journal of the American Chemical Society","2009","131","","5716","5717","10.1021/ja8095812","","","0.71073","MoKα","","0.0728","0.042","","","0.0981","0.1099","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104240","12.1153","0.0016","13.9807","0.0018","23.246","0.003","83.463","0.002","78.237","0.002","88.23","0.003","3829.5","0.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C72 H95 B F15 N5 O0.5 U -","- C72 H95 B F15 N5 O0.5 U -","- C144 H190 B2 F30 N10 O U2 -","2","1","","Alexander R. Fox; Christopher C. Cummins","Uranium-Nitrogen Multiple Bonding: The Case of a Four-Coordinate Uranium(VI) Nitridoborate Complex","Journal of the American Chemical Society","2009","131","","5716","5717","10.1021/ja8095812","","","0.71073","MoKα","","0.0657","0.0431","","","0.0877","0.0956","","","","","","1.022","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104241","10.927","0.0002","15.35","0.0002","20.204","0.0004","90","","90.861","0.0009","90","","3388.42","0.1","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C39 H48 B2 N2 -","- C39 H48 B2 N2 -","- C156 H192 B8 N8 -","4","1","","Kelly E. Krahulic; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Isolation of Free Phenylide-like Carbanions with N-Heterocyclic Carbene Frameworks","Journal of the American Chemical Society","2009","131","","5858","5865","10.1021/ja9001234","","","0.71073","MoKα","","0.0785","0.0514","","","0.1278","0.1458","","","","","","1.014","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104242","10.564","0.003","14.397","0.005","20.578","0.005","90","","91.09","0.015","90","","3129.1","1.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H50 B2 N4 -","- C31 H50 B2 N4 -","- C124 H200 B8 N16 -","4","1","","Kelly E. Krahulic; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Isolation of Free Phenylide-like Carbanions with N-Heterocyclic Carbene Frameworks","Journal of the American Chemical Society","2009","131","","5858","5865","10.1021/ja9001234","","","0.71073","MoKα","","0.1027","0.053","","","0.1216","0.1459","","","","","","1.028","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104243","11.411","0.002","13.544","0.002","21.362","0.004","74.015","0.01","78.738","0.01","68.096","0.011","2928.8","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H87 B2 K N2 O8 -","- C59 H87 B2 K N2 O8 -","- C118 H174 B4 K2 N4 O16 -","2","1","","Kelly E. Krahulic; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Isolation of Free Phenylide-like Carbanions with N-Heterocyclic Carbene Frameworks","Journal of the American Chemical Society","2009","131","","5858","5865","10.1021/ja9001234","","","0.71073","MoKα","","0.0721","0.0462","","","0.1129","0.1313","","","","","","0.962","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104244","26.323","0.004","15.078","0.004","15.509","0.006","90","","90","","90","","6155","3","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C58 H98 B2 K N4 O8 -","- C58 H98 B2 K N4 O8 -","- C232 H392 B8 K4 N16 O32 -","4","0.5","","Kelly E. Krahulic; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Isolation of Free Phenylide-like Carbanions with N-Heterocyclic Carbene Frameworks","Journal of the American Chemical Society","2009","131","","5858","5865","10.1021/ja9001234","","","0.71073","MoKα","","0.1051","0.075","","","0.187","0.2073","","","","","","1.068","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104245","11.9818","0.0002","13.7937","0.0002","16.2215","0.0003","78.109","0.001","72.759","0.001","83.782","0.001","2502.37","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H64 N2 Ni2 O2 P2 -","- C45 H63 N2 Ni2 O3 P2 -","- C90 H126 N4 Ni4 O6 P4 -","2","1","","Brandon A. Rodriguez; Massimiliano Delferro; Tobin J. Marks","Bimetallic Effects for Enhanced Polar Comonomer Enchainment Selectivity in Catalytic Ethylene Polymerization","Journal of the American Chemical Society","2009","131","","5902","5919","10.1021/ja900257k","","","1.54178","CuKα","","0.332","0.0919","","","0.6514","0.2475","","","","","","3.433","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104246","10.436","0.008","14.22","0.012","27.63","0.02","90","","92.307","0.018","90","","4097","6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ni2BisO=PMe3","","","- C44 H64 N2 Ni2 O2 P2 -","- C42 H49 N2 Ni O4 P2 -","- C168 H196 N8 Ni4 O16 P8 -","4","1","","Brandon A. Rodriguez; Massimiliano Delferro; Tobin J. Marks","Bimetallic Effects for Enhanced Polar Comonomer Enchainment Selectivity in Catalytic Ethylene Polymerization","Journal of the American Chemical Society","2009","131","","5902","5919","10.1021/ja900257k","","","1.54178","CuKα","","0.1143","0.0836","","","0.2469","0.2733","","","","","","1.018","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104247","8.6581","0.001","9.8765","0.0012","12.8693","0.0016","92.919","0.002","103.854","0.002","113.448","0.002","966.9","0.2","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H30 O3 -","- C21 H30 O3 -","- C42 H60 O6 -","2","1","","Pallavi Sharma; Barry Lygo; William Lewis; John E. Moses","Biomimetic Synthesis and Structural Reassignment of the Tridachiahydropyrones","Journal of the American Chemical Society","2009","131","","5966","5972","10.1021/ja900369z","","","0.71073","MoKα","","0.0628","0.0496","","","0.1258","0.1341","","","","","","1.071","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104248","10.2794","0.0012","11.535","0.0014","16.1121","0.0019","90","","96.466","0.002","90","","1898.3","0.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H30 O3 -","- C21 H30 O3 -","- C84 H120 O12 -","4","1","","Pallavi Sharma; Barry Lygo; William Lewis; John E. Moses","Biomimetic Synthesis and Structural Reassignment of the Tridachiahydropyrones","Journal of the American Chemical Society","2009","131","","5966","5972","10.1021/ja900369z","","","0.71073","MoKα","","0.0622","0.047","","","0.1168","0.1247","","","","","","1.006","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104249","18.3808","0.0007","11.6486","0.0004","23.6805","0.0009","90","","97.353","0.001","90","","5028.6","0.3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","DpppNippbbbme2, MeCN","","","- C59 H61 N3 Ni P4 -","- C59 H61 N3 Ni P4 -","- C236 H244 N12 Ni4 P16 -","4","1","","Jenny Y. Yang; R. Morris Bullock; Wendy J. Shaw; Brendan Twamley; Kendra Fraze; M. Rakowski DuBois; Daniel L. DuBois","Mechanistic Insights into Catalytic H2 Oxidation by Ni Complexes Containing a Diphosphine Ligand with a Positioned Amine Base","Journal of the American Chemical Society","2009","131","","5935","5945","10.1021/ja900483x","","","0.71073","MoKα","","0.0655","0.0406","","","0.0886","0.0999","","","","","","1.013","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104250","11.9614","0.0007","18.5134","0.0011","29.4975","0.0019","90","","92.783","0.004","90","","6524.4","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Boc-Gpn-Aib-Gpn-Aib-Gpn-Aib-Gpn-Aib-OMe","","","- C58 H100 N8 O11 -","- C58 H100 N8 O11 -","- C232 H400 N32 O44 -","4","1","","Sunanda Chatterjee; Prema G. Vasudev; Srinivasarao Raghothama; Chandrasekharan Ramakrishnan; Narayanaswamy Shamala; Padmanabhan Balaram","Expanding the Peptide β-Turn in αγ Hybrid Sequences: 12 Atom Hydrogen Bonded Helical and Hairpin Turns","Journal of the American Chemical Society","2009","131","","5956","5965","10.1021/ja900618h","","","0.71073","MoKα","","0.4058","0.0731","","","0.1569","0.2858","","","","","","0.806","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104251","9.558","0.0011","26.278","0.003","27.434","0.003","90","","90","","90","","6890.5","1.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Leu-Phe-Val-Aib-Gpn-Leu-Phe-Val-OMe","","","- C63 H100 N8 O12 -","- C63 H100 N8 O12 -","- C252 H400 N32 O48 -","4","1","","Sunanda Chatterjee; Prema G. Vasudev; Srinivasarao Raghothama; Chandrasekharan Ramakrishnan; Narayanaswamy Shamala; Padmanabhan Balaram","Expanding the Peptide β-Turn in αγ Hybrid Sequences: 12 Atom Hydrogen Bonded Helical and Hairpin Turns","Journal of the American Chemical Society","2009","131","","5956","5965","10.1021/ja900618h","","","0.71073","MoKα","","0.145","0.1235","","","0.2948","0.3128","","","","","","1.087","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104252","14.973","0.0011","20.7674","0.0012","28.0225","0.0015","90","","90.211","0.005","90","","8713.5","0.9","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C87 H128 P8 Sm4 -","- C86 H120 P8 Sm4 -","- C344 H480 P32 Sm16 -","4","0.5","","Sergey N. Konchenko; Nikolay A. Pushkarevsky; Michael T. Gamer; Ralf Köppe; Hansgeorg Schnöckel; Peter W. Roesky","[{(η5-C5Me5)2Sm}4P8]: A Molecular Polyphosphide of the Rare-Earth Elements","Journal of the American Chemical Society","2009","131","","5740","5741","10.1021/ja901045m","","","0.71073","MoKα","","0.0717","0.0434","","","0.0884","0.0943","","","","","","1.008","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104253","7.591","0.001","14.08","0.002","14.268","0.003","94.31","0.01","103.19","0.01","90.93","0.01","1479.7","0.4","286","2","286","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H44 N2 O5 Si -","- C29 H44 N2 O5 Si -","- C58 H88 N4 O10 Si2 -","2","1","","Min Zhang; Xiaoping Huang; Liqun Shen; Yong Qin","Total Synthesis of the Akuammiline Alkaloid (\±)-Vincorine","Journal of the American Chemical Society","2009","131","","6013","6020","10.1021/ja901219v","","","0.71073","MoKα","","0.0966","0.0533","","","0.1101","0.1211","","","","","","1.002","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104254","6.705","0.002","7.022","0.002","34.126","0.01","90","","90","","90","","1606.7","0.8","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H26 O6 Si -","- C12 H26 O6 Si -","- C48 H104 O24 Si4 -","4","1","","Sang Min Lim; Nicholas Hill; Andrew G. Myers","A Method for the Preparation of Differentiatedtrans-1,2-Diol Derivatives with Enantio- and Diastereocontrol","Journal of the American Chemical Society","2009","131","","5763","5765","10.1021/ja901283q","","","0.71073","MoKα","","0.0722","0.0617","","","0.1086","0.1124","","","","","","1.159","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104255","7.4443","0.0003","20.6728","0.0009","12.0342","0.0005","90","","93.972","0.002","90","","1847.55","0.13","193","2","193","2","","","","","","","chemical synthesis","5","P 1 21 1","P 2yb","4","B259","(1R,3R,4R,6R)-4,6-Bis(tert-butyldimethylsilyloxy)cyclohexane-1,3-diyl Bis(4-bromobenzoate)","","- C32 H46 Br2 O6 Si2 -","- C32 H46 Br2 O6 Si2 -","- C64 H92 Br4 O12 Si4 -","2","1","","Sang Min Lim; Nicholas Hill; Andrew G. Myers","A Method for the Preparation of Differentiatedtrans-1,2-Diol Derivatives with Enantio- and Diastereocontrol","Journal of the American Chemical Society","2009","131","","5763","5765","10.1021/ja901283q","","","0.71073","MoKα","","0.0351","0.0284","","","0.0691","0.0718","","","","","","1.033","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104256","12.1872","0.0002","10.3016","0.0002","18.9412","0.0004","90","","123.631","0.001","90","","1979.99","0.07","193","2","193","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","RAS-2-233","Methyl 2-(1-(<i>tert</i>-butoxycarbonyloxy)-2-methylpropyl)-4,4- dimethyl-3,5-dioxopyrrolidine-2-carboxylate","","- C17 H27 N O7 -","- C17 H27 N O7 -","- C68 H108 N4 O28 -","4","1","","Ryan A. Shenvi; E. J. Corey","A Short and Efficient Synthesis of (-)-7-Methylomuralide, a Potent Proteasome Inhibitor","Journal of the American Chemical Society","2009","131","","5746","5747","10.1021/ja901400q","","","0.71073","MoKα","","0.0627","0.0442","","","0.1141","0.1271","","","","","","1.023","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104257","9.0015","0.0001","9.14","0.0001","12.5776","0.0001","88.129","0.001","78.693","0.001","88.859","0.001","1014.08","0.018","193","2","193","2","","","","","","","chemical synthesis","4","P -1","-P 1","2","RAS-2-OCbz","Methyl 2-(1-(benzyloxycarbonyloxy)-2-methylpropyl)-4,4- dimethyl-3,5-dioxopyrrolidine-2-carboxylate","","- C20 H25 N O7 -","- C20 H25 N O7 -","- C40 H50 N2 O14 -","2","1","","Ryan A. Shenvi; E. J. Corey","A Short and Efficient Synthesis of (-)-7-Methylomuralide, a Potent Proteasome Inhibitor","Journal of the American Chemical Society","2009","131","","5746","5747","10.1021/ja901400q","","","0.71073","MoKα","","0.044","0.0374","","","0.0992","0.1044","","","","","","1.041","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104258","10.3987","0.0006","18.6372","0.001","9.2437","0.0005","90","","111.409","0.001","90","","1667.84","0.16","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl2 O6 -","- C17 H16 Cl2 O6 -","- C68 H64 Cl8 O24 -","4","1","","Scott A. Snyder; Zhen-Yu Tang; Ritu Gupta","Enantioselective Total Synthesis of (-)-Napyradiomycin A1 via Asymmetric Chlorination of an Isolated Olefin","Journal of the American Chemical Society","2009","131","","5744","5745","10.1021/ja9014716","","","0.71073","MoKα","","0.055","0.0495","","","0.1424","0.1465","","","","","","1.097","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104259","12.199","0.0005","12.4156","0.0005","16.1018","0.0007","73.056","0.004","82.456","0.004","85.222","0.004","2310.08","0.17","110","","110","","","","","","","","","8","P -1","-P 1","2","","","","- C47.47 H27.94 B Cl1.94 Cu F20 N3 O -","- C47.47 H27.94 B Cl1.94 Cu F20 N3 O -","- C94.94 H55.88 B2 Cl3.88 Cu2 F40 N6 O2 -","2","1","","Heather R. Lucas; Lei Li; Amy A. Narducci Sarjeant; Michael A. Vance; Edward I. Solomon; Kenneth D. Karlin","Toluene and Ethylbenzene Aliphatic C-H Bond Oxidations Initiated by a Dicopper(II)-μ-1,2-Peroxo Complex","Journal of the American Chemical Society","2009","131","","3230","3245","10.1021/ja807081d","","","0.71073","MoKα","","0.0692","0.05","","","0.1069","0.1173","","","","","","1.097","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104260","9.1046","0.0005","30.057","0.007","9.638","0.0005","90","","91.63","0.004","90","","2636.4","0.6","110","","110","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20.24 H23.48 Cl2 Cu N3 O9 -","- C20.24 H23.48 Cl2 Cu N3 O9 -","- C80.96 H93.92 Cl8 Cu4 N12 O36 -","4","1","","Heather R. Lucas; Lei Li; Amy A. Narducci Sarjeant; Michael A. Vance; Edward I. Solomon; Kenneth D. Karlin","Toluene and Ethylbenzene Aliphatic C-H Bond Oxidations Initiated by a Dicopper(II)-μ-1,2-Peroxo Complex","Journal of the American Chemical Society","2009","131","","3230","3245","10.1021/ja807081d","","","0.71073","MoKα","","0.0832","0.0565","","","0.1353","0.1433","","","","","","1.053","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104261","8.0704","0.001","17.337","0.003","17.499","0.002","107.807","0.012","90.416","0.01","91.68","0.011","2329.8","0.6","","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C49 H30 B Cu F20 N4 O -","- C49 H30 B Cu F20 N4 O -","- C98 H60 B2 Cu2 F40 N8 O2 -","2","1","","Heather R. Lucas; Lei Li; Amy A. Narducci Sarjeant; Michael A. Vance; Edward I. Solomon; Kenneth D. Karlin","Toluene and Ethylbenzene Aliphatic C-H Bond Oxidations Initiated by a Dicopper(II)-μ-1,2-Peroxo Complex","Journal of the American Chemical Society","2009","131","","3230","3245","10.1021/ja807081d","","","0.71073","MoKα","","0.0646","0.0412","","","0.1151","0.1195","","","","","","1.103","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104262","17.232","0.003","18.005","0.006","18.767","0.006","115.41","0.03","109.99","0.02","94.716","0.019","4759","3","110","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C195.6 H122 B4 Cu4 F80 N12 O11.4 -","- C195.6 H122 B4 Cu4 F80 N12 O11.4 -","- C195.6 H122 B4 Cu4 F80 N12 O11.4 -","1","0.5","","Heather R. Lucas; Lei Li; Amy A. Narducci Sarjeant; Michael A. Vance; Edward I. Solomon; Kenneth D. Karlin","Toluene and Ethylbenzene Aliphatic C-H Bond Oxidations Initiated by a Dicopper(II)-μ-1,2-Peroxo Complex","Journal of the American Chemical Society","2009","131","","3230","3245","10.1021/ja807081d","","","0.71073","MoKα","","0.257","0.0883","","","0.158","0.2072","","","","","","0.868","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104263","12.33","0.002","12.7247","0.0017","14.7999","0.0018","74.404","0.011","84.914","0.012","80.369","0.012","2202.7","0.6","","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C94 H56 B2 Cu2 F40 N6 O4 -","- C94 H56 B2 Cu2 F40 N6 O4 -","- C94 H56 B2 Cu2 F40 N6 O4 -","1","0.5","","Heather R. Lucas; Lei Li; Amy A. Narducci Sarjeant; Michael A. Vance; Edward I. Solomon; Kenneth D. Karlin","Toluene and Ethylbenzene Aliphatic C-H Bond Oxidations Initiated by a Dicopper(II)-μ-1,2-Peroxo Complex","Journal of the American Chemical Society","2009","131","","3230","3245","10.1021/ja807081d","","","0.71073","MoKα","","0.0561","0.0375","","","0.1004","0.105","","","","","","1.11","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104264","13.023","0.003","13.409","0.004","15.048","0.003","112.14","0.03","104.071","0.019","97.69","0.02","2285.4","1.2","","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C48.5 H30 B Cu F20 N4 -","- C48.5 H30 B Cu F20 N4 -","- C97 H60 B2 Cu2 F40 N8 -","2","1","","Heather R. Lucas; Lei Li; Amy A. Narducci Sarjeant; Michael A. Vance; Edward I. Solomon; Kenneth D. Karlin","Toluene and Ethylbenzene Aliphatic C-H Bond Oxidations Initiated by a Dicopper(II)-μ-1,2-Peroxo Complex","Journal of the American Chemical Society","2009","131","","3230","3245","10.1021/ja807081d","","","0.71073","MoKα","","0.1394","0.0612","","","0.0916","0.1076","","","","","","0.907","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104265","6.589","0.0018","10.395","0.003","6.6896","0.0019","90","","115.963","0.002","90","","411.9","0.2","296","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Cl3 Ti -","- C5 H5 Cl3 Ti -","- C10 H10 Cl6 Ti2 -","2","0.5","","Aaron J. Rossini; Ryan W. Mills; Graham A. Briscoe; Erin L. Norton; Stephen J. Geier; Ivan Hung; Shaohui Zheng; Jochen Autschbach; Robert W. Schurko","Solid-State Chlorine NMR of Group IV Transition Metal Organometallic Complexes","Journal of the American Chemical Society","2009","131","","3317","3330","10.1021/ja808390a","","","0.71073","MoKα","","0.0344","0.0309","","","0.0811","0.0845","","","","","","1.104","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104266","16.267","0.0013","14.9046","0.0011","26.8138","0.0018","90","","90","","90","","6501.1","0.8","100","0.2","100","0.2","","","","","","","synthesis as described","6","P b c a","-P 2ac 2ab","61","","","","- C29 H42 Cl Gd N4 O13 -","- C29 H42 Cl Gd N4 O13 -","- C232 H336 Cl8 Gd8 N32 O104 -","8","1","","Adrián Roca-Sabio; Marta Mato-Iglesias; David Esteban-Gómez; Éva Tóth; Andrés de Blas; Carlos Platas-Iglesias; Teresa Rodríguez-Blas","Macrocyclic Receptor Exhibiting Unprecedented Selectivity for Light Lanthanides","Journal of the American Chemical Society","2009","131","","3331","3341","10.1021/ja808534w","","x-ray","0.71073","MoKα","","0.067","0.0293","","","0.0525","0.0637","","","","","","1.018","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104267","14.8493","0.0008","22.4655","0.0009","14.9641","0.0008","90","","93.825","0.002","90","","4980.9","0.4","100","0.2","100","0.2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H68 Cl3 N6 O21 Yb -","- C38 H68 Cl3 N6 O21 Yb -","- C152 H272 Cl12 N24 O84 Yb4 -","4","1","","Adrián Roca-Sabio; Marta Mato-Iglesias; David Esteban-Gómez; Éva Tóth; Andrés de Blas; Carlos Platas-Iglesias; Teresa Rodríguez-Blas","Macrocyclic Receptor Exhibiting Unprecedented Selectivity for Light Lanthanides","Journal of the American Chemical Society","2009","131","","3331","3341","10.1021/ja808534w","","x-ray","0.71073","MoKα","","0.0481","0.0325","","","0.0659","0.0713","","","","","","1.026","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104268","15.8698","0.0014","15.8698","0.0014","16.868","0.0014","90","","90","","90","","4248.2","0.6","103","2","103","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C20 H26 Cl2 N3 O2 Ta -","- C20 H26 Cl2 N3 O2 Ta -","- C160 H208 Cl16 N24 O16 Ta8 -","8","0.5","","Andy I. Nguyen; Karen J. Blackmore; Shawn M. Carter; Ryan A. Zarkesh; Alan F. Heyduk","One- and Two-Electron Reactivity of a Tantalum(V) Complex with a Redox-Active Tris(amido) Ligand","Journal of the American Chemical Society","2009","131","","3307","3316","10.1021/ja808542j","","","0.71073","MoKα","","0.0247","0.0187","","","0.0473","0.0513","","","","","","1.063","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4104269","9.3551","0.0006","9.843","0.0007","14.4426","0.001","94.5768","0.0008","97.6611","0.0008","92.9604","0.0009","1311.22","0.15","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H31 Cl2 N4 O2 Ta -","- C26 H31 Cl2 N4 O2 Ta -","- C52 H62 Cl4 N8 O4 Ta2 -","2","1","","Andy I. Nguyen; Karen J. Blackmore; Shawn M. Carter; Ryan A. Zarkesh; Alan F. Heyduk","One- and Two-Electron Reactivity of a Tantalum(V) Complex with a Redox-Active Tris(amido) Ligand","Journal of the American Chemical Society","2009","131","","3307","3316","10.1021/ja808542j","","","0.71073","MoKα","","0.0285","0.0249","","","0.0611","0.0631","","","","","","1.056","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104270","14.5899","0.0006","15.5065","0.0006","16.2442","0.0007","80.14","0.0005","73.7726","0.0005","87.8341","0.0005","3476.3","0.2","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C36.5 H40 Cl2 N5 O2 Ta -","- C36.5 H40 Cl2 N5 O2 Ta -","- C146 H160 Cl8 N20 O8 Ta4 -","4","2","","Andy I. Nguyen; Karen J. Blackmore; Shawn M. Carter; Ryan A. Zarkesh; Alan F. Heyduk","One- and Two-Electron Reactivity of a Tantalum(V) Complex with a Redox-Active Tris(amido) Ligand","Journal of the American Chemical Society","2009","131","","3307","3316","10.1021/ja808542j","","","0.71073","MoKα","","0.0234","0.0189","","","0.0453","0.047","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104271","15.2986","0.0002","17.1817","0.0003","21.8206","0.0004","90","","90","","90","","5735.67","0.16","120","2","120","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C28 H40 Cl N O P2 Ru -","- C28 H40 Cl N O P2 Ru -","- C224 H320 Cl8 N8 O8 P16 Ru8 -","8","1","","Chidambaram Gunanathan; Linda J. W. Shimon; David Milstein","Direct Conversion of Alcohols to Acetals and H2 Catalyzed by an Acridine-Based Ruthenium Pincer Complex","Journal of the American Chemical Society","2009","131","","3146","3147","10.1021/ja808893g","","","0.71073","MoKα","","0.054","0.0356","","","0.0863","0.0928","","","","","","1.074","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104272","10.1087","0.001","10.7832","0.0011","14.9277","0.0015","84.414","0.002","78.963","0.002","81.217","0.002","1574.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H35 Br5 P2 Pt -","- C26 H35 Br5 P2 Pt -","- C52 H70 Br10 P4 Pt2 -","2","1","","Bao-Yu Wang; Alice Raphael Karikachery; Yunjing Li; Anupam Singh; Han Baek Lee; Wenfang Sun; Paul R. Sharp","Remarkable Bromination and Blue Emission of 9-Anthracenyl Pt(II) Complexes","Journal of the American Chemical Society","2009","131","","3150","3151","10.1021/ja809046p","","","0.71073","MoKα","","0.0639","0.0431","","","0.1001","0.1091","","","","","","1.036","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104273","19.3975","0.0016","12.6089","0.001","14.2731","0.0012","90","","129.005","0.001","90","","2712.8","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H38 Br2 P2 Pt -","- C26 H38 Br2 P2 Pt -","- C104 H152 Br8 P8 Pt4 -","4","0.5","","Bao-Yu Wang; Alice Raphael Karikachery; Yunjing Li; Anupam Singh; Han Baek Lee; Wenfang Sun; Paul R. Sharp","Remarkable Bromination and Blue Emission of 9-Anthracenyl Pt(II) Complexes","Journal of the American Chemical Society","2009","131","","3150","3151","10.1021/ja809046p","","","0.71073","MoKα","","0.0212","0.0185","","","0.0473","0.0485","","","","","","1.032","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104274","9.3779","0.0007","17.2149","0.0014","19.5432","0.0015","70.243","0.001","85.144","0.001","82.561","0.001","2941.5","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H37 Br3 P2 Pt -","- C26 H32.5 Br3 P2 Pt -","- C104 H130 Br12 P8 Pt4 -","4","2","","Bao-Yu Wang; Alice Raphael Karikachery; Yunjing Li; Anupam Singh; Han Baek Lee; Wenfang Sun; Paul R. Sharp","Remarkable Bromination and Blue Emission of 9-Anthracenyl Pt(II) Complexes","Journal of the American Chemical Society","2009","131","","3150","3151","10.1021/ja809046p","","","0.71073","MoKα","","0.0846","0.0524","","","0.128","0.148","","","","","","1.021","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104275","9.568","0.0005","17.4909","0.0009","37.2389","0.0019","90","","90","","90","","6232","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H36 Br4 P2 Pt -","- C26 H36 Br4 P2 Pt -","- C208 H288 Br32 P16 Pt8 -","8","2","","Bao-Yu Wang; Alice Raphael Karikachery; Yunjing Li; Anupam Singh; Han Baek Lee; Wenfang Sun; Paul R. Sharp","Remarkable Bromination and Blue Emission of 9-Anthracenyl Pt(II) Complexes","Journal of the American Chemical Society","2009","131","","3150","3151","10.1021/ja809046p","","","0.71073","MoKα","","0.0728","0.047","","","0.0982","0.1095","","","","","","1.025","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104276","16.6032","0.0004","16.6032","0.0004","16.6032","0.0004","90","","90","","90","","4576.94","0.19","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 Fe8 La21 Sn7 -","- C12 Fe8 La21 Sn7 -","- C48 Fe32 La84 Sn28 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.0233","0.0233","","","0.0533","0.0533","","","","","","1.517","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104277","16.4101","0.0002","16.4101","0.0002","16.4101","0.0002","90","","90","","90","","4419.1","0.09","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 Fe8 La21 Sb7 -","- C12 Fe8 La21 Sb7 -","- C48 Fe32 La84 Sb28 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.0281","0.0281","","","0.0668","0.0668","","","","","","1.343","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104278","16.2911","0.0007","16.2911","0.0007","16.2911","0.0007","90","","90","","90","","4323.7","0.3","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C12 Al2.78 Fe8 La21 Te4.22 -","- C12 Al2.76 Fe8 La21 Te4.24 -","- C48 Al11.04 Fe32 La84 Te16.96 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.0422","0.0422","","","0.0947","0.0947","","","","","","1.365","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104279","16.1589","0.0004","16.1589","0.0004","16.1589","0.0004","90","","90","","90","","4219.25","0.18","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C12 Al2.06 Fe8 Ge4.94 La21 -","- C12 Al2.058 Fe8 Ge4.942 La21 -","- C48 Al8.232 Fe32 Ge19.768 La84 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.0208","0.0208","","","0.0483","0.0483","","","","","","1.58","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104280","16.4863","0.0005","16.4863","0.0005","16.4863","0.0005","90","","90","","90","","4480.9","0.2","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 Bi7 Fe8 La21 -","- C12 Bi7 Fe8 La21 -","- C48 Bi28 Fe32 La84 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.0331","0.0326","","","0.0692","0.0694","","","","","","1.224","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104281","16.2992","0.0003","16.2992","0.0003","16.2992","0.0003","90","","90","","90","","4330.11","0.14","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 Bi7 Ce21 Fe8 -","- C12 Bi7 Ce21 Fe8 -","- C48 Bi28 Ce84 Fe32 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.0244","0.0243","","","0.0483","0.0483","","","","","","1.5","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104282","16.2124","0.0005","16.2124","0.0005","16.2124","0.0005","90","","90","","90","","4261.3","0.2","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 Bi7 Fe8 Pr21 -","- C12 Bi7 Fe8 Pr21 -","- C48 Bi28 Fe32 Pr84 -","4","0.0208333","","Evan M. Benbow; Naresh S. Dalal; Susan E. Latturner","Spin Glass Behavior of Isolated, Geometrically Frustrated Tetrahedra of Iron Atoms in the Intermetallic La21Fe8Sn7C12","Journal of the American Chemical Society","2009","131","","3349","3354","10.1021/ja809084n","","","0.71073","MoKα","","0.026","0.0259","","","0.0584","0.0584","","","","","","1.546","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104283","8.192","0.0016","10.305","0.002","24.315","0.005","78.84","0.03","85.45","0.03","86.33","0.03","2005","0.7","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H51 B Br O P -","- C46 H51 B Br O P -","- C92 H102 B2 Br2 O2 P2 -","2","1","","Youngmin Kim; François P. Gabbaï","Cationic Boranes for the Complexation of Fluoride Ions in Water below the 4 ppm Maximum Contaminant Level","Journal of the American Chemical Society","2009","131","","3363","3369","10.1021/ja8091467","","","0.71073","MoKα","","0.083","0.0578","","","0.1233","0.1354","","","","","","1.009","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104284","22.702","0.004","14.908","0.004","22.802","0.005","90","","112.368","0.004","90","","7136","3","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42.5 H44 B Cl O1.5 P -","- C42.5 H44 B Cl O1.5 P -","- C340 H352 B8 Cl8 O12 P8 -","8","1","","Youngmin Kim; François P. Gabbaï","Cationic Boranes for the Complexation of Fluoride Ions in Water below the 4 ppm Maximum Contaminant Level","Journal of the American Chemical Society","2009","131","","3363","3369","10.1021/ja8091467","","","0.71073","MoKα","","0.0686","0.0478","","","0.1386","0.1608","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104285","12.262","0.003","12.756","0.003","12.976","0.003","73.4","0.03","77.77","0.03","62.25","0.03","1713.9","0.9","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H41 B Cl3 O P -","- C38 H41 B Cl3 O P -","- C76 H82 B2 Cl6 O2 P2 -","2","1","","Youngmin Kim; François P. Gabbaï","Cationic Boranes for the Complexation of Fluoride Ions in Water below the 4 ppm Maximum Contaminant Level","Journal of the American Chemical Society","2009","131","","3363","3369","10.1021/ja8091467","","","0.71073","MoKα","","0.1303","0.084","","","0.1596","0.1739","","","","","","1.008","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4104286","18.988","0.004","19.806","0.004","19.918","0.004","99.42","0.03","104.07","0.03","99.53","0.03","7001","3","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C85 H84 B2 Cl2 F2 P2 -","- C85 H84 B2 Cl2 F2 P2 -","- C340 H336 B8 Cl8 F8 P8 -","4","2","","Youngmin Kim; François P. Gabbaï","Cationic Boranes for the Complexation of Fluoride Ions in Water below the 4 ppm Maximum Contaminant Level","Journal of the American Chemical Society","2009","131","","3363","3369","10.1021/ja8091467","","","0.71073","MoKα","","0.1001","0.0717","","","0.1476","0.1669","","","","","","1.003","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4104287","15.021","0.003","15.613","0.002","49.722","0.009","90","","90","","90","","11661","3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C103 H128 B6 Cl16 N6 O12 -","- C103 H128 B6 Cl16 N6 O12 -","- C412 H512 B24 Cl64 N24 O48 -","4","1","","Burçak Içli; Nicolas Christinat; Justus Tönnemann; Christian Schüttler; Rosario Scopelliti; Kay Severin","Synthesis of Molecular Nanostructures by Multicomponent Condensation Reactions in a Ball Mill","Journal of the American Chemical Society","2009","131","","3154","3155","10.1021/ja809279s","","","0.71073","MoKα","","0.0968","0.0739","","","0.1833","0.201","","","","","","1.102","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104288","17.665","0.008","18.127","0.01","30.45","0.03","82.86","0.07","74.86","0.06","63.57","0.04","8428","11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C123 H120 B6 N6 O12 -","- C123 H120 B6 N6 O12 -","- C246 H240 B12 N12 O24 -","2","1","","Burçak Içli; Nicolas Christinat; Justus Tönnemann; Christian Schüttler; Rosario Scopelliti; Kay Severin","Synthesis of Molecular Nanostructures by Multicomponent Condensation Reactions in a Ball Mill","Journal of the American Chemical Society","2009","131","","3154","3155","10.1021/ja809279s","","","0.71073","MoKα","","0.2687","0.1541","","","0.3645","0.4199","","","","","","0.967","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104289","9.543","0.003","11.132","0.004","17.869","0.006","94.962","0.004","92.843","0.004","111.105","0.004","1757.6","1","90","","90","","","","","","","","","3","P -1","-P 1","2","","","","- C30 H56 Si6 -","- C30 H56 Si6 -","- C60 H112 Si12 -","2","1","","Takeaki Iwamoto; Maiko Kobayashi; Kei Uchiyama; Shin Sasaki; Selvarajan Nagendran; Hiroyuki Isobe; Mitsuo Kira","Anthryl-Substituted Trialkyldisilene Showing Distinct Intramolecular Charge-Transfer Transition","Journal of the American Chemical Society","2009","131","","3156","3157","10.1021/ja8093313","","","0.71073","MoKα","","0.1139","0.0624","","","0.1331","0.1508","","","","","","1.056","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104290","9.09","0.003","11.235","0.004","19.544","0.007","105.125","0.004","90.687","0.004","103.759","0.004","1865.7","1.1","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C34 H58 Si6 -","- C34 H58 Si6 -","- C68 H116 Si12 -","2","1","","Takeaki Iwamoto; Maiko Kobayashi; Kei Uchiyama; Shin Sasaki; Selvarajan Nagendran; Hiroyuki Isobe; Mitsuo Kira","Anthryl-Substituted Trialkyldisilene Showing Distinct Intramolecular Charge-Transfer Transition","Journal of the American Chemical Society","2009","131","","3156","3157","10.1021/ja8093313","","","0.71073","MoKα","","0.1836","0.082","","","0.1767","0.2264","","","","","","1.039","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104291","22.011","0.006","11.173","0.003","15.114","0.004","90","","90","","90","","3717","1.7","173","","173","","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C34 H58 Si6 -","- C34 H58 Si6 -","- C136 H232 Si24 -","4","1","","Takeaki Iwamoto; Maiko Kobayashi; Kei Uchiyama; Shin Sasaki; Selvarajan Nagendran; Hiroyuki Isobe; Mitsuo Kira","Anthryl-Substituted Trialkyldisilene Showing Distinct Intramolecular Charge-Transfer Transition","Journal of the American Chemical Society","2009","131","","3156","3157","10.1021/ja8093313","","","0.71073","MoKα","","0.0555","0.0461","","","0.1122","0.1182","","","","","","1.036","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104292","14.307","0.003","14.724","0.003","19.63","0.003","101.863","0.003","96.16","0.003","99.59","0.003","3947.1","1.3","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H130 K2 O4 Si12 -","- C56 H130 K2 O4 Si12 -","- C112 H260 K4 O8 Si24 -","2","1","","Takeaki Iwamoto; Maiko Kobayashi; Kei Uchiyama; Shin Sasaki; Selvarajan Nagendran; Hiroyuki Isobe; Mitsuo Kira","Anthryl-Substituted Trialkyldisilene Showing Distinct Intramolecular Charge-Transfer Transition","Journal of the American Chemical Society","2009","131","","3156","3157","10.1021/ja8093313","","","0.7107","MoKα","","0.1374","0.0855","","","0.1781","0.2044","","","","","","1.246","","","","has coordinates,has disorder","178788","2020-10-21","18:00:00",""
"4104293","9.701","0.002","11.374","0.002","14.341","0.002","78.216","0.01","87.051","0.011","83.926","0.012","1539.6","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H32 N P -","- C45 H32 N P -","- C90 H64 N2 P2 -","2","1","","Sébastien Graule; Mark Rudolph; Nicolas Vanthuyne; Jochen Autschbach; Christian Roussel; Jeanne Crassous; Régis Réau","Metal-Bis(helicene) Assemblies Incorporating π-Conjugated Phosphole-Azahelicene Ligands: Impacting Chiroptical Properties by Metal Variation","Journal of the American Chemical Society","2009","131","","3183","3185","10.1021/ja809396f","","","0.71069","MoKα","","0.1713","0.0791","","","0.1615","0.1921","","","","","","1.022","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104294","7.6139","0.0004","12.7418","0.0007","24.1476","0.0014","90","","90","","90","","2342.7","0.2","125","2","125","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 N O5 S -","- C24 H31 N O5 S -","- C96 H124 N4 O20 S4 -","4","1","","Tim A. Cernak; Tristan H. Lambert","Multicatalytic Synthesis of α-Pyrrolidinyl Ketones via a Tandem Palladium(II)/Indium(III)-Catalyzed Aminochlorocarbonylation/Friedel-Crafts Acylation Reaction","Journal of the American Chemical Society","2009","131","","3124","3125","10.1021/ja809897f","","","0.71073","MoKα","","0.0329","0.0312","","","0.0863","0.0878","","","","","","1.046","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104295","8.0637","0.0007","12.3948","0.0011","31.67","0.003","90","","90","","90","","3165.4","0.5","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H21 N O2 -","- C19 H21 N O2 -","- C152 H168 N8 O16 -","8","1","","Thomas Tricotet; Patricia Fleming; Juliet Cotter; Anne-Marie L. Hogan; Carsten Strohmann; Viktoria H. Gessner; Donal F. O'Shea","Selective Vinyl C-H Lithiation of cis-Stilbenes","Journal of the American Chemical Society","2009","131","","3142","3143","10.1021/ja809941n","","","0.71073","MoKα","","0.0437","0.0356","","","0.0831","0.0871","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104296","16.132","0.004","20.076","0.005","8.573","0.002","90","","99.491","0.005","90","","2738.5","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 B O3 -","- C15 H15 B O3 -","- C120 H120 B8 O24 -","8","2","","Thomas Tricotet; Patricia Fleming; Juliet Cotter; Anne-Marie L. Hogan; Carsten Strohmann; Viktoria H. Gessner; Donal F. O'Shea","Selective Vinyl C-H Lithiation of cis-Stilbenes","Journal of the American Chemical Society","2009","131","","3142","3143","10.1021/ja809941n","","","0.71073","MoKα","","0.0675","0.0421","","","0.0968","0.1081","","","","","","1.029","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104297","8.5986","0.0015","9.1115","0.0017","9.5605","0.0017","101.637","0.004","100.532","0.003","91.312","0.004","719.9","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H16 O4 -","- C17 H16 O4 -","- C34 H32 O8 -","2","1","","Thomas Tricotet; Patricia Fleming; Juliet Cotter; Anne-Marie L. Hogan; Carsten Strohmann; Viktoria H. Gessner; Donal F. O'Shea","Selective Vinyl C-H Lithiation of cis-Stilbenes","Journal of the American Chemical Society","2009","131","","3142","3143","10.1021/ja809941n","","","0.71073","MoKα","","0.0584","0.0487","","","0.1286","0.1354","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104298","11.0571","0.0009","9.5058","0.0008","16.076","0.0013","90","","107.335","0.002","90","","1612.9","0.2","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 O2 -","- C22 H16 O2 -","- C88 H64 O8 -","4","1","","Thomas Tricotet; Patricia Fleming; Juliet Cotter; Anne-Marie L. Hogan; Carsten Strohmann; Viktoria H. Gessner; Donal F. O'Shea","Selective Vinyl C-H Lithiation of cis-Stilbenes","Journal of the American Chemical Society","2009","131","","3142","3143","10.1021/ja809941n","","","0.71073","MoKα","","0.0521","0.0457","","","0.1208","0.1256","","","","","","1.035","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104299","8.9728","0.0006","9.1409","0.0007","31.088","0.002","87.023","0.001","85.209","0.001","61.503","0.001","2232.8","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H31 Cl2 Ga N2 -","- C20 H31 Cl2 Ga N2 -","- C80 H124 Cl8 Ga4 N8 -","4","2","","Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Paul v. R. Schleyer; Gregory H. Robinson","A Neutral Ga6 Octahedron: Synthesis, Structure, and Aromaticity","Journal of the American Chemical Society","2009","131","","3168","3169","10.1021/ja809945v","","","0.71073","MoKα","","0.0449","0.0373","","","0.0992","0.1031","","","","","","1.064","","","","has coordinates","178788","2020-10-21","18:00:00",""
"4104300","15.0926","0.0019","14.3561","0.0019","20.16","0.003","90","","103.844","0.002","90","","4241.2","1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H62 Cl2 Ga2 N4 -","- C40 H62 Cl2 Ga2 N4 -","- C160 H248 Cl8 Ga8 N16 -","4","1","","Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Paul v. R. Schleyer; Gregory H. Robinson","A Neutral Ga6 Octahedron: Synthesis, Structure, and Aromaticity","Journal of the American Chemical Society","2009","131","","3168","3169","10.1021/ja809945v","","","0.71073","MoKα","","0.1683","0.057","","","0.1235","0.1766","","","","","","1.025","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104301","19.6044","0.0013","22.9053","0.0015","32.804","0.002","90","","90","","90","","14730.5","1.6","273","2","273","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C72 H100 Ga6 N4 -","- C72 H100 Ga6 N4 -","- C576 H800 Ga48 N32 -","8","0.25","","Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Paul v. R. Schleyer; Gregory H. Robinson","A Neutral Ga6 Octahedron: Synthesis, Structure, and Aromaticity","Journal of the American Chemical Society","2009","131","","3168","3169","10.1021/ja809945v","","","0.71073","MoKα","","0.1176","0.057","","","0.1483","0.1814","","","","","","1.049","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104302","16.823","0.0004","15.869","0.0007","17.917","0.0008","90","","90","","90","","4783.2","0.3","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","pentafluorophenyltetrahedrane","","- C19 H27 F5 Si3 -","- C19 H27 F5 Si3 -","- C152 H216 F40 Si24 -","8","1","","Masaaki Nakamoto; Yusuke Inagaki; Motoaki Nishina; Akira Sekiguchi","Perfluoroaryltetrahedranes: Tetrahedranes with Extended σ-π Conjugation","Journal of the American Chemical Society","2009","131","","3172","3173","10.1021/ja810055w","","","0.7107","MoKα","","0.0684","0.0496","","","0.1311","0.1455","","","","","","1.046","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104303","10.057","0.0003","22.355","0.0009","16.017","0.0006","90","","122.588","0.003","90","","3034.1","0.2","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-phenylethynyl(2,3,5,6-tetrafluorophenylene)-4-tetrahedrane","","- C27 H32 F4 Si3 -","- C27 H32 F4 Si3 -","- C108 H128 F16 Si12 -","4","1","","Masaaki Nakamoto; Yusuke Inagaki; Motoaki Nishina; Akira Sekiguchi","Perfluoroaryltetrahedranes: Tetrahedranes with Extended σ-π Conjugation","Journal of the American Chemical Society","2009","131","","3172","3173","10.1021/ja810055w","","","0.7107","MoKα","","0.0579","0.0483","","","0.138","0.1461","","","","","","1.038","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104304","8.5896","0.0003","10.1995","0.0003","37.4208","0.0012","90","","90","","90","","3278.42","0.18","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","C18H28O3","","","- C18 H28 O3 -","- C18 H28 O3 -","- C144 H224 O24 -","8","2","","Hyoungsu Kim; Joseph B. Baker; Su-Ui Lee; Yongho Park; Kyle L. Bolduc; Hyung-Bae Park; Marina G. Dickens; Dong-Sup Lee; Yongchul Kim; Seong Hwan Kim; Jiyong Hong","Stereoselective Synthesis and Osteogenic Activity of Subglutinols A and B","Journal of the American Chemical Society","2009","131","","3192","3194","10.1021/ja8101192","","","0.71073","MoKα","","0.0524","0.0406","","","0.1066","0.1167","","","","","","1.026","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104305","8.1782","0.0003","11.0055","0.0004","17.9809","0.0007","90","","90","","90","","1618.37","0.1","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H26 O3 -","- C18 H26 O3 -","- C72 H104 O12 -","4","1","","Hyoungsu Kim; Joseph B. Baker; Su-Ui Lee; Yongho Park; Kyle L. Bolduc; Hyung-Bae Park; Marina G. Dickens; Dong-Sup Lee; Yongchul Kim; Seong Hwan Kim; Jiyong Hong","Stereoselective Synthesis and Osteogenic Activity of Subglutinols A and B","Journal of the American Chemical Society","2009","131","","3192","3194","10.1021/ja8101192","","","0.71073","MoKα","","0.0582","0.047","","","0.1355","0.1465","","","","","","1.282","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4104306","10.8584","0.0007","13.805","0.0008","21.2206","0.0012","89.015","0.003","88.661","0.003","72.957","0.003","3040.3","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H68 N6 O13 -","- C64 H68 N6 O13 -","- C128 H136 N12 O26 -","2","1","","Begoña Verdejo; Guzmán Gil-Ramírez; Pablo Ballester","Molecular Recognition of Pyridine N-Oxides in Water Using Calix[4]pyrrole Receptors","Journal of the American Chemical Society","2009","131","","3178","3179","10.1021/ja900151u","","","0.71073","MoKα","","0.1229","0.0927","","","0.2648","0.2923","","","","","","1.052","","","","has coordinates","288243","2023-12-12","09:57:13",""
"4104307","11.164","0.004","15.33","0.005","21.339","0.007","76.829","0.007","77.781","0.009","80.682","0.008","3451","2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C77 H80 N8 O14 -","- C77 H80 N8 O14 -","- C154 H160 N16 O28 -","2","1","","Begoña Verdejo; Guzmán Gil-Ramírez; Pablo Ballester","Molecular Recognition of Pyridine N-Oxides in Water Using Calix[4]pyrrole Receptors","Journal of the American Chemical Society","2009","131","","3178","3179","10.1021/ja900151u","","","0.71073","MoKα","","0.1695","0.0898","","","0.234","0.2744","","","","","","1.043","","","","has coordinates","288243","2023-12-12","09:57:13",""
"4104308","11.0003","0.0005","13.8639","0.0006","21.2479","0.0009","87.207","0.002","85.586","0.002","73.617","0.002","3098.4","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C69 H74 N7 O14.5 -","- C69 H74 N7 O14.5 -","- C138 H148 N14 O29 -","2","1","","Begoña Verdejo; Guzmán Gil-Ramírez; Pablo Ballester","Molecular Recognition of Pyridine N-Oxides in Water Using Calix[4]pyrrole Receptors","Journal of the American Chemical Society","2009","131","","3178","3179","10.1021/ja900151u","","","0.71073","MoKα","","0.0861","0.0635","","","0.1721","0.1897","","","","","","1.035","","","","has coordinates,has disorder","288243","2023-12-12","09:57:13",""
"4104309","23.2455","0.0004","8.1765","0.0001","15.5145","0.0003","90","","99.6491","0.0003","90","","2907.07","0.08","90","1","90","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H24 Ti -","- C17 H24 Ti -","- C136 H192 Ti8 -","8","1","","Stephan Scheins; Marc Messerschmidt; Milan Gembicky; Mateusz Pitak; Anatoliy Volkov; Philip Coppens; Benjamin G. Harvey; Gregory C. Turpin; Atta M. Arif; Richard D. Ernst","Charge Density Analysis of the (C-C)\ρightarrowTi Agostic Interactions in a Titanacyclobutane Complex","Journal of the American Chemical Society","2009","131","","6154","6160","10.1021/ja807649k","","","0.71073","MoKα","","0.0253","0.0113","","","","0.01","","","","","","1.8177","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104310","15.3079","0.0012","17.8336","0.0014","20.3259","0.0016","90","","108.407","0.001","90","","5265","0.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H58 B2 Co2 F8 N8 O5 -","- C51 H58 B2 Co2 F8 N8 O5 -","- C204 H232 B8 Co8 F32 N32 O20 -","4","1","","Kil Sik Min; Antonio G. DiPasquale; Arnold L. Rheingold; Henry S. White; Joel S. Miller","Observation of Redox-Induced Electron Transfer and Spin Crossover for Dinuclear Cobalt and Iron Complexes with the 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate Bridging Ligand","Journal of the American Chemical Society","2009","131","","6229","6236","10.1021/ja900909u","","","0.71073","MoKα","","0.0567","0.048","","","0.1274","0.132","","","","","","1.099","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104311","24.12","0.002","15.4044","0.0013","17.0578","0.0014","90","","116.964","0.001","90","","5648.9","0.8","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C54 H60 B3 Co2 F12 N10 O4 -","- C54 H60 B2 Co2 F8 N10 O4 -","- C216 H240 B8 Co8 F32 N40 O16 -","4","0.5","","Kil Sik Min; Antonio G. DiPasquale; Arnold L. Rheingold; Henry S. White; Joel S. Miller","Observation of Redox-Induced Electron Transfer and Spin Crossover for Dinuclear Cobalt and Iron Complexes with the 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate Bridging Ligand","Journal of the American Chemical Society","2009","131","","6229","6236","10.1021/ja900909u","","","0.71073","MoKα","","0.0642","0.055","","","0.1375","0.1428","","","","","","1.074","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104312","17.953","0.003","19.739","0.003","19.19","0.003","90","","109.888","0.002","90","","6394.9","1.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","KS-127-03A","","","- C56 H63 B4 Co2 F16 N14 O4 -","- C50 H54 Co2 N8 O4 -","- C200 H216 Co8 N32 O16 -","4","1","","Kil Sik Min; Antonio G. DiPasquale; Arnold L. Rheingold; Henry S. White; Joel S. Miller","Observation of Redox-Induced Electron Transfer and Spin Crossover for Dinuclear Cobalt and Iron Complexes with the 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate Bridging Ligand","Journal of the American Chemical Society","2009","131","","6229","6236","10.1021/ja900909u","","","0.71073","MoKα","","0.1047","0.0778","","","0.1916","0.2041","","","","","","1.037","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104313","15.245","0.002","18.481","0.003","19.241","0.003","90","","107.588","0.002","90","","5167.6","1.3","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","KS-129-03","","","- C50 H54 B2 F8 Fe2 N8 O4 -","- C50 H54 B2 F8 Fe2 N8 O4 -","- C200 H216 B8 F32 Fe8 N32 O16 -","4","1","","Kil Sik Min; Antonio G. DiPasquale; Arnold L. Rheingold; Henry S. White; Joel S. Miller","Observation of Redox-Induced Electron Transfer and Spin Crossover for Dinuclear Cobalt and Iron Complexes with the 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate Bridging Ligand","Journal of the American Chemical Society","2009","131","","6229","6236","10.1021/ja900909u","","","0.71073","MoKα","","0.1183","0.0864","","","0.2438","0.2738","","","","","","1.033","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104314","15.3981","0.0016","18.5528","0.0019","19.548","0.002","90","","107.824","0.002","90","","5316.4","0.9","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","KS-129-03","","","- C50 H54 B2 F8 Fe2 N8 O4 -","- C50 H54 Fe2 N8 O4 -","- C200 H216 Fe8 N32 O16 -","4","1","","Kil Sik Min; Antonio G. DiPasquale; Arnold L. Rheingold; Henry S. White; Joel S. Miller","Observation of Redox-Induced Electron Transfer and Spin Crossover for Dinuclear Cobalt and Iron Complexes with the 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate Bridging Ligand","Journal of the American Chemical Society","2009","131","","6229","6236","10.1021/ja900909u","","","0.71073","MoKα","","0.073","0.0598","","","0.1782","0.1883","","","","","","1.097","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104315","27.857","0.004","7.1869","0.001","13.0085","0.0018","90","","115.185","0.002","90","","2356.8","0.6","173","2","173","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C50 H26 Br4 F14 N2 O4 -","- C50 H26 Br4 F14 N2 O4 -","- C100 H52 Br8 F28 N4 O8 -","2","0.5","","Rüdiger Schmidt; Joon Hak Oh; Ya-Sen Sun; Manuela Deppisch; Ana-Maria Krause; Krzysztof Radacki; Holger Braunschweig; Martin Könemann; Peter Erk; Zhenan Bao; Frank Würthner","High-Performance Air-Stable n-Channel Organic Thin Film Transistors Based on Halogenated Perylene Bisimide Semiconductors","Journal of the American Chemical Society","2009","131","","6215","6228","10.1021/ja901077a","","","0.71073","MoKα","","0.0316","0.0291","","","0.0726","0.0739","","","","","","1.056","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104316","31.88","0.002","8.5607","0.0006","10.1357","0.0007","90","","90","","90","","2766.2","0.3","100","2","100","2","","","","","","","","5","P n n a","-P 2a 2bc","52","perylen","","","- C36 H6 F12 N2 O4 -","- C36 H6 F12 N2 O4 -","- C144 H24 F48 N8 O16 -","4","0.5","","Rüdiger Schmidt; Joon Hak Oh; Ya-Sen Sun; Manuela Deppisch; Ana-Maria Krause; Krzysztof Radacki; Holger Braunschweig; Martin Könemann; Peter Erk; Zhenan Bao; Frank Würthner","High-Performance Air-Stable n-Channel Organic Thin Film Transistors Based on Halogenated Perylene Bisimide Semiconductors","Journal of the American Chemical Society","2009","131","","6215","6228","10.1021/ja901077a","","","0.71073","MoKα","","0.0487","0.0406","","","0.1072","0.1127","","","","","","1.101","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104317","4.9104","0.0004","8.4835","0.0007","16.2891","0.0013","97.489","0.004","94.373","0.004","98.033","0.004","663.08","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H12 F14 N2 O4 -","- C32 H12 F14 N2 O4 -","- C32 H12 F14 N2 O4 -","1","0.5","","Rüdiger Schmidt; Joon Hak Oh; Ya-Sen Sun; Manuela Deppisch; Ana-Maria Krause; Krzysztof Radacki; Holger Braunschweig; Martin Könemann; Peter Erk; Zhenan Bao; Frank Würthner","High-Performance Air-Stable n-Channel Organic Thin Film Transistors Based on Halogenated Perylene Bisimide Semiconductors","Journal of the American Chemical Society","2009","131","","6215","6228","10.1021/ja901077a","","","0.71073","MoKα","","0.0463","0.0352","","","0.0935","0.0995","","","","","","1.057","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104318","27.0649","0.0012","7.0704","0.0003","26.3217","0.0013","90","","114.671","0.005","90","","4577.1","0.4","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C50 H26 Cl4 F14 N2 O4 -","- C50 H26 Cl4 F14 N2 O4 -","- C200 H104 Cl16 F56 N8 O16 -","4","1","","Rüdiger Schmidt; Joon Hak Oh; Ya-Sen Sun; Manuela Deppisch; Ana-Maria Krause; Krzysztof Radacki; Holger Braunschweig; Martin Könemann; Peter Erk; Zhenan Bao; Frank Würthner","High-Performance Air-Stable n-Channel Organic Thin Film Transistors Based on Halogenated Perylene Bisimide Semiconductors","Journal of the American Chemical Society","2009","131","","6215","6228","10.1021/ja901077a","","","0.71073","MoKα","","0.1156","0.0507","","","0.0903","0.1129","","","","","","1.042","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104319","11.7846","0.0011","12.0337","0.0013","13.2301","0.0011","103.663","0.003","100.758","0.003","117.633","0.003","1516.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H4 Cl4 F10 N2 O4 -","- C36 H4 Cl4 F10 N2 O4 -","- C72 H8 Cl8 F20 N4 O8 -","2","1","","Rüdiger Schmidt; Joon Hak Oh; Ya-Sen Sun; Manuela Deppisch; Ana-Maria Krause; Krzysztof Radacki; Holger Braunschweig; Martin Könemann; Peter Erk; Zhenan Bao; Frank Würthner","High-Performance Air-Stable n-Channel Organic Thin Film Transistors Based on Halogenated Perylene Bisimide Semiconductors","Journal of the American Chemical Society","2009","131","","6215","6228","10.1021/ja901077a","","","0.71073","MoKα","","0.0298","0.0257","","","0.0662","0.069","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104320","11.928","0.003","13.092","0.003","15.633","0.004","90","","109.959","0.003","90","","2294.6","1","123.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H38 Fe N2 -","- C24 H34 Fe N2 -","- C96 H136 Fe4 N8 -","4","1","","Daisuke Noda; Yusuke Sunada; Takuji Hatakeyama; Masaharu Nakamura; Hideo Nagashima","Effect of TMEDA on Iron-Catalyzed Coupling Reactions of ArMgX with Alkyl Halides","Journal of the American Chemical Society","2009","131","","6078","6079","10.1021/ja901262g","","","0.7107","MoKα","","","0.067","","","","0.2314","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104321","15.405","0.002","8.594","0.0009","13.0859","0.0016","90","","90","","90","","1732.4","0.4","123.1","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H27 Br Fe N2 -","- C15 H27 Br Fe N2 -","- C60 H108 Br4 Fe4 N8 -","4","1","","Daisuke Noda; Yusuke Sunada; Takuji Hatakeyama; Masaharu Nakamura; Hideo Nagashima","Effect of TMEDA on Iron-Catalyzed Coupling Reactions of ArMgX with Alkyl Halides","Journal of the American Chemical Society","2009","131","","6078","6079","10.1021/ja901262g","","","0.7107","MoKα","","","0.0482","","","","0.1197","","","","","","0.958","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104322","15.578","0.003","9.1704","0.0018","19.993","0.004","90","","90","","90","","2856.1","1","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C10 H28 Al2 Ge7 N2 O18 -","- C10 H28 Al1.98 Ge7.02 N2 O18 -","- C40 H112 Al7.92 Ge28.08 N8 O72 -","4","0.5","","Jie Su; Yingxia Wang; Zheming Wang; Jianhua Lin","PKU-9: An Aluminogermanate with a New Three-Dimensional Zeolite Framework Constructed from CGS Layers and Spiro-5 Units","Journal of the American Chemical Society","2009","131","","6080","6081","10.1021/ja901330u","","","0.71073","MoKα","","0.078","0.0428","","","0.1218","0.1301","","","","","","1.025","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104323","26.292","0.003","26.292","0.003","26.292","0.003","90","","90","","90","","18175","4","100","2","100","2","","","","","","","","6","P 4 3 2","P 4 2 3","207","","","","- C11.58 H15.25 B0.67 Li0.67 N5.67 O0.17 -","- C11.5601 H15.2228 B0.666667 Li0.666667 N5.66267 O0.166667 -","- C416.165 H548.021 B24 Li24 N203.856 O6 -","36","1.5","","Tao Wu; Jian Zhang; Cong Zhou; Le Wang; Xianhui Bu; Pingyun Feng","Zeolite RHO-Type Net with the Lightest Elements","Journal of the American Chemical Society","2009","131","","6111","6113","10.1021/ja901725v","","","0.71073","MoKα","","0.1493","0.1161","","","0.2805","0.3297","","","","","","1.469","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104324","26.8152","0.0001","26.8152","0.0001","26.8152","0.0001","90","","90","","90","","19281.6","0.12","150","2","150","2","","","","","","","","5","P 4 3 2","P 4 2 3","207","","","","- C20.5 H23.5 B Cu N8 -","- C20.5 H23.5 B Cu N8 -","- C492 H564 B24 Cu24 N192 -","24","1","","Tao Wu; Jian Zhang; Cong Zhou; Le Wang; Xianhui Bu; Pingyun Feng","Zeolite RHO-Type Net with the Lightest Elements","Journal of the American Chemical Society","2009","131","","6111","6113","10.1021/ja901725v","","","0.71073","MoKα","","0.0726","0.0538","","","0.1706","0.1967","","","","","","1.186","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104325","8.9278","0.0001","9.5465","0.0001","21.1523","0.0003","90","","99.338","0.001","90","","1778.9","0.04","293","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H21 B N8 -","- C16 H21 B N8 -","- C64 H84 B4 N32 -","4","1","","Tao Wu; Jian Zhang; Cong Zhou; Le Wang; Xianhui Bu; Pingyun Feng","Zeolite RHO-Type Net with the Lightest Elements","Journal of the American Chemical Society","2009","131","","6111","6113","10.1021/ja901725v","","","0.71073","MoKα","","0.0663","0.046","","","0.1319","0.1466","","","","","","1.016","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104326","18.4911","0.0007","18.4911","0.0007","13.9617","0.001","90","","90","","90","","4773.8","0.4","150","2","150","2","","","","","","","","5","I -4","I -4","82","","","","- C20 H34 B N9 O2 -","- C20 H31 B N9 O2 -","- C160 H248 B8 N72 O16 -","8","1","","Tao Wu; Jian Zhang; Cong Zhou; Le Wang; Xianhui Bu; Pingyun Feng","Zeolite RHO-Type Net with the Lightest Elements","Journal of the American Chemical Society","2009","131","","6111","6113","10.1021/ja901725v","","","0.71073","MoKα","","0.0885","0.0702","","","0.1895","0.2067","","","","","","1.032","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104327","10.598","0.0004","10.6009","0.0005","21.6596","0.0009","93.65","0.003","100.36","0.003","90.017","0.003","2388.72","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C3.11 H2.22 B0.11 Li0.11 N0.89 -","- C3.11111 H2.22222 B0.111111 Li0.111111 N0.888889 -","- C112 H80 B4 Li4 N32 -","36","18","","Tao Wu; Jian Zhang; Cong Zhou; Le Wang; Xianhui Bu; Pingyun Feng","Zeolite RHO-Type Net with the Lightest Elements","Journal of the American Chemical Society","2009","131","","6111","6113","10.1021/ja901725v","","","0.71073","MoKα","","0.2292","0.1706","","","0.4101","0.4546","","","","","","1.18","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104328","10.6599","0.0002","10.6608","0.0002","21.2449","0.0005","86.299","0.001","79.483","0.001","89.989","0.001","2368.66","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H20 B Cu N8 -","- C28 H20 B Cu N8 -","- C112 H80 B4 Cu4 N32 -","4","2","","Tao Wu; Jian Zhang; Cong Zhou; Le Wang; Xianhui Bu; Pingyun Feng","Zeolite RHO-Type Net with the Lightest Elements","Journal of the American Chemical Society","2009","131","","6111","6113","10.1021/ja901725v","","","0.71073","MoKα","","0.1704","0.1308","","","0.3223","0.3465","","","","","","1.107","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104329","18.6069","0.0006","18.6069","0.0006","22.6226","0.0014","90","","90","","120","","6783","0.5","213","2","213","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","MAMS-2","","","- C18 H18 O5 Zn -","- C18 H16 O5 Zn -","- C216 H192 O60 Zn12 -","12","1","","Shengqian Ma; Daofeng Sun; Daqiang Yuan; Xi-Sen Wang; Hong-Cai Zhou","Preparation and Gas Adsorption Studies of Three Mesh-Adjustable Molecular Sieves with a Common Structure","Journal of the American Chemical Society","2009","131","","6445","6451","10.1021/ja808896f","","","0.71073","MoKα","","0.09","0.0746","","","0.2043","0.2136","","","","","","1.06","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104330","18.9328","0.0012","18.9328","0.0012","22.307","0.003","90","","90","","120","","6924.7","1.1","213","2","213","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","MAMS-3","","","- C18 H18 Co O5 -","- C18 H16 Co O5 -","- C216 H192 Co12 O60 -","12","1","","Shengqian Ma; Daofeng Sun; Daqiang Yuan; Xi-Sen Wang; Hong-Cai Zhou","Preparation and Gas Adsorption Studies of Three Mesh-Adjustable Molecular Sieves with a Common Structure","Journal of the American Chemical Society","2009","131","","6445","6451","10.1021/ja808896f","","","0.71073","MoKα","","0.0832","0.0665","","","0.203","0.2098","","","","","","1.064","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104331","18.4472","0.0004","18.4472","0.0004","22.576","0.0012","90","","90","","120","","6653.3","0.4","213","2","213","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","MAMS-4","","","- C18 H18 Cu O5 -","- C18 H16 Cu O5 -","- C216 H192 Cu12 O60 -","12","1","","Shengqian Ma; Daofeng Sun; Daqiang Yuan; Xi-Sen Wang; Hong-Cai Zhou","Preparation and Gas Adsorption Studies of Three Mesh-Adjustable Molecular Sieves with a Common Structure","Journal of the American Chemical Society","2009","131","","6445","6451","10.1021/ja808896f","","","0.71073","MoKα","","0.0936","0.0731","","","0.2152","0.2268","","","","","","1.093","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104332","18.037","0.002","15.732","0.001","19.141","0.002","90","","115.677","0.001","90","","4895.1","0.8","111.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C60 H66 B N2 Yb -","- C60 H66 B N2 Yb -","- C240 H264 B4 N8 Yb4 -","4","0.5","","Corwin H. Booth; Marc D. Walter; Daniel Kazhdan; Yung-Jin Hu; Wayne W. Lukens; Eric D. Bauer; Laurent Maron; Odile Eisenstein; Richard A. Andersen","Decamethylytterbocene Complexes of Bipyridines and Diazabutadienes: Multiconfigurational Ground States and Open-Shell Singlet Formation","Journal of the American Chemical Society","2009","131","","6480","6491","10.1021/ja809624w","","","0.7107","MoKα","","0.0545","0.0364","","0.0424","","0.0393","","","","","","1.397","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104333","13.702","0.003","9.152","0.002","17.958","0.005","90","","103.644","0.002","90","","2188.4","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N2 O6 -","- C24 H26 N2 O6 -","- C96 H104 N8 O24 -","4","1","","Hongchao Guo; Qihai Xu; Ohyun Kwon","Phosphine-Promoted [3 + 3] Annulations of Aziridines With Allenoates: Facile Entry Into Highly Functionalized Tetrahydropyridines","Journal of the American Chemical Society","2009","131","","6318","6319","10.1021/ja8097349","","","0.71073","MoKα","","0.0672","0.0467","","","0.1115","0.1227","","","","","","1.071","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104334","11.115","0.0015","10.6621","0.0015","16.808","0.002","90","","107.044","0.002","90","","1904.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 N2 O6 -","- C19 H26 N2 O6 -","- C76 H104 N8 O24 -","4","1","","Hongchao Guo; Qihai Xu; Ohyun Kwon","Phosphine-Promoted [3 + 3] Annulations of Aziridines With Allenoates: Facile Entry Into Highly Functionalized Tetrahydropyridines","Journal of the American Chemical Society","2009","131","","6318","6319","10.1021/ja8097349","","","0.71073","MoKα","","0.1283","0.0611","","","0.136","0.1635","","","","","","1.024","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104335","25.038","0.004","12.0303","0.0016","9.8885","0.0015","90","","105.419","0.004","90","","2871.4","0.7","143","1","143","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C14 H26 O2 -","- C14 H26 O2 -","- C112 H208 O16 -","8","1","","Mahmud M. Hussain; Hongmei Li; Nusrah Hussain; Mercedes Ureña; Patrick J. Carroll; Patrick J. Walsh","Applications of 1-Alkenyl-1,1-Heterobimetallics in the Stereoselective Synthesis of Cyclopropylboronate Esters, Trisubstituted Cyclopropanols and 2,3-Disubstituted Cyclobutanones","Journal of the American Chemical Society","2009","131","","6516","6524","10.1021/ja900147s","","","0.71073","MoKα","","0.0538","0.0431","","","0.1032","0.1114","","","","","","1.078","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104336","21.008","0.003","12.0889","0.0015","9.875","0.0013","90","","106.017","0.003","90","","2410.5","0.6","143","1","143","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C11 H22 O2 -","- C11 H22 O2 -","- C88 H176 O16 -","8","1","","Mahmud M. Hussain; Hongmei Li; Nusrah Hussain; Mercedes Ureña; Patrick J. Carroll; Patrick J. Walsh","Applications of 1-Alkenyl-1,1-Heterobimetallics in the Stereoselective Synthesis of Cyclopropylboronate Esters, Trisubstituted Cyclopropanols and 2,3-Disubstituted Cyclobutanones","Journal of the American Chemical Society","2009","131","","6516","6524","10.1021/ja900147s","","","0.71073","MoKα","","0.0513","0.0416","","","0.1049","0.1135","","","","","","1.027","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104337","24.797","0.003","13.229","0.0012","9.6376","0.0009","90","","90","","90","","3161.5","0.6","143","1","143","1","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C15 H18 Cl F3 O2 -","- C15 H18 Cl F3 O2 -","- C120 H144 Cl8 F24 O16 -","8","1","","Mahmud M. Hussain; Hongmei Li; Nusrah Hussain; Mercedes Ureña; Patrick J. Carroll; Patrick J. Walsh","Applications of 1-Alkenyl-1,1-Heterobimetallics in the Stereoselective Synthesis of Cyclopropylboronate Esters, Trisubstituted Cyclopropanols and 2,3-Disubstituted Cyclobutanones","Journal of the American Chemical Society","2009","131","","6516","6524","10.1021/ja900147s","","","0.71073","MoKα","","0.0738","0.0603","","","0.1596","0.1708","","","","","","1.062","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104338","28.63","0.03","6.521","0.007","40.62","0.04","90","","92.241","0.018","90","","7578","14","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C95 H16 F30 N8 O -","- C95 H16 F30 N8 O -","- C380 H64 F120 N32 O4 -","4","0.5","","Sung Cho; Jong Min Lim; Satoru Hiroto; Pyosang Kim; Hiroshi Shinokubo; Atsuhiro Osuka; Dongho Kim","Unusual Interchromophoric Interactions in β,β' Directly and Doubly Linked Corrole Dimers: Prohibited Electronic Communication and Abnormal Singlet Ground States","Journal of the American Chemical Society","2009","131","","6412","6420","10.1021/ja900220y","","","0.71073","MoKα","","0.1878","0.0946","","","0.2556","0.3159","","","","","","0.997","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104339","45.961","0.017","6.915","0.003","28.648","0.014","90","","115.291","0.014","90","","8232","6","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H30 Cl8 F30 N8 -","- C88 H30.004 Cl8.002 F30 N8 -","- C352 H120.016 Cl32.008 F120 N32 -","4","0.5","","Sung Cho; Jong Min Lim; Satoru Hiroto; Pyosang Kim; Hiroshi Shinokubo; Atsuhiro Osuka; Dongho Kim","Unusual Interchromophoric Interactions in β,β' Directly and Doubly Linked Corrole Dimers: Prohibited Electronic Communication and Abnormal Singlet Ground States","Journal of the American Chemical Society","2009","131","","6412","6420","10.1021/ja900220y","","","0.71075","MoKα","","0.1358","0.0975","","","0.2748","0.3101","","","","","","1.085","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104340","14.9948","0.0004","39.4282","0.0008","16.3092","0.0004","90","","109.651","0.0011","90","","9080.7","0.4","103","2","103","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C100 H69 Cl3 F30 N8 O2 Zn2 -","- C100 H69 Cl3 F30 N8 O2 Zn2 -","- C400 H276 Cl12 F120 N32 O8 Zn8 -","4","1","","Sung Cho; Jong Min Lim; Satoru Hiroto; Pyosang Kim; Hiroshi Shinokubo; Atsuhiro Osuka; Dongho Kim","Unusual Interchromophoric Interactions in β,β' Directly and Doubly Linked Corrole Dimers: Prohibited Electronic Communication and Abnormal Singlet Ground States","Journal of the American Chemical Society","2009","131","","6412","6420","10.1021/ja900220y","","","0.71069","MoKα","","0.1171","0.0875","","","0.2412","0.27","","","","","","1.027","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104341","20.138","0.003","13.595","0.002","26.549","0.003","90","","95.316","0.006","90","","7237.2","1.7","293","2","16","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 Cu F6 N2 P3 -","- C40 H36 Cu F6 N2 P3 -","- C320 H288 Cu8 F48 N16 P24 -","8","2","","Vorontsov, Ivan I.; Graber, Tim; Kovalevsky, Andrey Yu.; Novozhilova, Irina V.; Gembicky, Milan; Chen, Yu-Sheng; Coppens, Philip","Capturing and Analyzing the Excited-State Structure of a Cu(I) Phenanthroline Complex by Time-Resolved Diffraction and Theoretical Calculations","Journal of the American Chemical Society","2009","131","18","6566","6573","10.1021/ja900921p","","","0.49594","monochromatic","","0.0819","0.0525","","","0.1281","0.1412","","","","","","1.027","","","","has coordinates","219211","2020-10-21","18:00:00",""
"4104342","20.1851","0.0005","13.6617","0.0003","26.5689","0.0006","90","","95.445","0.001","90","","7293.7","0.3","90","1","90","1","","","","","","","in-house chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","Cu(dmp)(diphos)PF6","(2.9-Dimethyl-1,10-phenanthroline)-(1,2-bis(diphenylphosphino) ethane)-copper(i) hexafluorophosphate","","- C40 H36 Cu F6 N2 P3 -","- C40 H36 Cu F6 N2 P3 -","- C320 H288 Cu8 F48 N16 P24 -","8","2","","Vorontsov, Ivan I.; Graber, Tim; Kovalevsky, Andrey Yu.; Novozhilova, Irina V.; Gembicky, Milan; Chen, Yu-Sheng; Coppens, Philip","Capturing and Analyzing the Excited-State Structure of a Cu(I) Phenanthroline Complex by Time-Resolved Diffraction and Theoretical Calculations","Journal of the American Chemical Society","2009","131","18","6566","6573","10.1021/ja900921p","","","0.71073","MoKα","","0.061","0.0346","","","0.0739","0.0881","","","","","","1.048","","","","has coordinates","219211","2020-10-21","18:00:00",""
"4104343","3.6827","0.0004","3.6827","0.0004","25.934","0.006","90","","90","","120","","304.6","0.08","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- Mn0.95 Rb1.57 S6 Sn2.05 -","- Mn0.96 Rb1.572 S6 Sn2.04 -","- Mn0.96 Rb1.572 S6 Sn2.04 -","1","0.0277778","","Manolis J. Manos; Mercouri G. Kanatzidis","Highly Efficient and Rapid Cs+ Uptake by the Layered Metal Sulfide K2xMnxSn3-xS6 (KMS-1)","Journal of the American Chemical Society","2009","131","","6599","6607","10.1021/ja900977p","","","0.71073","MoKα","","0.0437","0.0406","","","0.0986","0.0997","","","","","","1.26","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104344","3.6969","0.0005","3.6969","0.0005","25.403","0.005","90","","90","","120","","300.67","0.08","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- K1.9 Mn0.95 S6 Sn2.05 -","- K1.872 Mn0.93 S6 Sn2.07 -","- K1.872 Mn0.93 S6 Sn2.07 -","1","0.0277778","","Manolis J. Manos; Mercouri G. Kanatzidis","Highly Efficient and Rapid Cs+ Uptake by the Layered Metal Sulfide K2xMnxSn3-xS6 (KMS-1)","Journal of the American Chemical Society","2009","131","","6599","6607","10.1021/ja900977p","","","0.71073","MoKα","","0.0278","0.0264","","","0.0658","0.0686","","","","","","1.192","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104345","3.6139","0.0008","3.6139","0.0008","26.867","0.012","90","","90","","120","","303.88","0.17","293","2","273","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- Cs Mn0.95 S6 Sn2.05 -","- Cs0.993 Mn0.96 S6 Sn2.04 -","- Cs0.993 Mn0.96 S6 Sn2.04 -","1","0.0277778","","Manolis J. Manos; Mercouri G. Kanatzidis","Highly Efficient and Rapid Cs+ Uptake by the Layered Metal Sulfide K2xMnxSn3-xS6 (KMS-1)","Journal of the American Chemical Society","2009","131","","6599","6607","10.1021/ja900977p","","","0.71073","MoKα","","0.0674","0.065","","","0.1699","0.1711","","","","","","1.188","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104346","9.7","0.001","17.298","0.002","21.756","0.003","90","","95.666","0.002","90","","3632.6","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","03086","","","- C26 H58 Mg O2 Si4 -","- C26 H58 Mg O2 Si4 -","- C104 H232 Mg4 O8 Si16 -","4","1","","Stephen C. Chmely; Christin N. Carlson; Timothy P. Hanusa; Arnold L. Rheingold","Classical versus Bridged Allyl Ligands in Magnesium Complexes: The Role of Solvent","Journal of the American Chemical Society","2009","131","","6344","6345","10.1021/ja900998t","","","0.71073","MoKα","","0.0717","0.0475","","","0.1026","0.1117","","","","","","1.014","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104347","10.7597","0.0002","12.9099","0.0002","19.7051","0.0003","90","","100.165","0.001","90","","2694.21","0.08","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H42 Mg Si4 -","- C18 H42 Mg Si4 -","- C72 H168 Mg4 Si16 -","4","2","","Stephen C. Chmely; Christin N. Carlson; Timothy P. Hanusa; Arnold L. Rheingold","Classical versus Bridged Allyl Ligands in Magnesium Complexes: The Role of Solvent","Journal of the American Chemical Society","2009","131","","6344","6345","10.1021/ja900998t","","","1.54178","CuKα","","0.0292","0.0273","","","0.0695","0.0711","","","","","","0.997","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104348","9.0245","0.0012","13.2478","0.0018","14.682","0.0019","94.179","0.007","99.608","0.007","93.006","0.006","1722.4","0.4","100","1","100","1","","","","","","","","6","P -1","-P 1","2","(IPr)Au[eta2-C7H10]+ SbF6-","","","- C34 H46 Au F6 N2 Sb -","- C34 H46 Au F6 N2 Sb -","- C68 H92 Au2 F12 N4 Sb2 -","2","1","","Timothy J. Brown; Marina G. Dickens; Ross A. Widenhoefer","Syntheses, X-ray Crystal Structures, and Solution Behavior of Monomeric, Cationic, Two-Coordinate Gold(I) π-Alkene Complexes","Journal of the American Chemical Society","2009","131","","6350","6351","10.1021/ja9015827","","","0.71073","MoKα","","0.0602","0.0412","","","0.0788","0.0826","","","","","","0.883","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104349","16.9803","0.0005","12.2366","0.0004","21.7326","0.0006","90","","110.479","0.002","90","","4230.2","0.2","110","1","110","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(IPr)Au[eta2-(CH3)2C=C(CH3)2]+ SbF6-","","","- C35 H52 Au Cl4 F6 N2 Sb -","- C35 H52 Au Cl4 F6 N2 Sb -","- C140 H208 Au4 Cl16 F24 N8 Sb4 -","4","1","","Timothy J. Brown; Marina G. Dickens; Ross A. Widenhoefer","Syntheses, X-ray Crystal Structures, and Solution Behavior of Monomeric, Cationic, Two-Coordinate Gold(I) π-Alkene Complexes","Journal of the American Chemical Society","2009","131","","6350","6351","10.1021/ja9015827","","","0.71073","MoKα","","0.0705","0.0391","","","0.0765","0.0838","","","","","","1.073","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104350","16.8505","0.0013","11.6076","0.0009","21.6262","0.0016","90","","106.172","0.004","90","","4062.6","0.5","100","1","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(IPr)Au[eta2-H2C=C(CH3)2]+ SbF6-","","","- C33 H48 Au Cl4 F6 N2 Sb -","- C33 H48 Au Cl4 F6 N2 Sb -","- C132 H192 Au4 Cl16 F24 N8 Sb4 -","4","1","","Timothy J. Brown; Marina G. Dickens; Ross A. Widenhoefer","Syntheses, X-ray Crystal Structures, and Solution Behavior of Monomeric, Cationic, Two-Coordinate Gold(I) π-Alkene Complexes","Journal of the American Chemical Society","2009","131","","6350","6351","10.1021/ja9015827","","","0.71073","MoKα","","0.0462","0.0351","","","0.0893","0.0934","","","","","","1.553","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104351","8.804","0.001","12.052","0.002","12.271","0.002","108.289","0.002","108.256","0.002","105.125","0.002","1076.8","0.3","144.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H26 O4 S2 -","- C24 H26 O4 S2 -","- C48 H52 O8 S4 -","2","1","","Pablo Mauleón; Rachel M. Zeldin; Ana Z. González; F. Dean Toste","Ligand-Controlled Access to [4 + 2] and [4 + 3] Cycloadditions in Gold-Catalyzed Reactions of Allene-Dienes","Journal of the American Chemical Society","2009","131","","6348","6349","10.1021/ja901649s","","","0.7107","MoKα","","0.0545","0.0392","","0.0537","","0.0508","","","","","","1.748","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104352","10.0379","0.0009","15.6091","0.0015","14.2205","0.0014","90","","90.283","0.001","90","","2228.1","0.4","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H31 Au Cl P -","- C23 H31 Au Cl P -","- C92 H124 Au4 Cl4 P4 -","4","1","","Pablo Mauleón; Rachel M. Zeldin; Ana Z. González; F. Dean Toste","Ligand-Controlled Access to [4 + 2] and [4 + 3] Cycloadditions in Gold-Catalyzed Reactions of Allene-Dienes","Journal of the American Chemical Society","2009","131","","6348","6349","10.1021/ja901649s","","","0.71073","MoKα","","0.0405","0.0302","","","0.0619","0.0659","","","","","","0.967","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104353","9.3733","0.0008","11.97","0.001","13.4864","0.0017","114.492","0.002","91.662","0.002","111.942","0.001","1246.6","0.2","124","2","124","2","","","","","","","","5","P -1","-P 1","2","RMZ2.024","TOSTE01","","- C27 H35 Au Cl P -","- C27 H35 Au Cl P -","- C54 H70 Au2 Cl2 P2 -","2","1","","Pablo Mauleón; Rachel M. Zeldin; Ana Z. González; F. Dean Toste","Ligand-Controlled Access to [4 + 2] and [4 + 3] Cycloadditions in Gold-Catalyzed Reactions of Allene-Dienes","Journal of the American Chemical Society","2009","131","","6348","6349","10.1021/ja901649s","","","0.71073","MoKα","","0.0471","0.0372","","","0.0783","0.0838","","","","","","1.057","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104354","23.2928","0.0017","27.637","0.002","24.0457","0.0016","90","","97.338","0.002","90","","15352.5","1.9","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","none","","","- C204 H174 Cu12 N18 O60 -","- C204 H174 Cu12 N18 O60 -","- C408 H348 Cu24 N36 O120 -","2","0.5","","Jian-Rong Li; Daren J. Timmons; Hong-Cai Zhou","Interconversion between Molecular Polyhedra and Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","6368","6369","10.1021/ja901731z","","","0.71073","MoKα","","0.0795","0.0602","","","0.1674","0.1795","","","","","","1.003","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104355","24.56","0.003","24.56","0.003","59.19","0.009","90","","90","","120","","30920","7","213","2","213","2","","","","","","","","5","R -3 :H","-R 3","148","none","","","- C198 H162 Cu12 N18 O60 -","- C198 H162 Cu12 N18 O60 -","- C594 H486 Cu36 N54 O180 -","3","0.166667","","Jian-Rong Li; Daren J. Timmons; Hong-Cai Zhou","Interconversion between Molecular Polyhedra and Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","6368","6369","10.1021/ja901731z","","","0.71073","MoKα","","0.1457","0.0828","","","0.2459","0.2627","","","","","","1.11","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104356","25.293","0.008","25.293","0.008","54.096","0.017","90","","90","","120","","29971","16","213","2","213","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C198 H126 Cu12 N18 O54 -","- C198 H126 Cu12 N18 O54 -","- C594 H378 Cu36 N54 O162 -","3","0.166667","","Jian-Rong Li; Daren J. Timmons; Hong-Cai Zhou","Interconversion between Molecular Polyhedra and Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","6368","6369","10.1021/ja901731z","","","0.71073","MoKα","","0.1416","0.0656","","","0.166","0.1874","","","","","","0.752","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104357","30.5521","0.0015","30.5521","0.0015","30.5521","0.0015","90","","90","","90","","28518","2","293","2","293","2","","","","","","","","5","I m -3 m","-I 4 2 3","229","none","","","- C33 H20 Cu2 N3 O9 -","- C33 H20 Cu2 N3 O9 -","- C396 H240 Cu24 N36 O108 -","12","0.125","","Jian-Rong Li; Daren J. Timmons; Hong-Cai Zhou","Interconversion between Molecular Polyhedra and Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","6368","6369","10.1021/ja901731z","","","0.71073","MoKα","","0.2597","0.0796","","","0.211","0.2851","","","","","","0.953","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104358","8.6896","0.001","18.229","0.002","24.344","0.003","90","","90","","90","","3856.2","0.8","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","none","","","- C44 H37 Cu N7 O4 -","- C44 H37 Cu N7 O4 -","- C176 H148 Cu4 N28 O16 -","4","1","","Jian-Rong Li; Daren J. Timmons; Hong-Cai Zhou","Interconversion between Molecular Polyhedra and Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","6368","6369","10.1021/ja901731z","","","0.71073","MoKα","","0.0893","0.0597","","","0.1541","0.17","","","","","","1.047","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104359","17.575","0.0004","11.552","0.0003","26.296","0.0005","90","","94.809","0.001","90","","5320","0.2","120","0.1","120","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,3-trisilacyclopenta-2,4-diene","","- C43 H96 Si7 -","- C43 H96 Si7 -","- C172 H384 Si28 -","4","1","","Hiroyuki Yasuda; Vladimir Ya. Lee; Akira Sekiguchi","Si3C2-Rings: From a Nonconjugated Trisilacyclopentadiene to an Aromatic Trisilacyclopentadienide and Cyclic Disilenide","Journal of the American Chemical Society","2009","131","","6352","6353","10.1021/ja901881z","","","0.7107","MoKα","","0.052","0.0406","","","0.1193","0.1297","","","","","","0.967","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104360","16.095","0.0006","16.796","0.0007","19.281","0.0004","90","","94.288","0.002","90","","5197.7","0.3","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","C42 H91 O Li Si6","","- C42 H91 Li O Si6 -","- C42 H91 Li O Si6 -","- C168 H364 Li4 O4 Si24 -","4","1","","Hiroyuki Yasuda; Vladimir Ya. Lee; Akira Sekiguchi","Si3C2-Rings: From a Nonconjugated Trisilacyclopentadiene to an Aromatic Trisilacyclopentadienide and Cyclic Disilenide","Journal of the American Chemical Society","2009","131","","6352","6353","10.1021/ja901881z","","","0.7107","MoKα","","0.0839","0.0591","","","0.1733","0.1837","","","","","","1.055","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104361","9.7044","0.0002","9.7044","0.0002","6.8538","0.0003","90","","90","","90","","645.46","0.03","90","2","90","2","","","","","","","","6","P 4/n m m :2","-P 4a 2a","129","Copper(II) bifluoride pyrazine hexafluoroantimonate","","","- C8 H9 Cu F8 N4 Sb -","- C8 H9 Cu F8 N4 Sb -","- C16 H18 Cu2 F16 N8 Sb2 -","2","0.125","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0152","0.0144","","","0.0359","0.0364","","","","","","1.09","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104362","9.719","0.002","9.719","0.002","6.865","0.003","90","","90","","90","","648.5","0.3","150","2","150","2","","","","","","","","6","P 4/n m m :2","-P 4a 2a","129","Copper(II) bifluoride pyrazine hexafluoroantimonate","","","- C8 H9 Cu F8 N4 Sb -","- C8 H9 Cu F8 N4 Sb -","- C16 H18 Cu2 F16 N8 Sb2 -","2","0.125","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0189","0.0175","","","0.0452","0.0458","","","","","","1.103","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104363","9.72","0.0006","9.72","0.0006","6.9414","0.0009","90","","90","","90","","655.81","0.1","298","2","298","2","","","","","","","","6","P 4/n m m :2","-P 4a 2a","129","Copper(II) bifluoride pyrazine hexafluoroantimonate","","","- C8 H9 Cu F8 N4 Sb -","- C8 H9 Cu F8 N4 Sb -","- C16 H18 Cu2 F16 N8 Sb2 -","2","0.125","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0185","0.0182","","","0.0489","0.0491","","","","","","1.083","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104364","13.5926","0.0005","19.9573","0.0007","19.8663","0.0007","90","","90","","90","","5389.2","0.3","90","2","90","2","","","","","","","","6","C m c a","-C 2ac 2","64","[(pyz)4Cu2(HF)F(F2H)][SbF6]2","","","- C16 H18 Cu2 F16 N8 Sb2 -","- C16 H18 Cu2 F16 N8 Sb2 -","- C128 H144 Cu16 F128 N64 Sb16 -","8","","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0275","0.0218","","","0.0537","0.0582","","","","","","1.087","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104365","13.5893","0.0015","19.974","0.003","19.893","0.003","90","","90","","90","","5399.6","1.3","150","2","150","2","","","","","","","","6","C m c a","-C 2ac 2","64","[(pyz)4Cu2(HF)F(F2H)][SbF6]2","","","- C16 H18 Cu2 F16 N8 Sb2 -","- C16 H18 Cu2 F16 N8 Sb2 -","- C128 H144 Cu16 F128 N64 Sb16 -","8","","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0244","0.0233","","","0.071","0.0719","","","","","","1.079","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104366","13.688","0.002","20.055","0.003","19.976","0.003","90","","90","","90","","5483.7","1.4","298","2","298","2","","","","","","","","6","C m c a","-C 2ac 2","64","[(pyz)4Cu2(HF)F(F2H)][SbF6]2","","","- C16 H18 Cu2 F16 N8 Sb2 -","- C16 H18 Cu2 F16 N8 Sb2 -","- C128 H144 Cu16 F128 N64 Sb16 -","8","","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0325","0.0283","","","0.0636","0.0665","","","","","","1.148","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104367","15.0944","0.0006","15.5893","0.0007","14.7562","0.0006","90","","90","","90","","3472.3","0.3","150","2","150","2","","","","","","","","7","C m m a","-C 2a 2","67","","","","- C20 H23 Ag Cu F16 N10 Sb2 -","- C20 H23 Ag Cu F16 N10 Sb2 -","- C80 H92 Ag4 Cu4 F64 N40 Sb8 -","4","0.25","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0682","0.039","","","0.0994","0.1083","","","","","","1.304","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104368","7.9725","0.0008","8.4866","0.0009","10.8938","0.0011","89.841","0.003","84.921","0.002","63.859","0.002","658.54","0.12","298","2","298","2","","","","","","","","6","P -1","-P 1","2","[(pyz)2Cu][SbF6]","","","- C8 H8 Cu F6 N4 Sb -","- C8 H8 Cu F6 N4 Sb -","- C16 H16 Cu2 F12 N8 Sb2 -","2","1","","Jamie L. Manson; John A. Schlueter; Kylee A. Funk; Heather I. Southerland; Brendan Twamley; Tom Lancaster; Stephen J. Blundell; Peter J. Baker; Francis L. Pratt; John Singleton; Ross D. McDonald; Paul A. Goddard; Pinaki Sengupta; Cristain D. Batista; Letan Ding; Changhoon Lee; Myung-Hwan Whangbo; Isabel Franke; Susan Cox; Chris Baines; Derek Trial","Strong H...F Hydrogen Bonds as Synthons in Polymeric Quantum Magnets: Structural, Magnetic, and Theoretical Characterization of [Cu(HF~2~)(pyrazine)~2~]SbF~6~, [Cu~2~F(HF)HF~2~(pyrazine)~4~](SbF~6~)~2~ and [CuAg(H~3~F~4~)(pyrazine)~5~](SbF~6~)~2~","Journal of the American Chemical Society","2009","131","","6733","6747","10.1021/ja808761d","","","0.71073","MoKα","","0.0266","0.0245","","","0.058","0.0588","","","","","","1.096","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104369","11.68","0.0002","17.471","0.0004","19.385","0.0005","69.482","0.001","74.174","0.001","89.58","0.001","3547.21","0.14","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H28 Cl0 N2 O0 -","- C45 H28 N2 -","- C180 H112 N8 -","4","2","","Yi Wei; Shingo Samori; Sachiko Tojo; Mamoru Fujitsuka; Jin-Sheng Lin; Chien-Tien Chen; Tetsuro Majima","Emission Mechanism of Doublyortho-Linked Quinoxaline/Diphenylfluorene or cis-Stilbene/Fluorene Hybrid Compounds Based on the Transient Absorption and Emission Measurements during Pulse Radiolysis","Journal of the American Chemical Society","2009","131","","6698","6707","10.1021/ja8090005","","","0.71073","MoKα","","0.1724","0.0876","","","0.2038","0.2567","","","","","","1.103","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104370","16.8902","0.0006","9.8465","0.0003","17.6024","0.0008","90","","107.789","0.001","90","","2787.48","0.18","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C41 H30 O2 -","- C41 H30 O2 -","- C164 H120 O8 -","4","1","","Yi Wei; Shingo Samori; Sachiko Tojo; Mamoru Fujitsuka; Jin-Sheng Lin; Chien-Tien Chen; Tetsuro Majima","Emission Mechanism of Doublyortho-Linked Quinoxaline/Diphenylfluorene or cis-Stilbene/Fluorene Hybrid Compounds Based on the Transient Absorption and Emission Measurements during Pulse Radiolysis","Journal of the American Chemical Society","2009","131","","6698","6707","10.1021/ja8090005","","","0.71073","MoKα","","0.1453","0.0579","","","0.1317","0.1873","","","","","","0.987","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104371","13.5203","0.0002","30.6169","0.0006","17.9603","0.0003","90","","99.356","0.001","90","","7335.8","0.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C79 H76 F12 Fe N6 O6 P2 -","- C79 H76 F12 Fe N6 O6 P2 -","- C316 H304 F48 Fe4 N24 O24 P8 -","4","1","","Alexander I. Prikhod'ko; Jean-Pierre Sauvage","Passing Two Strings through the Same Ring Using an Octahedral Metal Center as Template: A New Synthesis of [3]Rotaxanes","Journal of the American Chemical Society","2009","131","","6794","6807","10.1021/ja809267z","","","0.71073","MoKα","","0.1204","0.0676","","","0.1788","0.2056","","","","","","1.06","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104372","13.4954","0.0003","19.0943","0.0006","25.8961","0.0008","89.234","0.001","78.448","0.002","84.786","0.002","6510.7","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C123 H108 Co F18 N6 O12 P3 -","- C123 H108 Co F18 N6 O12 P3 -","- C246 H216 Co2 F36 N12 O24 P6 -","2","1","","Alexander I. Prikhod'ko; Jean-Pierre Sauvage","Passing Two Strings through the Same Ring Using an Octahedral Metal Center as Template: A New Synthesis of [3]Rotaxanes","Journal of the American Chemical Society","2009","131","","6794","6807","10.1021/ja809267z","","","0.71073","MoKα","","0.329","0.1465","","","0.3587","0.4388","","","","","","1.117","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104373","31.0363","0.0005","13.1163","0.0002","27.6377","0.0006","90","","117.889","0.001","90","","9944.1","0.3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C108 H96 Co F18 N6 O10 P3 -","- C108 H96 Co F18 N6 O10 P3 -","- C432 H384 Co4 F72 N24 O40 P12 -","4","0.5","","Alexander I. Prikhod'ko; Jean-Pierre Sauvage","Passing Two Strings through the Same Ring Using an Octahedral Metal Center as Template: A New Synthesis of [3]Rotaxanes","Journal of the American Chemical Society","2009","131","","6794","6807","10.1021/ja809267z","","","0.71073","MoKα","","0.1591","0.088","","","0.2527","0.2969","","","","","","1.073","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104374","13.968","0.0004","16.041","0.0003","20.735","0.0006","103.808","0.002","98.228","0.001","101.688","0.002","4327.6","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C99 H78 Cl2 Co N6 O15 -","- C99 H78 Cl2 Co N6 O15 -","- C198 H156 Cl4 Co2 N12 O30 -","2","1","","Alexander I. Prikhod'ko; Jean-Pierre Sauvage","Passing Two Strings through the Same Ring Using an Octahedral Metal Center as Template: A New Synthesis of [3]Rotaxanes","Journal of the American Chemical Society","2009","131","","6794","6807","10.1021/ja809267z","","","0.71073","MoKα","","0.0918","0.0642","","","0.176","0.1918","","","","","","1.102","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104375","12.675","0.0003","14.9214","0.0004","19.4499","0.0005","79.543","0.001","75.832","0.001","89.533","0.001","3504.87","0.16","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H75 Cl12 N4 P Ru -","- C64 H75 Cl12.003 N4 P Ru -","- C128 H150 Cl24.006 N8 P2 Ru2 -","2","1","","Brandon R. Galan; Mateusz Pitak; Milan Gembicky; Jerome B. Keister; Steven T. Diver","Ligand-Promoted Carbene Insertion into the Aryl Substituent of an N-Heterocyclic Carbene Ligand in Ruthenium-Based Metathesis Catalysts","Journal of the American Chemical Society","2009","131","","6822","6832","10.1021/ja809984k","","","0.71073","MoKα","","0.1233","0.098","","","0.2626","0.2888","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104376","15.388","0.002","15.585","0.002","16.341","0.003","92.463","0.004","114.839","0.004","114.18","0.004","3133","0.8","90","1","90","1","","","","","","","","7","P -1","-P 1","2","","","","- C63 H61 Cl4 N4 O P Ru -","- C63 H61 Cl4 N4 O P Ru -","- C126 H122 Cl8 N8 O2 P2 Ru2 -","2","1","","Brandon R. Galan; Mateusz Pitak; Milan Gembicky; Jerome B. Keister; Steven T. Diver","Ligand-Promoted Carbene Insertion into the Aryl Substituent of an N-Heterocyclic Carbene Ligand in Ruthenium-Based Metathesis Catalysts","Journal of the American Chemical Society","2009","131","","6822","6832","10.1021/ja809984k","","","0.71073","MoKα","","0.0555","0.0492","","","0.1428","0.1473","","","","","","1.084","","","","has coordinates,has disorder","178789","2020-10-21","18:00:00",""
"4104377","13.4404","0.0007","15.3105","0.0008","16.4038","0.0009","117.398","0.001","112.842","0.001","90.063","0.002","2694.4","0.3","90","1","90","1","","","","","","","","6","P -1","-P 1","2","","","","- C58 H56 Cl5 N5 O Ru -","- C58 H56 Cl5 N5 O Ru -","- C116 H112 Cl10 N10 O2 Ru2 -","2","1","","Brandon R. Galan; Mateusz Pitak; Milan Gembicky; Jerome B. Keister; Steven T. Diver","Ligand-Promoted Carbene Insertion into the Aryl Substituent of an N-Heterocyclic Carbene Ligand in Ruthenium-Based Metathesis Catalysts","Journal of the American Chemical Society","2009","131","","6822","6832","10.1021/ja809984k","","","0.71073","MoKα","","0.0862","0.0544","","","0.1426","0.1677","","","","","","1.043","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104378","8.5932","0.0003","13.5318","0.0004","17.3502","0.0006","90","","90","","90","","2017.51","0.12","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Trichlorosilane-bis(p-tert-butylpyridine)","","- C18 H27 Cl3 N2 Si -","- C18 H27 Cl3 N2 Si -","- C72 H108 Cl12 N8 Si4 -","4","1","","Gerrit W. Fester; Jörg Wagler; Erica Brendler; Uwe Böhme; Daniela Gerlach; Edwin Kroke","Octahedral HSiCl3 and HSiCl2Me Adducts with Pyridines","Journal of the American Chemical Society","2009","131","","6855","6864","10.1021/ja901053w","","","0.71073","MoKα","","0.0585","0.0423","","","0.1083","0.1204","","","","","","1.105","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104379","8.4028","0.001","7.2048","0.0008","16.494","0.002","90","","91.419","0.004","90","","998.2","0.2","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis-(4-phenylpyridine)hydridotrichlorosilane","","- C22 H19 Cl3 N2 Si -","- C22 H19 Cl3 N2 Si -","- C44 H38 Cl6 N4 Si2 -","2","0.5","","Gerrit W. Fester; Jörg Wagler; Erica Brendler; Uwe Böhme; Daniela Gerlach; Edwin Kroke","Octahedral HSiCl3 and HSiCl2Me Adducts with Pyridines","Journal of the American Chemical Society","2009","131","","6855","6864","10.1021/ja901053w","","","0.71073","MoKα","","0.0893","0.0484","","","0.1108","0.12","","","","","","0.906","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104380","15.5719","0.0013","13.3478","0.0011","7.1495","0.0006","90","","92.911","0.003","90","","1484.1","0.2","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis-(4-methylpyridine)methylhydridodichlorosilane","","- C13 H18 Cl2 N2 Si -","- C13 H18 Cl2 N2 Si -","- C52 H72 Cl8 N8 Si4 -","4","1","","Gerrit W. Fester; Jörg Wagler; Erica Brendler; Uwe Böhme; Daniela Gerlach; Edwin Kroke","Octahedral HSiCl3 and HSiCl2Me Adducts with Pyridines","Journal of the American Chemical Society","2009","131","","6855","6864","10.1021/ja901053w","","","0.71073","MoKα","","0.0668","0.0414","","","0.1108","0.1228","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104381","9.1395","0.0003","9.9123","0.0004","10.7813","0.0004","80.006","0.002","65.544","0.002","79.592","0.002","869.12","0.06","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","Bis-(4-dimethylaminopyridine)methylhydridodichlorosilane","","- C15 H24 Cl2 N4 Si -","- C15 H24 Cl2 N4 Si -","- C30 H48 Cl4 N8 Si2 -","2","1","","Gerrit W. Fester; Jörg Wagler; Erica Brendler; Uwe Böhme; Daniela Gerlach; Edwin Kroke","Octahedral HSiCl3 and HSiCl2Me Adducts with Pyridines","Journal of the American Chemical Society","2009","131","","6855","6864","10.1021/ja901053w","","","0.71073","MoKα","","0.0533","0.0361","","","0.0986","0.1049","","","","","","1.111","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104382","16.463","0.0006","15.455","0.0005","10.138","0.0003","90","","123.341","0.002","90","","2154.93","0.13","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H32 B2 N2 Zr2 -","- C20 H32 B2 N2 Zr2 -","- C80 H128 B8 N8 Zr8 -","4","0.5","","Taryn D. Forster; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Characterization of β-B-Agostic Isomers in Zirconocene Amidoborane Complexes","Journal of the American Chemical Society","2009","131","","6689","6691","10.1021/ja901460y","","","0.71073","MoKα","","0.0323","0.0268","","","0.064","0.0665","","","","","","1.048","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104383","7.984","0.0005","14.837","0.0005","10.305","0.0005","90","0.003","117.83","0.003","90","0.002","1079.52","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 B N Zr -","- C10 H16 B N Zr -","- C40 H64 B4 N4 Zr4 -","4","1","","Taryn D. Forster; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Characterization of β-B-Agostic Isomers in Zirconocene Amidoborane Complexes","Journal of the American Chemical Society","2009","131","","6689","6691","10.1021/ja901460y","","","0.71073","MoKα","","0.0819","0.0536","","","0.0763","0.0843","","","","","","1.141","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104384","8.1","0.0004","10.792","0.0006","15.087","0.0006","90","","119.12","0.003","90","","1152.14","0.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H15 B Cl N Zr -","- C10 H15 B Cl N Zr -","- C40 H60 B4 Cl4 N4 Zr4 -","4","1","","Taryn D. Forster; Heikki M. Tuononen; Masood Parvez; Roland Roesler","Characterization of β-B-Agostic Isomers in Zirconocene Amidoborane Complexes","Journal of the American Chemical Society","2009","131","","6689","6691","10.1021/ja901460y","","","0.71073","MoKα","","0.0624","0.0354","","","0.0691","0.0781","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104385","9.649","0.003","9.649","0.003","5.198","0.003","90","","90","","120","","419.1","0.3","296","2","296","2","","","","","","","","4","P 63","P 6c","173","","","","- I6 Na2 O18 Ti -","- I6 Na2 O18 Ti -","- I6 Na2 O18 Ti -","1","0.166667","","Hong-Young Chang; Sang-Hwan Kim; Kang Min Ok; P. Shiv Halasyamani","Polar or Nonpolar? A+ Cation Polarity Control in A2Ti(IO3)6 (A = Li, Na, K, Rb, Cs, Tl)","Journal of the American Chemical Society","2009","131","","6865","6873","10.1021/ja9015099","","","0.71073","MoKα","","0.0505","0.0354","","","0.0553","0.0581","","","","","","1.099","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104386","11.2703","0.0006","11.2703","0.0006","11.3514","0.0011","90","","90","","120","","1248.68","0.15","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- I6 K2 O18 Ti -","- I6 K2 O18 Ti -","- I18 K6 O54 Ti3 -","3","0.166667","","Hong-Young Chang; Sang-Hwan Kim; Kang Min Ok; P. Shiv Halasyamani","Polar or Nonpolar? A+ Cation Polarity Control in A2Ti(IO3)6 (A = Li, Na, K, Rb, Cs, Tl)","Journal of the American Chemical Society","2009","131","","6865","6873","10.1021/ja9015099","","","0.71073","MoKα","","0.0281","0.0223","","","0.0517","0.0529","","","","","","1.152","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104387","11.3757","0.0016","11.3757","0.0016","11.426","0.003","90","","90","","120","","1280.5","0.4","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- I6 O18 Rb2 Ti -","- I6 O18 Rb2 Ti -","- I18 O54 Rb6 Ti3 -","3","0.166667","","Hong-Young Chang; Sang-Hwan Kim; Kang Min Ok; P. Shiv Halasyamani","Polar or Nonpolar? A+ Cation Polarity Control in A2Ti(IO3)6 (A = Li, Na, K, Rb, Cs, Tl)","Journal of the American Chemical Society","2009","131","","6865","6873","10.1021/ja9015099","","","0.71073","MoKα","","0.0596","0.0456","","","0.1198","0.1259","","","","","","1.137","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104388","11.6726","0.0005","11.6726","0.0005","11.6399","0.001","90","","90","","120","","1373.46","0.14","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- Cs2 I6 O18 Ti -","- Cs2 I6 O18 Ti -","- Cs6 I18 O54 Ti3 -","3","0.166667","","Hong-Young Chang; Sang-Hwan Kim; Kang Min Ok; P. Shiv Halasyamani","Polar or Nonpolar? A+ Cation Polarity Control in A2Ti(IO3)6 (A = Li, Na, K, Rb, Cs, Tl)","Journal of the American Chemical Society","2009","131","","6865","6873","10.1021/ja9015099","","","0.71073","MoKα","","0.0248","0.0164","","","0.0274","0.0286","","","","","","0.907","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104389","11.4167","0.0006","11.4167","0.0006","11.3953","0.0011","90","","90","","120","","1286.29","0.16","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- I6 O18 Ti Tl2 -","- I6 O18 Ti Tl2 -","- I18 O54 Ti3 Tl6 -","3","0.166667","","Hong-Young Chang; Sang-Hwan Kim; Kang Min Ok; P. Shiv Halasyamani","Polar or Nonpolar? A+ Cation Polarity Control in A2Ti(IO3)6 (A = Li, Na, K, Rb, Cs, Tl)","Journal of the American Chemical Society","2009","131","","6865","6873","10.1021/ja9015099","","","0.71073","MoKα","","0.0504","0.0421","","","0.1133","0.1157","","","","","","1.162","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104390","18.9145","0.0007","17.2265","0.0005","10.4262","0.0004","90","","90","","90","","3397.2","0.2","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C35 H55 N2 P Ru -","- C35 H56 N2 P Ru -","- C140 H224 N8 P4 Ru4 -","4","0.5","","Halil Aktas; J. Chris Slootweg; Marius Schakel; Andreas W. Ehlers; Martin Lutz; Anthony L. Spek; Koop Lammertsma","N-Heterocyclic Carbene-Functionalized Ruthenium Phosphinidenes: What a Difference a Twist Makes","Journal of the American Chemical Society","2009","131","","6666","6667","10.1021/ja901540h","","","0.71073","MoKα","","0.0408","0.0335","","","0.0817","0.0848","","","","","","1.172","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104391","19.5083","0.001","18.2986","0.0005","22.217","0.001","90","","113.4","0.0019","90","","7278.6","0.5","153.1","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C75 H98 Cl6 Ir2 O6 P2 -","- C75 H98 Cl6 Ir2 O6 P2 -","- C300 H392 Cl24 Ir8 O24 P8 -","4","1","","Tomohiro Iwai; Tetsuaki Fujihara; Jun Terao; Yasushi Tsuji","Iridium-Catalyzed Addition of Acid Chlorides to Terminal Alkynes","Journal of the American Chemical Society","2009","131","","6668","6669","10.1021/ja901778y","","","0.7107","MoKα","","","0.0373","","","","0.0907","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104392","13.077","0.011","7.098","0.006","14.856","0.012","90","","101.902","0.014","90","","1349.3","1.9","153.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 Cl F3 O -","- C16 H10 Cl F3 O -","- C64 H40 Cl4 F12 O4 -","4","1","","Tomohiro Iwai; Tetsuaki Fujihara; Jun Terao; Yasushi Tsuji","Iridium-Catalyzed Addition of Acid Chlorides to Terminal Alkynes","Journal of the American Chemical Society","2009","131","","6668","6669","10.1021/ja901778y","","","0.7107","MoKα","","","0.0597","","","","0.0748","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104393","14.7624","0.0015","5.7017","0.0006","16.5862","0.0015","90","","94.381","0.006","90","","1392","0.2","153.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C17 H13 Cl O3 -","- C17 H13 Cl O3 -","- C68 H52 Cl4 O12 -","4","1","","Tomohiro Iwai; Tetsuaki Fujihara; Jun Terao; Yasushi Tsuji","Iridium-Catalyzed Addition of Acid Chlorides to Terminal Alkynes","Journal of the American Chemical Society","2009","131","","6668","6669","10.1021/ja901778y","","","0.7107","MoKα","","","0.0437","","","","0.0584","","","","","","0.962","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104394","7.1332","0.0002","9.229","0.0003","13.0111","0.0004","90","","103.216","0.001","90","","833.87","0.04","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H14 Cl N -","- C22 H14 Cl N -","- C44 H28 Cl2 N2 -","2","1","","Jorge García-Fortanet; Florian Kessler; Stephen L. Buchwald","Palladium-Catalyzed Asymmetric Dearomatization of Naphthalene Derivatives","Journal of the American Chemical Society","2009","131","","6676","6677","10.1021/ja9025193","","","1.54178","CuKα","","0.0226","0.0224","","","0.0594","0.0595","","","","","","1.038","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104395","9.6774","0.0007","11.5225","0.0008","17.5094","0.0013","90","","90","","90","","1952.4","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H22 Br N -","- C25 H22 Br N -","- C100 H88 Br4 N4 -","4","1","","Jorge García-Fortanet; Florian Kessler; Stephen L. Buchwald","Palladium-Catalyzed Asymmetric Dearomatization of Naphthalene Derivatives","Journal of the American Chemical Society","2009","131","","6676","6677","10.1021/ja9025193","","","0.71073","MoKα","","0.0264","0.0237","","","0.0608","0.062","","","","","","1.037","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104396","10.4928","0.0003","5.1755","0.0001","11.2885","0.0003","90","","112.412","0.001","90","","566.72","0.03","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C12 H20 O4 -","- C12 H20 O4 -","- C24 H40 O8 -","2","1","","Christopher J. Morten; Timothy F. Jamison","Water Overcomes Methyl Group Directing Effects in Epoxide-Opening Cascades","Journal of the American Chemical Society","2009","131","","6678","6679","10.1021/ja9025243","","","1.54178","CuKα","","0.0283","0.0281","","","0.0839","0.0842","","","","","","1.102","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104397","18.9594","0.0015","18.4485","0.0015","13.177","0.004","90","","104.204","0.003","90","","4468","1.4","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C35 H36 O16 Zn2 -","- C35 H30 O16 Zn2 -","- C140 H120 O64 Zn8 -","4","1","","Zhengang Guo; Rong Cao; Xin Wang; Hongfang Li; Wenbing Yuan; Guojian Wang; Haohan Wu; Jing Li","A Multifunctional 3D Ferroelectric and NLO-Active Porous Metal-Organic Framework","Journal of the American Chemical Society","2009","131","","6894","6895","10.1021/ja9000129","","","0.71073","MoKα","","0.0548","0.0481","","","0.1361","0.1428","","","","","","0.905","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104398","8.6537","0.0006","9.4166","0.0006","13.4394","0.0009","90","","90","","90","","1095.16","0.13","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C52 H60 N4 O8 -","4","1","","Bassam K. Alnasleh; William M. Sherrill; Marina Rubina; Joseph Banning; Michael Rubin","Highly Diastereoselective Formal Nucleophilic Substitution of Bromocyclopropanes","Journal of the American Chemical Society","2009","131","","6906","6907","10.1021/ja900634m","","","0.71073","MoKα","","0.0561","0.05","","","0.0978","0.1004","","","","","","1.057","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104399","4.1566","0.0004","14.0039","0.0012","16.4888","0.0015","90","","94.338","0.006","90","","957.04","0.15","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ClBPTSMe","","","- C6 H3 Cl N3 S2 Se2 -","- C6 H3 Cl N3 S2 Se2 -","- C24 H12 Cl4 N12 S8 Se8 -","4","1","","Alicea A. Leitch; Xueyang Yu; Stephen M. Winter; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Structure and Property Correlations in Heavy Atom Radical Conductors","Journal of the American Chemical Society","2009","131","","7112","7125","10.1021/ja900853t","","","1.54178","CuKα","","0.0656","0.0442","","","0.1035","0.1115","","","","","","1.065","","","","has coordinates","178789","2020-10-21","18:00:00",""
"4104400","4.1932","0.0002","15.1413","0.0008","16.1531","0.0008","90","","90","","90","","1025.57","0.09","295","2","295","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","ClBPSTMe","","","- C6 H3 Cl N3 S2 Se2 -","- C6 H3 Cl N3 S2 Se2 -","- C24 H12 Cl4 N12 S8 Se8 -","4","1","","Alicea A. Leitch; Xueyang Yu; Stephen M. Winter; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Structure and Property Correlations in Heavy Atom Radical Conductors","Journal of the American Chemical Society","2009","131","","7112","7125","10.1021/ja900853t","","","0.71073","MoKα","","0.0389","0.0268","","","0.0499","0.0527","","","","","","1.024","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104401","4.1978","0.0002","14.318","0.0008","16.7655","0.0009","90","","96.22","0.001","90","","1001.74","0.09","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ClBPSSMe","","","- C6 H3 Cl N3 Se4 -","- C6 H3 Cl N3 Se4 -","- C24 H12 Cl4 N12 Se16 -","4","1","","Alicea A. Leitch; Xueyang Yu; Stephen M. Winter; Richard A. Secco; Paul A. Dube; Richard T. Oakley","Structure and Property Correlations in Heavy Atom Radical Conductors","Journal of the American Chemical Society","2009","131","","7112","7125","10.1021/ja900853t","","","0.71073","MoKα","","0.0296","0.0235","","","0.0521","0.0537","","","","","","0.969","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104402","13.023","0.003","13.385","0.004","14.076","0.004","80.98","0.004","86.683","0.004","61.886","0.003","2137","1","110","2","110","2","","","","","","","","5","P -1","-P 1","2","ZP1_2,2-DPA-DCF","","","- C48 H41 Cl2 N7 O6 -","- C48 H41 Cl2 N7 O6 -","- C96 H82 Cl4 N14 O12 -","2","1","","Brian A. Wong; Simone Friedle; Stephen J. Lippard","Solution and Fluorescence Properties of Symmetric Dipicolylamine-Containing Dichlorofluorescein-Based Zn2+ Sensors","Journal of the American Chemical Society","2009","131","","7142","7152","10.1021/ja900980u","","","0.71073","MoKα","","0.061","0.0487","","","0.1192","0.1267","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104403","14.766","0.003","14.851","0.003","22.573","0.004","92.659","0.003","105.087","0.002","117.641","0.003","4152.3","1.4","110","2","110","2","","","","","","","","5","P -1","-P 1","2","2,4-DPA-DCF","","","- C48 H39 Cl2 N7 O5.25 -","- C48 H39 Cl2 N7 O5.25 -","- C192 H156 Cl8 N28 O21 -","4","2","","Brian A. Wong; Simone Friedle; Stephen J. Lippard","Solution and Fluorescence Properties of Symmetric Dipicolylamine-Containing Dichlorofluorescein-Based Zn2+ Sensors","Journal of the American Chemical Society","2009","131","","7142","7152","10.1021/ja900980u","","","0.71073","MoKα","","0.0734","0.0511","","","0.1261","0.1384","","","","","","1.039","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104404","10.521","0.002","11.825","0.003","12.749","0.003","90.43","0.003","111.283","0.003","111.419","0.003","1357.8","0.5","476","2","476","2","","","","","","","","5","P -1","-P 1","2","DEA-DCF","","","- C30 H31 Cl2 N2 O5 -","- C30 H31 Cl2 N2 O5 -","- C60 H62 Cl4 N4 O10 -","2","1","","Brian A. Wong; Simone Friedle; Stephen J. Lippard","Solution and Fluorescence Properties of Symmetric Dipicolylamine-Containing Dichlorofluorescein-Based Zn2+ Sensors","Journal of the American Chemical Society","2009","131","","7142","7152","10.1021/ja900980u","","","0.71073","MoKα","","0.0581","0.0477","","","0.1167","0.1234","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104405","6.3985","0.0005","7.5006","0.0005","12.1391","0.0009","90.32","0.007","96.714","0.006","103.08","0.009","563.27","0.07","300","","300","","","","170000","","","","","4","P -1","-P 1","2","","Au(tmdt)2","","- C18 H12 Au S12 -","- C18 H12 Au S12 -","- C18 H12 Au S12 -","1","0.5","","Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi","High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]","Journal of the American Chemical Society","2009","131","","7169","7174","10.1021/ja9010018","powder diffraction","","0.49559","synchrotron","","","","","","","","","0.039","","","","","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104406","6.2925","0.0007","7.3513","0.0006","12.0494","0.0011","89.596","0.008","96.355","0.009","102.898","0.014","539.89","0.09","300","","300","","","","780000","","","","","4","P -1","-P 1","2","","Au(tmdt)2","","- C18 H12 Au S12 -","- C18 H12 Au S12 -","- C18 H12 Au S12 -","1","0.5","","Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi","High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]","Journal of the American Chemical Society","2009","131","","7169","7174","10.1021/ja9010018","powder diffraction","","0.49559","synchrotron","","","","","","","","","0.042","","","","","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104407","6.2129","0.0006","7.2359","0.0006","11.9817","0.0012","89.145","0.009","96.038","0.01","102.756","0.014","522.42","0.09","300","","300","","","","1300000","","","","","4","P -1","-P 1","2","","Au(tmdt)2","","- C18 H12 Au S12 -","- C18 H12 Au S12 -","- C18 H12 Au S12 -","1","0.5","","Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi","High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]","Journal of the American Chemical Society","2009","131","","7169","7174","10.1021/ja9010018","powder diffraction","","0.49559","synchrotron","","","","","","","","","0.04","","","","","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104408","6.0539","0.0005","7.009","0.0005","11.8438","0.001","88.216","0.01","95.438","0.008","102.638","0.014","488.14","0.07","300","","300","","","","2960000","","","","","4","P -1","-P 1","2","","Au(tmdt)2","","- C18 H12 Au S12 -","- C18 H12 Au S12 -","- C18 H12 Au S12 -","1","0.5","","Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi","High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]","Journal of the American Chemical Society","2009","131","","7169","7174","10.1021/ja9010018","powder diffraction","","0.49559","synchrotron","","","","","","","","","0.027","","","","","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104409","5.9126","0.0006","6.8074","0.0006","11.7174","0.0008","87.4","0.01","94.883","0.009","102.49","0.02","458.61","0.08","300","","300","","","","5500000","","","","","4","P -1","-P 1","2","","Au(tmdt)2","","- C18 H12 Au S12 -","- C18 H12 Au S12 -","- C18 H12 Au S12 -","1","0.5","","Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi","High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]","Journal of the American Chemical Society","2009","131","","7169","7174","10.1021/ja9010018","powder diffraction","","0.49559","synchrotron","","","","","","","","","0.03","","","","","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104410","5.7645","0.001","6.5657","0.0009","11.591","0.002","86.318","0.014","94.352","0.015","102.41","0.03","426.69","0.13","300","","300","","","","10660000","","","","","4","P -1","-P 1","2","","Au(tmdt)2","","- C18 H12 Au S12 -","- C18 H12 Au S12 -","- C18 H12 Au S12 -","1","0.5","","Yoshinori Okano; Biao Zhou; Hishashi Tanaka; Takafumi Adachi; Yasuo Ohishi; Masaki Takata; Shinobu Aoyagi; Eiji Nishibori; Makoto Sakata; Akiko Kobayashi; Hayao Kobayashi","High-Pressure (up to 10.7 GPa) Crystal Structure of Single-Component Molecular Metal [Au(tmdt)2]","Journal of the American Chemical Society","2009","131","","7169","7174","10.1021/ja9010018","powder diffraction","","0.49559","synchrotron","","","","","","","","","0.035","","","","","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104411","29.389","0.003","43.595","0.005","45.965","0.005","90","","90","","90","","58891","11","113","2","113","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C144 H484 Br12 Cl18 Er60 N34 O354 -","- C140 H340 Er60 N34 O232 -","- C560 H1360 Er240 N136 O928 -","4","0.5","","Xiang-Jian Kong; Yinglan Wu; La-Sheng Long; Lan-Sun Zheng; Zhiping Zheng","A Chiral 60-Metal Sodalite Cage Featuring 24 Vertex-Sharing [Er4(μ3-OH)4] Cubanes","Journal of the American Chemical Society","2009","131","","6918","6919","10.1021/ja901214d","","","0.71073","MoKα","","0.114","0.0633","","","0.1271","0.141","","","","","","1.036","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104412","29.2379","0.0003","43.3554","0.0006","46.0899","0.0005","90","","90","","90","","58424.5","1.2","293","2","293","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C144 H484 Br12 Cl18 Er60 N34 O354 -","- C140 H340 Er60 N34 O238 -","- C560 H1360 Er240 N136 O952 -","4","0.5","","Xiang-Jian Kong; Yinglan Wu; La-Sheng Long; Lan-Sun Zheng; Zhiping Zheng","A Chiral 60-Metal Sodalite Cage Featuring 24 Vertex-Sharing [Er4(μ3-OH)4] Cubanes","Journal of the American Chemical Society","2009","131","","6918","6919","10.1021/ja901214d","","","1.54178","CuKα","","0.1164","0.1042","","","0.2441","0.2529","","","","","","1.058","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104413","11.5735","0.0002","11.5735","0.0002","6.9885","0.0003","90","","90","","120","","810.67","0.04","193","2","193","2","","","","","","","","5","P 32","P 32","145","","","","- C10 H11 B N2 O4 -","- C10 H11 B N2 O4 -","- C30 H33 B3 N6 O12 -","3","1","","David M. Knapp; Eric P. Gillis; Martin D. Burke","A General Solution for Unstable Boronic Acids: Slow-Release Cross-Coupling from Air-Stable MIDA Boronates","Journal of the American Chemical Society","2009","131","","6961","6963","10.1021/ja901416p","","","0.71073","MoKα","","0.0285","0.0264","","","0.0693","0.0721","","","","","","1.079","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104414","12.9806","0.0011","13.0795","0.0012","17.3387","0.0015","95.315","0.001","109.101","0.001","111.843","0.001","2503.7","0.4","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C63 H70 Ge O2 -","- C63 H70 Ge O2 -","- C126 H140 Ge2 O4 -","2","1","","Xinping Wang; Zhongliang Zhu; Yang Peng; Hao Lei; James C. Fettinger; Philip P. Power","Room-Temperature Reaction of Carbon Monoxide with a Stable Diarylgermylene","Journal of the American Chemical Society","2009","131","","6912","6913","10.1021/ja9017286","","","0.71073","MoKα","","0.0802","0.0464","","","0.1044","0.1131","","","","","","0.978","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104415","10.8193","0.0005","49.856","0.002","14.1848","0.0006","90","","97.784","0.001","90","","7580.9","0.6","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C185 H228 Ge2 O4 -","- C185 H228 Ge2 O4 -","- C370 H456 Ge4 O8 -","2","0.5","","Xinping Wang; Zhongliang Zhu; Yang Peng; Hao Lei; James C. Fettinger; Philip P. Power","Room-Temperature Reaction of Carbon Monoxide with a Stable Diarylgermylene","Journal of the American Chemical Society","2009","131","","6912","6913","10.1021/ja9017286","","","0.71073","MoKα","","0.0792","0.0509","","","0.1154","0.1229","","","","","","1.045","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104416","8.404","0.0009","5.9967","0.0006","11.1389","0.001","90","","106.366","0.004","90","","538.61","0.09","150","1","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H14 O2 S -","- C12 H14 O2 S -","- C24 H28 O4 S2 -","2","1","","Matthew M. Coulter; Peter K. Dornan; Vy M. Dong","Rh-Catalyzed Intramolecular Olefin Hydroacylation: Enantioselective Synthesis of Seven- and Eight-Membered Heterocycles","Journal of the American Chemical Society","2009","131","","6932","6933","10.1021/ja901915u","","","0.71073","MoKα","","0.0665","0.0457","","","0.0979","0.1103","","","","","","1.063","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104417","8.2853","0.0004","13.867","0.0008","6.4876","0.0003","90","","103.698","0.003","90","","724.17","0.06","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H16 Cl4 Co2 O4 -","- C8 H16 Cl4 Co2 O4 -","- C16 H32 Cl8 Co4 O8 -","2","0.25","","Zhiming Duan; Yan Zhang; Bin Zhang; Daoben Zhu","Crystal-to-Crystal Transformation from Antiferromagnetic Chains into a Ferromagnetic Diamondoid Framework","Journal of the American Chemical Society","2009","131","","6934","6935","10.1021/ja902101x","","","0.71073","MoKα","","0.0367","0.027","","","0.063","0.0656","","","","","","1.076","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104418","6.859","0.0002","9.1904","0.0003","8.0991","0.0003","90","","114.854","0.001","90","","463.26","0.03","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H6 Cl Co0.5 O2 -","- C2 H6 Cl Co0.5 O2 -","- C8 H24 Cl4 Co2 O8 -","4","1","","Zhiming Duan; Yan Zhang; Bin Zhang; Daoben Zhu","Crystal-to-Crystal Transformation from Antiferromagnetic Chains into a Ferromagnetic Diamondoid Framework","Journal of the American Chemical Society","2009","131","","6934","6935","10.1021/ja902101x","","","0.71073","MoKα","","0.0298","0.023","","","0.0534","0.0554","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104419","6.3066","0.0007","8.188","0.0008","26.402","0.002","90","","90","","90","","1363.4","0.2","150","","150","","","","","","","","Synthesized by the authors. See text","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H15 Br N2 O -","- C15 H15 Br N2 O -","- C60 H60 Br4 N8 O4 -","4","1","","David Marcoux; Soula Azzi; André B. Charette","TfNH2 as Achiral Hydrogen-Bond Donor Additive to Enhance the Selectivity of a Transition Metal Catalyzed Reaction. Highly Enantio- and Diastereoselective Rhodium-Catalyzed Cyclopropanation of Alkenes Using α-Cyano Diazoacetamide","Journal of the American Chemical Society","2009","131","","6970","6972","10.1021/ja902205f","","","1.54178","CuKα","","0.0349","0.0347","","","0.0938","0.094","","","","","","1.071","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104420","22.8055","0.0012","23.0389","0.0012","17.2256","0.0009","90","","90","","90","","9050.6","0.8","153","2","153","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C52 H46 Ir N O9 P2 -","- C48 H36 Ir N O8 P2 -","- C384 H288 Ir8 N8 O64 P16 -","8","2","","Soo Bong Han; In Su Kim; Hoon Han; Michael J. Krische","Enantioselective Carbonyl Reverse Prenylation from the Alcohol or Aldehyde Oxidation Level Employing 1,1-Dimethylallene as the Prenyl Donor","Journal of the American Chemical Society","2009","131","","6916","6917","10.1021/ja902437k","","","0.71073","MoKα","","0.1042","0.0809","","","0.1462","0.1495","","","","","","1.769","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104421","12.9468","0.001","10.525","0.0008","20.5386","0.0018","90","","93.473","0.005","90","","2793.6","0.4","193","2","193","2","","","","","","","","10","P 1 21 1","P 2yb","4","","","","- C57 H56 B Cl3 F4 Fe Ni O P4 S2 -","- C57 H56 B Cl3 F4 Fe Ni O P4 S2 -","- C114 H112 B2 Cl6 F8 Fe2 Ni2 O2 P8 S4 -","2","1","","Bryan E. Barton; C. Matthew Whaley; Thomas B. Rauchfuss; Danielle L. Gray","Nickel-Iron Dithiolato Hydrides Relevant to the [NiFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2009","131","","6942","6943","10.1021/ja902570u","","","0.71073","MoKα","","0.0854","0.0596","","","0.132","0.145","","","","","","1.167","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104422","9.8894","0.0007","11.643","0.0008","20.6688","0.0015","74.482","0.005","84.864","0.004","77.498","0.004","2237.5","0.3","193","2","193","2","","","","","","","","9","P -1","-P 1","2","","","","- C84 H102 B2 F8 Fe2 Ni2 O11 P4 S4 -","- C83.992 H101.984 B2 F8 Fe2 Ni2 O10.998 P4 S4 -","- C83.992 H101.984 B2 F8 Fe2 Ni2 O10.998 P4 S4 -","1","0.5","","Bryan E. Barton; C. Matthew Whaley; Thomas B. Rauchfuss; Danielle L. Gray","Nickel-Iron Dithiolato Hydrides Relevant to the [NiFe]-Hydrogenase Active Site","Journal of the American Chemical Society","2009","131","","6942","6943","10.1021/ja902570u","","","0.71073","MoKα","","0.2166","0.0702","","","0.1282","0.178","","","","","","0.961","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104423","28.776","0.014","11.868","0.006","32.32","0.02","90","","115.653","0.006","90","","9950","9","90","","90","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C64 H42 Cl4 N4 -","- C64 H42 Cl4 N4 -","- C512 H336 Cl32 N32 -","8","1","","Hiroshi Miyasaka; Yusuke Satoh; Yukihide Ishibashi; Syoji Ito; Yutaka Nagasawa; Seiji Taniguchi; Haik Chosrowjan; Noboru Mataga; Daisuke Kato; Azusa Kikuchi; Jiro Abe","Ultrafast Photodissociation Dynamics of a Hexaarylbiimidazole Derivative with Pyrenyl Groups: Dispersive Reaction from Femtosecond to 10 ns Time Regions","Journal of the American Chemical Society","2009","131","","7256","7263","10.1021/ja809195s","","","0.71073","MoKα","","0.0822","0.0699","","","0.171","0.1801","","","","","","1.032","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104424","16.21","0.004","20.391","0.005","23.229","0.006","90","","98.095","0.012","90","","7602","3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H58 F20 N6 Si2 -","- C76 H58 F20 N6 Si2 -","- C304 H232 F80 N24 Si8 -","4","1","","Min-Chul Yoon; Sung Cho; Masaaki Suzuki; Atsuhiro Osuka; Dongho Kim","Aromatic versus Antiaromatic Effect on Photophysical Properties of Conformationally Lockedtrans-Vinylene-Bridged Hexaphyrins","Journal of the American Chemical Society","2009","131","","7360","7367","10.1021/ja9000536","","","0.71075","MoKα","","0.1556","0.1267","","","0.3595","0.3746","","","","","","1.322","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104425","11.2927","0.0012","12.2466","0.0013","15.2241","0.0015","73.373","0.002","79.17","0.002","68.124","0.002","1864.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","dppmAu2Br6","","","- C26 H24 Au2 Br6 Cl2 P2 -","- C26 H24 Au2 Br6 Cl2 P2 -","- C52 H48 Au4 Br12 Cl4 P4 -","2","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0658","0.0408","","","0.1042","0.1189","","","","","","1.021","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104426","9.5914","0.0008","15.0383","0.0013","26.602","0.002","90","","96.941","0.002","90","","3808.9","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","dcpmAu2Br6","","","- C27 H50 Au2 Br6 Cl2 P2 -","- C27 H50 Au2 Br6 Cl2 P2 -","- C108 H200 Au8 Br24 Cl8 P8 -","4","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0407","0.0344","","","0.073","0.0749","","","","","","1.173","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104427","15.787","0.002","15.787","0.002","30.811","0.004","90","","90","","120","","6650.2","1.5","100","2","100","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C30 H51 Au2 Cl12 P2 -","- C30 H51 Au2 Cl12 P2 -","- C180 H306 Au12 Cl72 P12 -","6","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0471","0.0406","","","0.1026","0.108","","","","","","1.079","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104428","9.9293","0.0006","14.9256","0.0009","21.1774","0.0013","90","","93.054","0.001","90","","3134","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","dppmAu2Cl6","","","- C26 H24 Au2 Cl8 P2 -","- C26 H24 Au2 Cl8 P2 -","- C104 H96 Au8 Cl32 P8 -","4","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0301","0.0234","","","0.0481","0.0507","","","","","","1.032","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104429","12.57","0.003","13.011","0.003","16.508","0.003","90","","90","","90","","2699.9","1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","dppmAuClAuCl3","","","- C25 H22 Au2 Cl4 P2 -","- C25 H22 Au2 Cl4 P2 -","- C100 H88 Au8 Cl16 P8 -","4","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0315","0.0293","","","0.0671","0.0678","","","","","","1.052","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104430","11.7519","0.0009","14.3982","0.001","19.2592","0.0014","90","","95.461","0.001","90","","3244","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","dcpm(AuBr)(AuBr3)","","","- C25 H46 Au2 Br4 P2 -","- C25 H46 Au2 Br4 P2 -","- C100 H184 Au8 Br16 P8 -","4","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0444","0.0319","","","0.0748","0.0805","","","","","","1.048","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104431","17.2194","0.0014","13.7859","0.0014","18.2238","0.0016","90","","99.905","0.002","90","","4261.6","0.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","PCy3AuCl3","","","- C18 H33 Au Cl3 P -","- C18 H33 Au Cl3 P -","- C144 H264 Au8 Cl24 P8 -","8","1","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0437","0.0341","","","0.065","0.0681","","","","","","1.122","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104432","14.7919","0.0009","16.4575","0.001","9.0123","0.0005","90","","90","","90","","2193.9","0.2","296","2","296","2","","","","","","","","5","P n m a","-P 2ac 2n","62","PCy3AuBr3","","","- C18 H33 Au Br3 P -","- C18 H33 Au Br3 P -","- C72 H132 Au4 Br12 P4 -","4","0.5","","Thomas S. Teets; Daniel G. Nocera","Halogen Photoreductive Elimination from Gold(III) Centers","Journal of the American Chemical Society","2009","131","","7411","7420","10.1021/ja9009937","","","0.71073","MoKα","","0.0295","0.0224","","","0.0474","0.0501","","","","","","1.05","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104433","25.9305","0.0012","5.0875","0.0003","14.8171","0.0008","90","","119.549","0.001","90","","1700.45","0.16","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- As F10 N S Xe -","- As F10 N S Xe -","- As8 F80 N8 S8 Xe8 -","8","1","","Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen","Solid-State and Solution Rearrangements of F3S\τbNXeF+ Leading to the F4S=NXe+ Cation; Syntheses, HF Solvolyses, and Structural Characterizations of [F4S=NXe][AsF6] and [F4S=NH2][AsF6]","Journal of the American Chemical Society","2009","131","","7272","7286","10.1021/ja901187n","","","0.71073","MoKα","","0.0265","0.0224","","","0.0509","0.0524","","","","","","1.081","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104434","5.4447","0.0006","6.6457","0.0007","10.3063","0.0011","89.484","0.009","87.479","0.007","74.955","0.007","359.79","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","F4 S N H2, As F6","","","- As F10 H2 N S -","- As F10 H2 N S -","- As2 F20 H4 N2 S2 -","2","1","","Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen","Solid-State and Solution Rearrangements of F3S\τbNXeF+ Leading to the F4S=NXe+ Cation; Syntheses, HF Solvolyses, and Structural Characterizations of [F4S=NXe][AsF6] and [F4S=NH2][AsF6]","Journal of the American Chemical Society","2009","131","","7272","7286","10.1021/ja901187n","","","0.71073","MoKα","","0.1335","0.0855","","","0.1623","0.1725","","","","","","1.418","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104435","13.653","0.004","14.23","0.004","17.518","0.005","77.44","0.004","86.604","0.004","89.381","0.004","3316.1","1.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C67 H59 F3 I N O12 P4 -","- C67 H59 F3 I N O12 P4 -","- C134 H118 F6 I2 N2 O24 P8 -","2","1","","Elisa Biavardi; Maria Favazza; Alessandro Motta; Ignazio L. Fragalà; Chiara Massera; Luca Prodi; Marco Montalti; Monica Melegari; Guglielmo G. Condorelli; Enrico Dalcanale","Molecular Recognition on a Cavitand-Functionalized Silicon Surface","Journal of the American Chemical Society","2009","131","","7447","7455","10.1021/ja901678b","","","0.71073","MoKα","","0.0631","0.0468","","","0.1403","0.142","","","","","","1.029","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104436","15.313","0.003","16.539","0.004","16.677","0.004","67.754","0.004","68.076","0.004","85.881","0.004","3614.6","1.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C73 H82 I N O16 P4 -","- C64 H64 I N O13 P4 -","- C128 H128 I2 N2 O26 P8 -","2","1","","Elisa Biavardi; Maria Favazza; Alessandro Motta; Ignazio L. Fragalà; Chiara Massera; Luca Prodi; Marco Montalti; Monica Melegari; Guglielmo G. Condorelli; Enrico Dalcanale","Molecular Recognition on a Cavitand-Functionalized Silicon Surface","Journal of the American Chemical Society","2009","131","","7447","7455","10.1021/ja901678b","","","0.71069","MoKα","","0.1207","0.0751","","","0.1825","0.1958","","","","","","1.011","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104437","14.141","0.004","14.141","0.004","11.289","0.004","90","","90","","90","","2257.4","1.2","100","2","100","2","","","","","","","","3","P 42/n :2","-P 4bc","86","","","","- C11 H20 O3 -","- C11 H20 O3 -","- C88 H160 O24 -","8","1","","Giuditta Guazzelli; Sara De Grazia; Karl D. Collins; Hiroshi Matsubara; Malcolm Spain; David J. Procter","Selective Reductions of Cyclic 1,3-Diesters Using SmI2 and H2O","Journal of the American Chemical Society","2009","131","","7214","7215","10.1021/ja901715d","","","0.71073","MoKα","","0.1013","0.0701","","","0.1745","0.1895","","","","","","1.056","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104438","3.8933","0.0001","46.6322","0.0006","5.7018","0.0001","90","","91.017","0.001","90","","1035.02","0.03","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 O4 -","- C12 H10 O4 -","- C48 H40 O16 -","4","1","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0652","0.0518","","","0.1441","0.1598","","","","","","1.097","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104439","3.8085","0.0002","46.6731","0.0019","5.9322","0.0003","90","","91.53","0.003","90","","1054.1","0.09","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 O4 -","- C11.88 H9.9 O3.96 -","- C47.52 H39.6 O15.84 -","4","1","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.1695","0.1515","","","0.4865","0.5001","","","","","","2.367","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104440","3.876","0.0016","22.776","0.01","5.892","0.003","90","","91.571","0.007","90","","519.9","0.4","296","2","296","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C12 H10 O4 -","- C12 H10 O4 -","- C24 H20 O8 -","2","0.5","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0909","0.0616","","","0.1782","0.2032","","","","","","1.055","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104441","3.8266","0.0002","23.0145","0.0009","5.9776","0.0002","90","","91.777","0.003","90","","526.18","0.04","296","2","296","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C12 H10 O4 -","- C12 H10 O4 -","- C24 H20 O8 -","2","0.5","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.1477","0.083","","","0.2817","0.3529","","","","","","1.059","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104442","24.7573","0.0011","5.6223","0.0002","3.8806","0.0002","90","","90","","90","","540.15","0.04","296","2","296","2","","","","","","","","3","P m a 2","P 2 -2a","28","","","","- C12 H12 O5 -","- C12 H12 O5 -","- C24 H24 O10 -","2","0.5","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0344","0.0297","","","0.0711","0.0742","","","","","","1.085","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104443","4.0165","0.0002","29.8961","0.0012","6.2402","0.0003","90","","90.084","0.004","90","","749.31","0.06","173","2","173","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C16 H18 O6 -","- C16 H18 O6 -","- C32 H36 O12 -","2","0.5","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0654","0.0383","","","0.0849","0.0919","","","","","","0.958","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104444","16.2402","0.0019","15.7995","0.0019","12.7087","0.0015","90","","125.498","0.001","90","","2654.8","0.5","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 O5 -","- C14 H14 O5 -","- C112 H112 O40 -","8","1","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0672","0.0473","","","0.1452","0.1705","","","","","","1.043","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104445","7.5745","0.0015","3.8768","0.0008","28.671","0.006","90","","92.45","0.03","90","","841.1","0.3","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 O3 -","- C10 H8 O3 -","- C40 H32 O12 -","4","1","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0578","0.0437","","","0.1136","0.1259","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104446","10.934","0.002","14.085","0.003","18.36","0.004","68.08","0.03","76.48","0.03","76.01","0.03","2512.8","1.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","5,20-diphenyl-10,15-ditolyl-2-oksa-3-okso-21 -diphenylphosphoryloporhyrinato copper(II) dichloromathane disolvate","","- C60 H44 Cl4 Cu N3 O3 P -","- C60 H44 Cl4 Cu N3 O3 P -","- C120 H88 Cl8 Cu2 N6 O6 P2 -","2","1","","Norbert Grzegorzek; Miłosz Pawlicki; Ludmiła Szterenberg; Lechosław Latos-Grażyński","Organocopper(II) Complex of 21-Diphenylphosphoryl-Carbaporpholactone Hybrid: A Side-On Coordination Mode of Copper(II)","Journal of the American Chemical Society","2009","131","","7224","7225","10.1021/ja902310n","","","0.71073","MoKα","","0.0961","0.0552","","","0.1109","0.1225","","","","","","1.054","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104447","16.573","0.003","18.521","0.004","19.981","0.004","105.37","0.03","90.18","0.03","94.18","0.03","5896","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H54 Cl3 N3 O3.5 P -","- C63 H54 Cl3 N3 O3.5 P -","- C252 H216 Cl12 N12 O14 P4 -","4","2","","Norbert Grzegorzek; Miłosz Pawlicki; Ludmiła Szterenberg; Lechosław Latos-Grażyński","Organocopper(II) Complex of 21-Diphenylphosphoryl-Carbaporpholactone Hybrid: A Side-On Coordination Mode of Copper(II)","Journal of the American Chemical Society","2009","131","","7224","7225","10.1021/ja902310n","","","0.71073","MoKα","","0.1566","0.0977","","","0.259","0.2938","","","","","","1.051","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104448","11.0868","0.0016","10.1911","0.0014","13.851","0.002","90","","102.926","0.005","90","","1525.3","0.4","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C34 H33 Cl2 N3 Ni O3 -","- C34 H33 Cl2 N3 Ni O3 -","- C68 H66 Cl4 N6 Ni2 O6 -","2","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.042","0.0405","","","0.1102","0.1117","","","","","","1.002","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104449","23.999","0.004","8.8743","0.0016","18.269","0.003","90","","121.612","0.005","90","","3313.5","1","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C35 H37 Cl2 N3 Ni O4 -","- C34 H33 Cl2 N3 Ni O3 -","- C136 H132 Cl8 N12 Ni4 O12 -","4","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.0642","0.0546","","","0.1462","0.1525","","","","","","1.037","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104450","9.8982","0.0012","12.9223","0.0016","21.547","0.002","90","","90","","90","","2756","0.5","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H32 N4 Ni O3 -","- C28 H29 N3 Ni O3 -","- C112 H116 N12 Ni4 O12 -","4","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.0233","0.0229","","","0.0598","0.06","","","","","","1.003","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104451","10.3867","0.0016","8.1085","0.0012","17.113","0.002","90","","95.665","0.005","90","","1434.2","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H33 N3 Ni O3 -","- C34 H33 N3 Ni O3 -","- C68 H66 N6 Ni2 O6 -","2","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.027","0.0264","","","0.0694","0.0701","","","","","","1.009","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104452","10.1519","0.0014","9.4117","0.0012","13.988","0.002","90","","107.886","0.005","90","","1271.9","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H33 N3 Ni O3 -","- C30 H33 N3 Ni O3 -","- C60 H66 N6 Ni2 O6 -","2","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.0269","0.0262","","","0.0668","0.0673","","","","","","1.006","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104453","10.0845","0.0018","10.515","0.002","26.97","0.005","90","","90","","90","","2859.9","0.9","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H35 Cl2 N3 Ni O3 -","- C31 H35 Cl2 N3 Ni O3 -","- C124 H140 Cl8 N12 Ni4 O12 -","4","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.0353","0.0325","","","0.0824","0.084","","","","","","1.01","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104454","10.453","0.002","9.1137","0.0016","13.473","0.002","90","","97.062","0.005","90","","1273.8","0.4","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H31 N3 Ni O3 -","- C29 H31 N3 Ni O3 -","- C58 H62 N6 Ni2 O6 -","2","1","","Vadim A. Soloshonok; Trevor K. Ellis; Hisanori Ueki; Taizo Ono","Resolution/Deracemization of Chiral α-Amino Acids Using Resolving Reagents with Flexible Stereogenic Centers","Journal of the American Chemical Society","2009","131","","7208","7209","10.1021/ja9026055","","","0.71073","MoKα","","0.0283","0.0273","","","0.0675","0.0681","","","","","","1.026","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104455","11.4816","0.0007","20.3721","0.0013","12.4196","0.0008","90","","115.692","0.001","90","","2617.8","0.3","193","2","193","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C60 H58 F3 Ir N O5 P S -","- C60 H58 F3 Ir N O5 P S -","- C120 H116 F6 Ir2 N2 O10 P2 S2 -","2","1","","Sherzod T. Madrahimov; Dean Markovic; John F. Hartwig","The Allyl Intermediate in Regioselective and Enantioselective Iridium-Catalyzed Asymmetric Allylic Substitution Reactions","Journal of the American Chemical Society","2009","131","","7228","7229","10.1021/ja902609g","","","0.71073","MoKα","","0.0224","0.0197","","","0.0468","0.0479","","","","","","1.029","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104456","11.84","0.005","20.679","0.009","12.619","0.006","90","","117.75","0.006","90","","2734","2","193","2","193","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C60 H60 F6 Ir N O2 P Sb -","- C60 H60 F6 Ir N O2 P Sb -","- C120 H120 F12 Ir2 N2 O4 P2 Sb2 -","2","1","","Sherzod T. Madrahimov; Dean Markovic; John F. Hartwig","The Allyl Intermediate in Regioselective and Enantioselective Iridium-Catalyzed Asymmetric Allylic Substitution Reactions","Journal of the American Chemical Society","2009","131","","7228","7229","10.1021/ja902609g","","","0.71073","MoKα","","0.0766","0.0492","","","0.1158","0.1208","","","","","","0.906","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104457","8.8617","0.0005","20.047","0.0008","9.7565","0.0004","90","","112.839","0.006","90","","1597.36","0.15","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","HLSi(OH)-Ni(CO)3","","","- C32 H42 N2 Ni O4 Si -","- C32 H42 N2 Ni O4 Si -","- C64 H84 N4 Ni2 O8 Si2 -","2","0.5","","Antje Meltzer; Carsten Präsang; Matthias Driess","Diketiminate Silicon(II) and Related NHSi Ligands Generated in the Coordination Sphere of Nickel(0)","Journal of the American Chemical Society","2009","131","","7232","7233","10.1021/ja9026727","","","0.71073","MoKα","","0.0803","0.0425","","","0.0895","0.0971","","","","","","0.899","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104458","10.8132","0.0003","11.6057","0.0003","17.4222","0.0005","105.188","0.003","98.328","0.002","107.146","0.003","1956.91","0.11","173","2","173","2","","","","","","","","8","P -1","-P 1","2","HLSi(OTf)-Ni(CO)3*1/2hexane","","","- C36 H48 F3 N2 Ni O6 S Si -","- C36 H48 F3 N2 Ni O6 S Si -","- C72 H96 F6 N4 Ni2 O12 S2 Si2 -","2","1","","Antje Meltzer; Carsten Präsang; Matthias Driess","Diketiminate Silicon(II) and Related NHSi Ligands Generated in the Coordination Sphere of Nickel(0)","Journal of the American Chemical Society","2009","131","","7232","7233","10.1021/ja9026727","","","0.71073","MoKα","","0.0523","0.0364","","","0.0791","0.0836","","","","","","1.016","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104459","14.6855","0.0003","20.2466","0.0007","20.5691","0.0007","64.292","0.003","71.71","0.003","87.14","0.002","5205.4","0.3","150","2","150","2","","","","","","","","8","P -1","-P 1","2","(C6F5)3B-LSi=Ni(CO)3 * 1/2 toluene","","","- C107 H88 B2 F30 N4 Ni2 O6 Si2 -","- C107 H88 B2 F30 N4 Ni2 O6 Si2 -","- C214 H176 B4 F60 N8 Ni4 O12 Si4 -","2","1","","Antje Meltzer; Carsten Präsang; Matthias Driess","Diketiminate Silicon(II) and Related NHSi Ligands Generated in the Coordination Sphere of Nickel(0)","Journal of the American Chemical Society","2009","131","","7232","7233","10.1021/ja9026727","","","0.71073","MoKα","","0.1135","0.0603","","","0.1148","0.1271","","","","","","1.073","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104460","14.182","0.004","20.088","0.006","28.868","0.009","90","","96.456","0.006","90","","8172","4","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C78 H88 N4 O20 Rh2 -","- C60 H64 N4 O18 Rh2 -","- C240 H256 N16 O72 Rh8 -","4","2","","Andrew DeAngelis; Olga Dmitrenko; Glenn P. A. Yap; Joseph M. Fox","Chiral Crown Conformation of Rh2(S-PTTL)4: Enantioselective Cyclopropanation with α-Alkyl-α-diazoesters","Journal of the American Chemical Society","2009","131","","7230","7231","10.1021/ja9026852","","","0.71073","MoKα","","0.1229","0.0718","","","0.1053","0.1173","","","","","","1.02","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104461","11.961","0.004","5.5326","0.0019","15.785","0.005","90","","109.747","0.005","90","","983.2","0.6","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H25 N O3 -","- C23 H25 N O3 -","- C46 H50 N2 O6 -","2","1","","Andrew DeAngelis; Olga Dmitrenko; Glenn P. A. Yap; Joseph M. Fox","Chiral Crown Conformation of Rh2(S-PTTL)4: Enantioselective Cyclopropanation with α-Alkyl-α-diazoesters","Journal of the American Chemical Society","2009","131","","7230","7231","10.1021/ja9026852","","","0.71073","MoKα","","0.043","0.0374","","","0.1015","0.1123","","","","","","1.048","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104462","8.25","0.0009","9.685","0.0009","21.036","0.0013","96.373","0.005","98.346","0.006","101.48","0.003","1612.7","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H37 I N4 Pt2 Si -","- C29 H37 I N4 Pt2 Si -","- C58 H74 I2 N8 Pt4 Si2 -","2","1","","Allan J. Canty; Michael G. Gardiner; Roderick C. Jones; Thomas Rodemann; Manab Sharma","Binuclear Intermediates in Oxidation Reactions: [(Me3SiC\τbC)Me2(bipy)Pt-PtMe2(bipy)]+ in the Oxidation of PtIIMe2(bipy) (bipy = 2,2'-Bipyridine) by IPh(C\τbCSiMe3)(OTf) (OTf = Triflate)","Journal of the American Chemical Society","2009","131","","7236","7237","10.1021/ja902799u","","","0.77487","Synchrotron","","0.0301","0.0296","","","0.0787","0.0791","","","","","","1.065","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104463","9.193","0.007","25.117","0.019","16.256","0.013","90","0.004","94.053","0.004","90","0.004","3744","5","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H39 N O2 P2 Ru -","- C45 H39 N O2 P2 Ru -","- C180 H156 N4 O8 P8 Ru4 -","4","1","","Tetsuro Koreeda; Takuya Kochi; Fumitoshi Kakiuchi","Cleavage of C-N Bonds in Aniline Derivatives on a Ruthenium Center and Its Relevance to Catalytic C-C Bond Formation","Journal of the American Chemical Society","2009","131","","7238","7239","10.1021/ja902829p","","","0.7107","MoKα","","0.0349","0.0306","","","0.069","0.0715","","","","","","1.13","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104464","10.564","0.004","19.327","0.007","18.127","0.007","90","0.0014","104.733","0.0016","90","0.0014","3579","2","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H42 N O3 P Ru -","- C41 H42 N O3 P Ru -","- C164 H168 N4 O12 P4 Ru4 -","4","1","","Tetsuro Koreeda; Takuya Kochi; Fumitoshi Kakiuchi","Cleavage of C-N Bonds in Aniline Derivatives on a Ruthenium Center and Its Relevance to Catalytic C-C Bond Formation","Journal of the American Chemical Society","2009","131","","7238","7239","10.1021/ja902829p","","","0.7107","MoKα","","0.0427","0.0393","","","0.0949","0.0977","","","","","","1.098","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104465","10.724","0.003","18.588","0.006","18.785","0.006","90","","102.085","0.003","90","","3662","2","93.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H44 N O3 P Ru -","- C42 H44 N O3 P Ru -","- C168 H176 N4 O12 P4 Ru4 -","4","1","","Tetsuro Koreeda; Takuya Kochi; Fumitoshi Kakiuchi","Cleavage of C-N Bonds in Aniline Derivatives on a Ruthenium Center and Its Relevance to Catalytic C-C Bond Formation","Journal of the American Chemical Society","2009","131","","7238","7239","10.1021/ja902829p","","","0.71075","MoKα","","","0.0364","","","","0.0917","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104466","14.19","0.03","14.83","0.03","17.49","0.04","71.79","0.07","88.1","0.09","67.33","0.09","3210","12","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H29 F29 N6 O -","- C72 H29 F29 N6 O -","- C144 H58 F58 N12 O2 -","2","1","","Sumito Tokuji; Jae-Yoon Shin; Kil Suk Kim; Jong Min Lim; Katsuyuki Youfu; Shohei Saito; Dongho Kim; Atsuhiro Osuka","Facile Formation of a Benzopyrane-Fused [28]Hexaphyrin That Exhibits Distinct Möbius Aromaticity","Journal of the American Chemical Society","2009","131","","7240","7241","10.1021/ja902836x","","","0.71075","MoKα","","0.1401","0.1057","","","0.2693","0.3035","","","","","","1.029","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104467","7.4202","0.0008","10.7636","0.0011","19.946","0.002","90","","90","","90","","1593","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H25 B O4 -","- C16 H25 B O4 -","- C64 H100 B4 O16 -","4","1","","Kang-sang Lee; Adil R. Zhugralin; Amir H. Hoveyda","Efficient C-B Bond Formation Promoted by N-Heterocyclic Carbenes: Synthesis of Tertiary and Quaternary B-Substituted Carbons through Metal-Free Catalytic Boron Conjugate Additions to Cyclic and Acyclic α,β-Unsaturated Carbonyls","Journal of the American Chemical Society","2009","131","","7253","7255","10.1021/ja902889s","","","0.71073","MoKα","","0.0406","0.0377","","","0.0938","0.096","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104468","5.9436","0.0008","16.888","0.002","17.475","0.002","90","","93.841","0.002","90","","1750.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H27 B O4 -","- C19 H27 B O4 -","- C76 H108 B4 O16 -","4","1","","Kang-sang Lee; Adil R. Zhugralin; Amir H. Hoveyda","Efficient C-B Bond Formation Promoted by N-Heterocyclic Carbenes: Synthesis of Tertiary and Quaternary B-Substituted Carbons through Metal-Free Catalytic Boron Conjugate Additions to Cyclic and Acyclic α,β-Unsaturated Carbonyls","Journal of the American Chemical Society","2009","131","","7253","7255","10.1021/ja902889s","","","0.71073","MoKα","","0.0468","0.0417","","","0.106","0.1104","","","","","","1.041","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104469","12.509","0.003","32.442","0.007","9.963","0.002","90","","108.603","0.003","90","","3831.9","1.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 B Br O4 -","- C19 H26 B Br O4 -","- C152 H208 B8 Br8 O32 -","8","2","","Kang-sang Lee; Adil R. Zhugralin; Amir H. Hoveyda","Efficient C-B Bond Formation Promoted by N-Heterocyclic Carbenes: Synthesis of Tertiary and Quaternary B-Substituted Carbons through Metal-Free Catalytic Boron Conjugate Additions to Cyclic and Acyclic α,β-Unsaturated Carbonyls","Journal of the American Chemical Society","2009","131","","7253","7255","10.1021/ja902889s","","","0.71073","MoKα","","0.0432","0.0323","","","0.073","0.0777","","","","","","1.033","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104470","12.399","0.002","32.215","0.005","9.9188","0.0017","90","","109.176","0.002","90","","3742.1","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 B Cl O4 -","- C19 H26 B Cl O4 -","- C152 H208 B8 Cl8 O32 -","8","2","","Kang-sang Lee; Adil R. Zhugralin; Amir H. Hoveyda","Efficient C-B Bond Formation Promoted by N-Heterocyclic Carbenes: Synthesis of Tertiary and Quaternary B-Substituted Carbons through Metal-Free Catalytic Boron Conjugate Additions to Cyclic and Acyclic α,β-Unsaturated Carbonyls","Journal of the American Chemical Society","2009","131","","7253","7255","10.1021/ja902889s","","","0.71073","MoKα","","0.0741","0.0481","","","0.0957","0.1048","","","","","","1.046","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104471","11.322","0.002","19.295","0.003","11.91","0.002","90","","111.634","0.004","90","","2418.6","0.7","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C58 H54 Cl N4 O3 P -","- C58 H54 Cl N4 O3 P -","- C116 H108 Cl2 N8 O6 P2 -","2","1","","Daisuke Uraguchi; Daisuke Nakashima; Takashi Ooi","Chiral Arylaminophosphonium Barfates as a New Class of Charged Brønsted Acid for the Enantioselective Activation of Nonionic Lewis Bases","Journal of the American Chemical Society","2009","131","","7242","7243","10.1021/ja903271t","","","0.71073","MoKα","","0.0482","0.0443","","","0.1118","0.1151","","","","","","1.038","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104472","10.383","0.003","21.787","0.006","25.368","0.006","90","","90","","90","","5739","3","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C66 H66 Cl N4 O4 P -","- C66 H66 Cl N4 O4 P -","- C264 H264 Cl4 N16 O16 P4 -","4","1","","Daisuke Uraguchi; Daisuke Nakashima; Takashi Ooi","Chiral Arylaminophosphonium Barfates as a New Class of Charged Brønsted Acid for the Enantioselective Activation of Nonionic Lewis Bases","Journal of the American Chemical Society","2009","131","","7242","7243","10.1021/ja903271t","","","0.71073","MoKα","","0.0911","0.0602","","","0.1362","0.1524","","","","","","1.023","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104473","27.1026","0.0003","27.1026","0.0003","12.2397","0.0004","90","","90","","90","","8990.7","0.3","20","2","20","2","","","","","","","","5","I -4","I -4","82","","","","- C55.96 H47.56 Cl8.28 Co4 N16 -","- C55.9607 H47.5573 Cl8.28533 Co4 N16 -","- C335.764 H285.344 Cl49.712 Co24 N96 -","6","0.75","","Rasmus D. Poulsen; Jacob Overgaard; Alexander Schulman; Christina Østergaard; Carlos A. Murillo; Mark A. Spackman; Bo B. Iversen","Effects of Weak Intermolecular Interactions on the Molecular Isomerism of Tricobalt Metal Chains","Journal of the American Chemical Society","2009","131","","7580","7591","10.1021/ja8091032","","","0.643","","","0.0678","0.0524","","","0.1337","0.1401","","","","","","1.043","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104474","27.2473","0.0003","27.2473","0.0003","12.257","0.0003","90","","90","","90","","9099.8","0.3","150","2","150","2","","","","","","","","5","I -4","I -4","82","","","","- C56.1 H47.49 Cl8.19 Co4 N16 -","- C56.0853 H47.4667 Cl8.17067 Co4 N16 -","- C336.512 H284.8 Cl49.024 Co24 N96 -","6","0.75","","Rasmus D. Poulsen; Jacob Overgaard; Alexander Schulman; Christina Østergaard; Carlos A. Murillo; Mark A. Spackman; Bo B. Iversen","Effects of Weak Intermolecular Interactions on the Molecular Isomerism of Tricobalt Metal Chains","Journal of the American Chemical Society","2009","131","","7580","7591","10.1021/ja8091032","","","0.643","","","0.0767","0.0578","","","0.1439","0.1522","","","","","","1.079","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104475","27.483","0.012","27.483","0.012","12.376","0.007","90","","90","","90","","9348","8","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C42.25 H35.75 Cl6.5 Co3 N12 -","- C42.1685 H35.684 Cl6.337 Co3 N12 -","- C337.348 H285.472 Cl50.696 Co24 N96 -","8","1","","Rasmus D. Poulsen; Jacob Overgaard; Alexander Schulman; Christina Østergaard; Carlos A. Murillo; Mark A. Spackman; Bo B. Iversen","Effects of Weak Intermolecular Interactions on the Molecular Isomerism of Tricobalt Metal Chains","Journal of the American Chemical Society","2009","131","","7580","7591","10.1021/ja8091032","","","0.643","","","0.092","0.0637","","","0.1666","0.1854","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104476","27.132","0.003","27.132","0.003","12.201","0.002","90","","90","","90","","8982","2","100","1","","","","","","","","","","5","I -4","I -4","82","","","","- C42.11 H35.7 Cl6.21 Co3 N12 -","- C42.1055 H35.702 Cl6.2109 Co3 N12 -","- C336.844 H285.616 Cl49.6872 Co24 N96 -","8","1","","Rasmus D. Poulsen; Jacob Overgaard; Alexander Schulman; Christina Østergaard; Carlos A. Murillo; Mark A. Spackman; Bo B. Iversen","Effects of Weak Intermolecular Interactions on the Molecular Isomerism of Tricobalt Metal Chains","Journal of the American Chemical Society","2009","131","","7580","7591","10.1021/ja8091032","","","0.71073","MoKα","","0.043","0.031","","","","0.055","","","","","","1.316","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104477","28.692","0.007","13.346","0.004","21.297","0.006","90","","93.17","0.009","90","","8143","4","298.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C46 H46 Zr -","- C46 H37 Zr -","- C368 H296 Zr8 -","8","1","","Shenyong Ren; Eri Igarashi; Kiyohiko Nakajima; Ken-ichiro Kanno; Tamotsu Takahashi","Coupling of the R-Cp or Indenyl Ligand with the Diene Moiety of Bis(substituted cyclopentadienyl)- or Bis(indenyl)zirconacyclopentadienes","Journal of the American Chemical Society","2009","131","","7492","7493","10.1021/ja809401s","","","0.71075","MoKα","","","0.0742","","","","0.2623","","","","","","0.978","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104478","16.843","0.004","12.551","0.004","18.114","0.007","90","","97.89","0.05","90","","3793","2","298.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C50 H42 Zr -","- C50 H42 Zr -","- C200 H168 Zr4 -","4","1","","Shenyong Ren; Eri Igarashi; Kiyohiko Nakajima; Ken-ichiro Kanno; Tamotsu Takahashi","Coupling of the R-Cp or Indenyl Ligand with the Diene Moiety of Bis(substituted cyclopentadienyl)- or Bis(indenyl)zirconacyclopentadienes","Journal of the American Chemical Society","2009","131","","7492","7493","10.1021/ja809401s","","","0.7107","MoKα","","","0.0493","","","","0.0596","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104479","16.692","0.0006","15.0251","0.0006","17.9256","0.0006","90","","90","","90","","4495.7","0.3","298.1","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C27 H28 N4 -","- C27 H28 N4 -","- C216 H224 N32 -","8","1","","Shenyong Ren; Eri Igarashi; Kiyohiko Nakajima; Ken-ichiro Kanno; Tamotsu Takahashi","Coupling of the R-Cp or Indenyl Ligand with the Diene Moiety of Bis(substituted cyclopentadienyl)- or Bis(indenyl)zirconacyclopentadienes","Journal of the American Chemical Society","2009","131","","7492","7493","10.1021/ja809401s","","","0.71075","MoKα","","","0.0714","","","","0.0682","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104480","11.7432","0.0002","11.5531","0.0004","22.8714","0.0009","90","","90","","90","","3102.97","0.17","150","1","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C8 H24 Br N P2 Si -","- C8 H24 Br N P2 Si -","- C64 H192 Br8 N8 P16 Si8 -","8","1","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.0704","0.0395","","","0.0859","0.0983","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104481","14.0798","0.0007","17.0889","0.0008","18.0705","0.0006","118.17","0.002","104.297","0.003","90.164","0.002","3677.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H30 Br N P2 Si -","- C11 H29.75 Br N P2 Si -","- C88 H238 Br8 N8 P16 Si8 -","8","4","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.1966","0.1478","","","0.4397","0.4493","","","","","","2.564","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104482","12.4326","0.0002","28.4196","0.0007","36.7682","0.0009","90","","90","","90","","12991.3","0.5","150","1","150","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C12 H30 F3 N O3 P2 S Si -","- C12 H30 F3 N O3 P2 S Si -","- C288 H720 F72 N24 O72 P48 S24 Si24 -","24","3","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.1022","0.053","","","0.1115","0.1303","","","","","","1.014","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104483","14.9772","0.0008","10.9378","0.0004","11.6076","0.0011","90","","102.029","0.002","90","","1859.8","0.2","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H29 Br N P3 Si -","- C10 H29 Br N P3 Si -","- C40 H116 Br4 N4 P12 Si4 -","4","1","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.0883","0.0653","","","0.1775","0.1962","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104484","16.0802","0.0005","9.2065","0.0003","15.4421","0.0003","90","","111.208","0.002","90","","2131.26","0.11","150","1","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C10 H22 Br F6 N O2 P2 Si -","- C10 H22 Br F6 N O2 P2 Si -","- C40 H88 Br4 F24 N4 O8 P8 Si4 -","4","1","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.0777","0.0436","","","0.1037","0.1284","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104485","17.6985","0.0016","7.5122","0.0004","17.6621","0.0015","90","","93.383","0.003","90","","2344.2","0.3","150","1","150","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C13 H28 Br F6 N O2 P2 Si -","- C13 H28 Br F6 N O2 P2 Si -","- C52 H112 Br4 F24 N4 O8 P8 Si4 -","4","1","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.1446","0.055","","","0.1068","0.1365","","","","","","0.944","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104486","15.7111","0.0008","15.7111","0.0008","6.4101","0.0004","90","","90","","90","","1582.26","0.15","150","1","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C8 H24 N4 P4 -","- C8 H24 N4 P4 -","- C32 H96 N16 P16 -","4","0.25","","Keith Huynh; Alan J. Lough; Michelle A. M. Forgeron; Martin Bendle; Alejandro Presa Soto; Roderick E. Wasylishen; Ian Manners","Synthesis and Reactivity of Phosphine-Stabilized Phosphoranimine Cations, [R3P.PR'2=NSiMe3]+","Journal of the American Chemical Society","2009","131","","7905","7916","10.1021/ja900256g","","","0.71073","MoKα","","0.0494","0.0354","","","0.08","0.0875","","","","","","1.07","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104487","8.94","0.005","20.345","0.011","9.707","0.005","90","","107.521","0.009","90","","1683.6","1.6","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 N O -","- C22 H17 N O -","- C88 H68 N4 O4 -","4","1","","Yasufumi Yoshino; Takuya Kurahashi; Seijiro Matsubara","Nickel-Catalyzed Decarboxylative Carboamination of Alkynes with Isatoic Anhydrides","Journal of the American Chemical Society","2009","131","","7494","7495","10.1021/ja900805y","","","0.71073","MoKα","","0.058","0.0498","","","0.1402","0.1478","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104488","15.276","0.002","9.5922","0.0013","24.512","0.003","90","","101.123","0.002","90","","3524.3","0.8","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H23 N O -","- C21 H23 N O -","- C168 H184 N8 O8 -","8","1","","Yasufumi Yoshino; Takuya Kurahashi; Seijiro Matsubara","Nickel-Catalyzed Decarboxylative Carboamination of Alkynes with Isatoic Anhydrides","Journal of the American Chemical Society","2009","131","","7494","7495","10.1021/ja900805y","","","0.71073","MoKα","","0.106","0.0785","","","0.222","0.2525","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104489","13.78","0.002","10.9493","0.0019","11.0724","0.0019","90","","102.445","0.003","90","","1631.4","0.5","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N O -","- C20 H21 N O -","- C80 H84 N4 O4 -","4","1","","Yasufumi Yoshino; Takuya Kurahashi; Seijiro Matsubara","Nickel-Catalyzed Decarboxylative Carboamination of Alkynes with Isatoic Anhydrides","Journal of the American Chemical Society","2009","131","","7494","7495","10.1021/ja900805y","","","0.71073","MoKα","","0.0701","0.055","","","0.1651","0.1807","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104490","14.3502","0.0015","10.924","0.0012","11.3158","0.0012","90","","102.966","0.002","90","","1728.7","0.3","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 N O Si -","- C19 H21 N O Si -","- C76 H84 N4 O4 Si4 -","4","1","","Yasufumi Yoshino; Takuya Kurahashi; Seijiro Matsubara","Nickel-Catalyzed Decarboxylative Carboamination of Alkynes with Isatoic Anhydrides","Journal of the American Chemical Society","2009","131","","7494","7495","10.1021/ja900805y","","","0.71073","MoKα","","0.0546","0.0499","","","0.1455","0.1506","","","","","","1.038","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104491","10.103","0.009","17.836","0.017","12.044","0.012","90","","109.874","0.017","90","","2041","3","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 N O Si -","- C24 H23 N O Si -","- C96 H92 N4 O4 Si4 -","4","1","","Yasufumi Yoshino; Takuya Kurahashi; Seijiro Matsubara","Nickel-Catalyzed Decarboxylative Carboamination of Alkynes with Isatoic Anhydrides","Journal of the American Chemical Society","2009","131","","7494","7495","10.1021/ja900805y","","","0.71073","MoKα","","0.0669","0.0524","","","0.141","0.1537","","","","","","1.026","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104492","10.852","0.002","9.8548","0.0019","18.477","0.004","90","","104.764","0.003","90","","1910.8","0.7","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 N O Si -","- C21 H23 N O Si -","- C84 H92 N4 O4 Si4 -","4","1","","Yasufumi Yoshino; Takuya Kurahashi; Seijiro Matsubara","Nickel-Catalyzed Decarboxylative Carboamination of Alkynes with Isatoic Anhydrides","Journal of the American Chemical Society","2009","131","","7494","7495","10.1021/ja900805y","","","0.71073","MoKα","","0.0659","0.0574","","","0.173","0.1836","","","","","","1.019","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104493","8.231","0.0005","8.231","0.0005","22.399","0.003","90","","90","","120","","1314.2","0.2","173","2","173","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","catena-(Me2NH2)[Fe(HCOO)3]","catena-(dimethylammonium)-(tris(μ~2~-Formato-O,O')-iron(ii)","","- C5 H15 Fe N O6 -","- C5 H10.98 Fe N0.99 O6 -","- C30 H65.88 Fe6 N5.94 O36 -","6","0.166667","","Karl S. Hagen; Sunil G. Naik; Boi Hanh Huynh; Antonio Masello; George Christou","Intensely Colored Mixed-Valence Iron(II) Iron(III) Formate Analogue of Prussian Blue Exhibits Néel N-Type Ferrimagnetism","Journal of the American Chemical Society","2009","131","","7516","7517","10.1021/ja901093b","","x-ray","0.71073","MoKα","","0.0206","0.0199","","","0.0531","0.0535","","","","","","1.119","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104494","8.2512","0.0011","8.2512","0.0011","13.846","0.003","90","","90","","120","","816.4","0.2","173","2","173","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","catena-(Me2NH2)[Fe2(HCOO)6]","catena-(Dimethylammonium bis(μ~2~-formato-O,O')-iron(ii)-iron(iii)","","- C8 H18 Fe2 N O12 -","- C8 H13.98 Fe2 N0.99 O12 -","- C16 H27.96 Fe4 N1.98 O24 -","2","0.166667","","Karl S. Hagen; Sunil G. Naik; Boi Hanh Huynh; Antonio Masello; George Christou","Intensely Colored Mixed-Valence Iron(II) Iron(III) Formate Analogue of Prussian Blue Exhibits Néel N-Type Ferrimagnetism","Journal of the American Chemical Society","2009","131","","7516","7517","10.1021/ja901093b","","x-ray","0.71073","MoKα","","0.0305","0.0279","","","0.0747","0.0765","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104495","18.645","0.002","18.645","0.002","19.061","0.002","90","","90","","120","","5738.5","1.1","110","","110","","","","","","","","synthesis as described","5","R -3 :H","-R 3","148","","","","- C27 H52 N6 Ru Si6 -","- C27 H52 N6 Ru Si6 -","- C162 H312 N36 Ru6 Si36 -","6","0.333333","","Mary Grellier; Tahra Ayed; Jean-Claude Barthelat; Alberto Albinati; Sax Mason; Laure Vendier; Yannick Coppel; Sylviane Sabo-Etienne","Versatile Coordination of 2-Pyridinetetramethyldisilazane at Ruthenium: Ru(II) vs Ru(IV) As Evidenced by NMR, X-ray, Neutron, and DFT Studies","Journal of the American Chemical Society","2009","131","","7633","7640","10.1021/ja901140v","","","0.71073","MoKα","","0.0731","0.0361","","","0.0566","0.0632","","","","","","0.894","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104496","18.588","0.0003","18.588","0.0003","18.8361","0.0003","90","","90","","120","","5636.21","0.16","20","2","20","2","","","","","","","","5","R -3 :H","-R 3","148","Ru(H)[(SiMe2)(N-[(C5H4N)(SiMe2H)]3(PCy3)2","","","- C27 H52 N6 Ru Si6 -","- C27 H52 N6 Ru Si6 -","- C162 H312 N36 Ru6 Si36 -","6","0.333333","","Mary Grellier; Tahra Ayed; Jean-Claude Barthelat; Alberto Albinati; Sax Mason; Laure Vendier; Yannick Coppel; Sylviane Sabo-Etienne","Versatile Coordination of 2-Pyridinetetramethyldisilazane at Ruthenium: Ru(II) vs Ru(IV) As Evidenced by NMR, X-ray, Neutron, and DFT Studies","Journal of the American Chemical Society","2009","131","","7633","7640","10.1021/ja901140v","","neutron","1.16954","neutron","","0.108","0.0698","","","0.1306","0.1483","","","","","","1.119","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104497","9.831","0.002","21.651","0.004","11.917","0.002","90","","109.44","0.03","90","","2391.9","0.9","160","2","160","2","","","","","","","synthesis as described","6","P 1 21/m 1","-P 2yb","11","","","","- C45 H86 N2 P2 Ru Si2 -","- C45 H86 N2 P2 Ru Si2 -","- C90 H172 N4 P4 Ru2 Si4 -","2","0.5","","Mary Grellier; Tahra Ayed; Jean-Claude Barthelat; Alberto Albinati; Sax Mason; Laure Vendier; Yannick Coppel; Sylviane Sabo-Etienne","Versatile Coordination of 2-Pyridinetetramethyldisilazane at Ruthenium: Ru(II) vs Ru(IV) As Evidenced by NMR, X-ray, Neutron, and DFT Studies","Journal of the American Chemical Society","2009","131","","7633","7640","10.1021/ja901140v","","","0.71073","MoKα","","0.0466","0.0403","","","0.0912","0.0953","","","","","","1.101","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4104498","43.193","0.003","11.8637","0.0009","20.2109","0.0015","90","","108.446","0.001","90","","9824.5","1.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C57 H66 N2 O3 W -","- C57 H65.9994 N2 O3 W -","- C456 H527.995 N16 O24 W8 -","8","1","","Annie J. Jiang; Jeffrey H. Simpson; Peter Müller; Richard R. Schrock","Fundamental Studies of Tungsten Alkylidene Imido Monoalkoxidepyrrolide Complexes","Journal of the American Chemical Society","2009","131","","7770","7780","10.1021/ja9012694","","","0.71073","MoKα","","0.039","0.0303","","","0.0667","0.07","","","","","","1.189","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104499","11.3574","0.0008","14.0541","0.001","14.9825","0.0011","81.242","0.001","81.323","0.001","80.748","0.001","2313.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H58 N2 O W -","- C57 H58 N2 O W -","- C114 H116 N4 O2 W2 -","2","1","","Annie J. Jiang; Jeffrey H. Simpson; Peter Müller; Richard R. Schrock","Fundamental Studies of Tungsten Alkylidene Imido Monoalkoxidepyrrolide Complexes","Journal of the American Chemical Society","2009","131","","7770","7780","10.1021/ja9012694","","","0.71073","MoKα","","0.0258","0.0228","","","0.0593","0.0612","","","","","","1.092","","","","has coordinates,has disorder","178790","2020-10-21","18:00:00",""
"4104500","11.0794","0.0007","12.0146","0.0008","17.5559","0.0011","93.976","0.001","99.307","0.001","103.313","0.001","2230.3","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H57 N2 O P W -","- C52 H57 N2 O P W -","- C104 H114 N4 O2 P2 W2 -","2","1","","Annie J. Jiang; Jeffrey H. Simpson; Peter Müller; Richard R. Schrock","Fundamental Studies of Tungsten Alkylidene Imido Monoalkoxidepyrrolide Complexes","Journal of the American Chemical Society","2009","131","","7770","7780","10.1021/ja9012694","","","0.71073","MoKα","","0.0265","0.0231","","","0.0537","0.0555","","","","","","1.071","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104501","10.45","0.0003","33.847","0.001","12.9622","0.0004","90","","97.02","0.002","90","","4550.4","0.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C47 H64 Br2 N2 O2 Si W -","- C47 H64 Br2 N2 O2 Si W -","- C188 H256 Br8 N8 O8 Si4 W4 -","4","2","","Annie J. Jiang; Jeffrey H. Simpson; Peter Müller; Richard R. Schrock","Fundamental Studies of Tungsten Alkylidene Imido Monoalkoxidepyrrolide Complexes","Journal of the American Chemical Society","2009","131","","7770","7780","10.1021/ja9012694","","","1.54178","CuKα","","0.0261","0.0255","","","0.0615","0.0618","","","","","","1.032","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104502","19.164","0.002","8.0863","0.0011","18.0847","0.0012","90","","98.937","0.008","90","","2768.5","0.5","250","2","250","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 O4 P Ru -","- C30 H31 O4 P Ru -","- C120 H124 O16 P4 Ru4 -","4","1","","Rémi Martinez; Marc-Olivier Simon; Reynald Chevalier; Cyrielle Pautigny; Jean-Pierre Genet; Sylvain Darses","C-C Bond Formation via C-H Bond Activation Using an in Situ-Generated Ruthenium Catalyst","Journal of the American Chemical Society","2009","131","","7887","7895","10.1021/ja9017489","","","0.71073","MoKα","","0.0885","0.0365","","","0.0715","0.0854","","","","","","0.996","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104503","9.9136","0.0007","15.4103","0.0012","16.3476","0.0012","90","","90","","90","","2497.4","0.3","243","2","243","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Phenazine)Mo(PMe3)3","","","- C21 H35 Mo N2 P3 -","- C21 H35 Mo N2 P3 -","- C84 H140 Mo4 N8 P12 -","4","1","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0195","0.0183","","","0.0482","0.0488","","","","","","1.031","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104504","14.5169","0.001","9.0962","0.0006","16.3795","0.0011","90","","115.463","0.001","90","","1952.8","0.2","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H62 Mo2 N2 P6 -","- C30 H62 Mo2 N2 P6 -","- C60 H124 Mo4 N4 P12 -","2","0.5","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.1025","0.0465","","","0.072","0.0858","","","","","","1.002","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104505","18.174","0.0016","9.4426","0.0008","26.621","0.002","90","","97.48","0.001","90","","4529.5","0.6","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H88 Mo2 N2 P6 -","- C30 H64 Mo2 N2 P6 -","- C120 H256 Mo8 N8 P24 -","4","1","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0588","0.0374","","","0.0801","0.0852","","","","","","1.03","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104506","9.7998","0.0005","17.8776","0.0009","16.1462","0.0009","90","","100.422","0.001","90","","2782.1","0.3","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24.5 H44 Mo N P3 -","- C22 H38 Mo N P3 -","- C88 H152 Mo4 N4 P12 -","4","1","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0424","0.0348","","","0.0804","0.0829","","","","","","1.066","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104507","10.1768","0.0007","14.814","0.001","16.9546","0.0011","90","","103.315","0.001","90","","2487.4","0.3","125","2","125","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H39 Mo P3 -","- C23 H39 Mo P3 -","- C92 H156 Mo4 P12 -","4","1","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0652","0.0367","","","0.0706","0.0791","","","","","","1.002","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104508","13.4843","0.0009","14.0854","0.001","15.9116","0.0011","76.577","0.001","70.985","0.001","79.895","0.001","2762.7","0.3","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H34 Mo N4 P2 -","- C30 H34 Mo N4 P2 -","- C120 H136 Mo4 N16 P8 -","4","2","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0668","0.0378","","","0.0879","0.1007","","","","","","1.005","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104509","9.2889","0.0005","11.5097","0.0006","23.4023","0.0013","90","","101.214","0.001","90","","2454.2","0.2","125","2","125","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H37 Mo N2 P3 -","- C21 H37 Mo N2 P3 -","- C84 H148 Mo4 N8 P12 -","4","1","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0406","0.031","","","0.0622","0.0665","","","","","","1.064","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104510","13.4943","0.0011","13.9119","0.0011","23.1706","0.0019","90","","97.263","0.001","90","","4314.9","0.6","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H35 Mo N2 P3 -","- C17 H35 Mo N2 P3 -","- C136 H280 Mo8 N16 P24 -","8","2","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0306","0.0251","","","0.0633","0.0669","","","","","","1.044","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104511","12.5971","0.0007","5.4794","0.0003","12.694","0.0007","90","","96.503","0.001","90","","870.56","0.08","125","2","125","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 N2 -","- C26 H20 N2 -","- C52 H40 N4 -","2","0.5","","Sattler, Aaron; Zhu, Guang; Parkin, Gerard","Multiple Modes for Coordination of Phenazine to Molybdenum: Ring Fusion Promotes Access to η4-Coordination, Oxidative Addition of Dihydrogen and Hydrogenation of Aromatic Nitrogen Compounds","Journal of the American Chemical Society","2009","131","22","7828","7838","10.1021/ja901896x","","","0.71073","MoKα","","0.0575","0.0434","","","0.1137","0.1248","","","","","","1.026","","","","has coordinates","219209","2020-10-21","18:00:00",""
"4104512","6.6527","0.0007","10.892","0.0011","11.9177","0.0019","107.8","0.007","95.428","0.007","107.102","0.005","769.56","0.17","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H8 Cl O5 P W -","- C11 H8 Cl O5 P W -","- C22 H16 Cl2 O10 P2 W2 -","2","1","","Matthew P. Duffy; François Mathey","Generation and Trapping of a Terminal Chlorophosphinidene Complex","Journal of the American Chemical Society","2009","131","","7534","7535","10.1021/ja901918e","","","0.71073","MoKα","","0.021","0.0167","","","0.0394","0.0428","","","","","","1.062","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104513","6.4957","0.0002","15.7482","0.0005","14.0945","0.0004","90","","98.028","0.001","90","","1427.68","0.08","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 Cl O5 P W -","- C11 H10 Cl O5 P W -","- C44 H40 Cl4 O20 P4 W4 -","4","1","","Matthew P. Duffy; François Mathey","Generation and Trapping of a Terminal Chlorophosphinidene Complex","Journal of the American Chemical Society","2009","131","","7534","7535","10.1021/ja901918e","","","0.71073","MoKα","","0.0224","0.018","","","0.0565","0.0803","","","","","","1.355","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104514","7.0477","0.0009","9.0172","0.0012","17.499","0.002","103.527","0.002","94.33","0.002","95.501","0.002","1070.7","0.2","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H26 N4 O5 -","- C22 H26 N4 O5 -","- C44 H52 N8 O10 -","2","1","","David J. Hardee; Tristan H. Lambert","Lanthanum(III) Triflate-Catalyzed Cyclopropanation via Intramolecular Methylene Transfer","Journal of the American Chemical Society","2009","131","","7536","7537","10.1021/ja902137z","","","0.71073","MoKα","","0.1095","0.052","","","0.1093","0.1306","","","","","","1.001","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104515","22.1783","0.0014","9.4339","0.0006","10.8391","0.0007","90","","98.663","0.001","90","","2242","0.2","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 Cl2 N O8 S -","- C18 H25 Cl2 N O8 S -","- C72 H100 Cl8 N4 O32 S4 -","4","1","","D. Karl Bedke; Grant M. Shibuya; Alban Pereira; William H. Gerwick; Thomas H. Haines; Christopher D. Vanderwal","Relative Stereochemistry Determination and Synthesis of the Major Chlorosulfolipid from Ochromonas danica","Journal of the American Chemical Society","2009","131","","7570","7572","10.1021/ja902138w","","","0.71073","MoKα","","0.0327","0.028","","","0.0727","0.0763","","","","","","1.043","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104516","10.8038","0.001","23.985","0.002","8.7832","0.0008","90","","102.021","0.001","90","","2226.1","0.3","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","frojm03","","","- C28 H26 O6 -","- C28 H26 O6 -","- C112 H104 O24 -","4","1","","John A. Malona; Kevin Cariou; Alison J. Frontier","Nazarov Cyclization Initiated by Peracid Oxidation: The Total Synthesis of (\±)-Rocaglamide","Journal of the American Chemical Society","2009","131","","7560","7561","10.1021/ja9029736","","","0.71073","MoKα","","0.0731","0.0452","","","0.1044","0.1189","","","","","","1.021","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104517","9.0885","0.0014","9.8939","0.0015","14.454","0.002","85.558","0.003","79.432","0.003","77.598","0.003","1246.9","0.3","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","frojm09","","","- C27 H21 F3 O9 S -","- C27 H21 F3 O9 S -","- C54 H42 F6 O18 S2 -","2","1","","John A. Malona; Kevin Cariou; Alison J. Frontier","Nazarov Cyclization Initiated by Peracid Oxidation: The Total Synthesis of (\±)-Rocaglamide","Journal of the American Chemical Society","2009","131","","7560","7561","10.1021/ja9029736","","","0.71073","MoKα","","0.1319","0.0583","","","0.1123","0.1494","","","","","","0.96","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104518","24.6511","0.0009","15.6914","0.0004","24.5387","0.0008","90","","114.28","0.002","90","","8652.2","0.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46.5 H64 N4 O Si -","- C46.5 H64 N4 O Si -","- C372 H512 N32 O8 Si8 -","8","1","","Yun Xiong; Shenglai Yao; Matthias Driess","An Isolable NHC-Supported Silanone","Journal of the American Chemical Society","2009","131","","7562","7563","10.1021/ja9031049","","","0.71073","MoKα","","0.076","0.049","","","0.117","0.1271","","","","","","1.041","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104519","12.5248","0.0007","16.5902","0.0007","17.3318","0.0008","90","","105.545","0.005","90","","3469.6","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H52 N4 Si -","- C36 H52 N4 Si -","- C144 H208 N16 Si4 -","4","1","","Yun Xiong; Shenglai Yao; Matthias Driess","An Isolable NHC-Supported Silanone","Journal of the American Chemical Society","2009","131","","7562","7563","10.1021/ja9031049","","","0.71073","MoKα","","0.1972","0.0699","","","0.07","0.0939","","","","","","0.936","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104520","14.549","0.003","14.689","0.003","20.017","0.004","90","","97.19","0.03","90","","4244.2","1.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H68 Br2 P2 Pd2 -","- C40 H68 Br2 P2 Pd2 -","- C160 H272 Br8 P8 Pd8 -","4","1","","Fabiola Barrios-Landeros; Brad P. Carrow; John F. Hartwig","Effect of Ligand Steric Properties and Halide Identity on the Mechanism for Oxidative Addition of Haloarenes to Trialkylphosphine Pd(0) Complexes","Journal of the American Chemical Society","2009","131","","8141","8154","10.1021/ja900798s","","","0.71073","MoKα","","0.1119","0.0419","","","0.0677","0.0827","","","","","","0.914","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104521","15.251","0.003","14.575","0.003","20.401","0.004","90","","90.64","0.03","90","","4534.5","1.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H76 Cl2 P2 Pd2 -","- C48 H76 Cl2 P2 Pd2 -","- C192 H304 Cl8 P8 Pd8 -","4","1","","Fabiola Barrios-Landeros; Brad P. Carrow; John F. Hartwig","Effect of Ligand Steric Properties and Halide Identity on the Mechanism for Oxidative Addition of Haloarenes to Trialkylphosphine Pd(0) Complexes","Journal of the American Chemical Society","2009","131","","8141","8154","10.1021/ja900798s","","","0.71073","MoKα","","0.06","0.0386","","","0.0954","0.1042","","","","","","1.006","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104522","8.29","0.0017","24.948","0.005","10.626","0.002","90","","106.86","0.03","90","","2103.2","0.8","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H62 Cl2 F6 P2 Pd2 -","- C38 H61 Cl2 F6 P2 Pd2 -","- C76 H122 Cl4 F12 P4 Pd4 -","2","1","","Fabiola Barrios-Landeros; Brad P. Carrow; John F. Hartwig","Effect of Ligand Steric Properties and Halide Identity on the Mechanism for Oxidative Addition of Haloarenes to Trialkylphosphine Pd(0) Complexes","Journal of the American Chemical Society","2009","131","","8141","8154","10.1021/ja900798s","","","0.71073","MoKα","","0.0514","0.0427","","","0.1089","0.1146","","","","","","1.015","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104523","8.7256","0.0003","10.1686","0.0004","15.1679","0.0005","74.382","0.002","81.966","0.002","84.065","0.002","1280.34","0.08","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H16 F9 N -","- C30 H16 F9 N -","- C60 H32 F18 N2 -","2","1","","Jong Won Chung; Youngmin You; Hyun Sue Huh; Byeong-Kwan An; Seong-Jun Yoon; Se Hun Kim; Soon W. Lee; Soo Young Park","Shear- and UV-Induced Fluorescence Switching in Stilbenic π-Dimer Crystals Powered by Reversible [2 + 2] Cycloaddition","Journal of the American Chemical Society","2009","131","","8163","8172","10.1021/ja900803d","","","0.71073","MoKα","","0.1278","0.1131","","","0.3149","0.3312","","","","","","1.086","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104524","8.626","0.0016","10.283","0.002","15.342","0.004","75.91","0.02","79.12","0.02","82.83","0.017","1291.7","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H16 F9 N -","- C30 H16 F9 N -","- C60 H32 F18 N2 -","2","1","","Jong Won Chung; Youngmin You; Hyun Sue Huh; Byeong-Kwan An; Seong-Jun Yoon; Se Hun Kim; Soon W. Lee; Soo Young Park","Shear- and UV-Induced Fluorescence Switching in Stilbenic π-Dimer Crystals Powered by Reversible [2 + 2] Cycloaddition","Journal of the American Chemical Society","2009","131","","8163","8172","10.1021/ja900803d","","","0.71073","MoKα","","0.1299","0.1053","","","0.3167","0.3499","","","","","","1.09","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104525","7.4886","0.0009","7.9502","0.001","11.2672","0.0014","90","","91.095","0.002","90","","670.68","0.14","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H13 N O5 -","- C14 H13 N O5 -","- C28 H26 N2 O10 -","2","1","","Christopher J. Hayes; Nigel S. Simpkins; Douglas T. Kirk; Lee Mitchell; Jerome Baudoux; Alexander J. Blake; Claire Wilson","Bridgehead Lithiation-Substitution of Bridged Ketones, Lactones, Lactams, and Imides: Experimental Observations and Computational Insights","Journal of the American Chemical Society","2009","131","","8196","8210","10.1021/ja9009875","","","0.71073","MoKα","","0.0315","0.0293","","","0.0771","0.0784","","","","","","1.046","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104526","9.3099","0.0013","12.519","0.002","12.858","0.002","63.488","0.002","83.907","0.002","81.996","0.002","1326.3","0.3","150","2","150","2","","","","","","","","3","P 1","P 1","1","","","","- C16 H20 O2 -","- C16 H20 O2 -","- C64 H80 O8 -","4","4","","Christopher J. Hayes; Nigel S. Simpkins; Douglas T. Kirk; Lee Mitchell; Jerome Baudoux; Alexander J. Blake; Claire Wilson","Bridgehead Lithiation-Substitution of Bridged Ketones, Lactones, Lactams, and Imides: Experimental Observations and Computational Insights","Journal of the American Chemical Society","2009","131","","8196","8210","10.1021/ja9009875","","","0.71073","MoKα","","0.0682","0.0493","","","0.1189","0.1285","","","","","","1.002","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104527","6.1361","0.0009","20.097","0.003","25.013","0.004","90","","91.633","0.002","90","","3083.3","0.8","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H21 N O2 Si -","- C16 H21 N O2 Si -","- C128 H168 N8 O16 Si8 -","8","4","","Christopher J. Hayes; Nigel S. Simpkins; Douglas T. Kirk; Lee Mitchell; Jerome Baudoux; Alexander J. Blake; Claire Wilson","Bridgehead Lithiation-Substitution of Bridged Ketones, Lactones, Lactams, and Imides: Experimental Observations and Computational Insights","Journal of the American Chemical Society","2009","131","","8196","8210","10.1021/ja9009875","","","0.71073","MoKα","","0.0772","0.0607","","","0.1445","0.1523","","","","","","1.026","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4104528","11.071","0.0012","6.1798","0.0007","24.568","0.003","90","","102.43","0.002","90","","1641.5","0.3","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H23 N O2 Si -","- C17 H23 N O2 Si -","- C68 H92 N4 O8 Si4 -","4","2","","Christopher J. Hayes; Nigel S. Simpkins; Douglas T. Kirk; Lee Mitchell; Jerome Baudoux; Alexander J. Blake; Claire Wilson","Bridgehead Lithiation-Substitution of Bridged Ketones, Lactones, Lactams, and Imides: Experimental Observations and Computational Insights","Journal of the American Chemical Society","2009","131","","8196","8210","10.1021/ja9009875","","","0.6892","synchrotron","","0.06","0.0534","","","0.1167","0.1191","","","","","","0.935","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4104529","6.293","0.002","11.15","0.004","25.494","0.008","90","","90","","90","","1788.8","1","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C17 H23 N O S Si -","- C17 H23 N O S Si -","- C68 H92 N4 O4 S4 Si4 -","4","1","","Christopher J. Hayes; Nigel S. Simpkins; Douglas T. Kirk; Lee Mitchell; Jerome Baudoux; Alexander J. Blake; Claire Wilson","Bridgehead Lithiation-Substitution of Bridged Ketones, Lactones, Lactams, and Imides: Experimental Observations and Computational Insights","Journal of the American Chemical Society","2009","131","","8196","8210","10.1021/ja9009875","","","0.71073","MoKα","","0.0765","0.0436","","","0.0813","0.0883","","","","","","0.93","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4104530","9.2218","0.0018","11.407","0.002","15.182","0.003","88.63","0.03","73.5","0.03","84.78","0.03","1524.9","0.6","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C35 H32 O11 -","- C35 H32 O11 -","- C70 H64 O22 -","2","1","","Yu Feng; Zi-Tong Liu; Ji Liu; Yan-Mei He; Qi-Yu Zheng; Qing-Hua Fan","Peripherally Dimethyl Isophthalate-Functionalized Poly(benzyl ether) Dendrons: A New Kind of Unprecedented Highly Efficient Organogelators","Journal of the American Chemical Society","2009","131","","7950","7951","10.1021/ja901501j","","","0.71073","MoKα","","0.1255","0.0816","","","0.1341","0.1467","","","","","","1.214","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104531","13.4328","0.0003","14.2892","0.0002","22.198","0.0004","90","","105.729","0.003","90","","4101.23","0.14","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H39 B2 Fe3 N20 O7 -","- C28 H34 B2 Fe3 N20 O7 -","- C112 H136 B8 Fe12 N80 O28 -","4","1","","Yan-Juan Zhang; Tao Liu; Shinji Kanegawa; Osamu Sato","Reversible Single-Crystal-to-Single-Crystal Transformation from Achiral Antiferromagnetic Hexanuclears to a Chiral Ferrimagnetic Double Zigzag Chain","Journal of the American Chemical Society","2009","131","","7942","7943","10.1021/ja901539y","","","0.71073","MoKα","","0.1221","0.0798","","","0.1571","0.1718","","","","","","1.105","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104532","21.9803","0.0003","14.3748","0.0002","13.3242","0.0002","90","","120.32","0.005","90","","3634.1","0.2","123","2","123","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C24 H20 B2 Fe3 N18 O -","- C24 H18 B2 Fe3 N18 O -","- C96 H72 B8 Fe12 N72 O4 -","4","1","","Yan-Juan Zhang; Tao Liu; Shinji Kanegawa; Osamu Sato","Reversible Single-Crystal-to-Single-Crystal Transformation from Achiral Antiferromagnetic Hexanuclears to a Chiral Ferrimagnetic Double Zigzag Chain","Journal of the American Chemical Society","2009","131","","7942","7943","10.1021/ja901539y","","","0.71073","MoKα","","0.1611","0.1218","","","0.29","0.3389","","","","","","1.168","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104533","14.4533","0.0009","14.4533","0.0009","14.4533","0.0009","112.201","0.001","112.201","0.001","112.201","0.001","2056.1","0.2","163","2","163","2","","","","","","","","5","R 3 c :R","P 3* -2n","161","","","","- C9 H6 Fe2 O7 S2 -","- C9 H6 Fe2 O7 S2 -","- C54 H36 Fe12 O42 S12 -","6","1","","Tianbiao Liu; Bin Li; Michael L. Singleton; Michael B. Hall; Marcetta Y. Darensbourg","Sulfur Oxygenates of Biomimetics of the Diiron Subsite of the [FeFe]-Hydrogenase Active Site: Properties and Oxygen Damage Repair Possibilities","Journal of the American Chemical Society","2009","131","","8296","8307","10.1021/ja9016528","","","0.71073","MoKα","","0.0452","0.0434","","","0.1076","0.1097","","","","","","1.078","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104534","9.028","0.002","11.105","0.002","14.688","0.003","94.528","0.012","90.33","0.012","110.374","0.01","1375.3","0.5","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H21 Fe2 O7 P S2 -","- C26 H21 Fe2 O7 P S2 -","- C52 H42 Fe4 O14 P2 S4 -","2","1","","Tianbiao Liu; Bin Li; Michael L. Singleton; Michael B. Hall; Marcetta Y. Darensbourg","Sulfur Oxygenates of Biomimetics of the Diiron Subsite of the [FeFe]-Hydrogenase Active Site: Properties and Oxygen Damage Repair Possibilities","Journal of the American Chemical Society","2009","131","","8296","8307","10.1021/ja9016528","","","1.54178","CuKα","","0.0767","0.0503","","","0.1039","0.1116","","","","","","0.906","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104535","9.2023","0.0012","10.1762","0.0013","14.772","0.002","95.35","0.007","94.305","0.007","107.375","0.006","1306.7","0.3","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H21 Fe2 O6 P S2 -","- C26 H21 Fe2 O6 P S2 -","- C52 H42 Fe4 O12 P2 S4 -","2","1","","Tianbiao Liu; Bin Li; Michael L. Singleton; Michael B. Hall; Marcetta Y. Darensbourg","Sulfur Oxygenates of Biomimetics of the Diiron Subsite of the [FeFe]-Hydrogenase Active Site: Properties and Oxygen Damage Repair Possibilities","Journal of the American Chemical Society","2009","131","","8296","8307","10.1021/ja9016528","","","1.54178","CuKα","","0.103","0.067","","","0.1587","0.1755","","","","","","0.914","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104536","20.59","0.002","9.4714","0.001","22.335","0.002","90","","104.732","0.005","90","","4212.5","0.7","106","2","106","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H25 Fe2 O5.5 P2 S2 -","- C13 H25 Fe2 O5.5 P2 S2 -","- C104 H200 Fe16 O44 P16 S16 -","8","2","","Tianbiao Liu; Bin Li; Michael L. Singleton; Michael B. Hall; Marcetta Y. Darensbourg","Sulfur Oxygenates of Biomimetics of the Diiron Subsite of the [FeFe]-Hydrogenase Active Site: Properties and Oxygen Damage Repair Possibilities","Journal of the American Chemical Society","2009","131","","8296","8307","10.1021/ja9016528","","","1.54178","CuKα","","0.0931","0.0589","","","0.1302","0.1493","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104537","8.392","0.004","12.651","0.006","12.692","0.006","88.196","0.008","78.502","0.008","77.183","0.008","1287.4","1.1","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H26 Cl2 Fe Na0 O6 P2 -","- C22 H26 Cl2 Fe O6 P2 -","- C44 H52 Cl4 Fe2 O12 P4 -","2","1","","Tianbiao Liu; Bin Li; Michael L. Singleton; Michael B. Hall; Marcetta Y. Darensbourg","Sulfur Oxygenates of Biomimetics of the Diiron Subsite of the [FeFe]-Hydrogenase Active Site: Properties and Oxygen Damage Repair Possibilities","Journal of the American Chemical Society","2009","131","","8296","8307","10.1021/ja9016528","","","0.71073","MoKα","","0.062","0.0464","","","0.1151","0.1248","","","","","","1.036","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104538","13.3637","0.0004","13.3637","0.0004","9.5954","0.0007","90","","90","","90","","1713.63","0.14","150","2","150","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C44 H27 Fe N5 O -","- C44 H27 Fe N5 O -","- C88 H54 Fe2 N10 O2 -","2","0.125","","Wei-Min Ching; Chuan-Hung Chuang; Chih-Wei Wu; Chih-Hsiung Peng; Chen-Hsiung Hung","Facile Nitrite Reduction and Conversion Cycle of {Fe(NO)}6/7 Species: Chemistry of Iron N-Confused Porphyrin Complexes via Protonation/Deprotonation","Journal of the American Chemical Society","2009","131","","7952","7953","10.1021/ja901796j","","","0.71073","MoKα","","0.1219","0.0589","","","0.1518","0.17","","","","","","1.037","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104539","15.8963","0.0005","9.6917","0.0003","22.5515","0.0007","90","","98.775","0.002","90","","3433.67","0.19","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H28 Cl Fe N5 O5 -","- C44 H28 Cl Fe N5 O5 -","- C176 H112 Cl4 Fe4 N20 O20 -","4","1","","Wei-Min Ching; Chuan-Hung Chuang; Chih-Wei Wu; Chih-Hsiung Peng; Chen-Hsiung Hung","Facile Nitrite Reduction and Conversion Cycle of {Fe(NO)}6/7 Species: Chemistry of Iron N-Confused Porphyrin Complexes via Protonation/Deprotonation","Journal of the American Chemical Society","2009","131","","7952","7953","10.1021/ja901796j","","","0.71073","MoKα","","0.0818","0.0501","","","0.1276","0.1492","","","","","","1.04","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104540","13.3762","0.0017","13.3762","0.0017","9.656","0.003","90","","90","","90","","1727.7","0.6","200","2","200","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C44 H28 Fe N5 O -","- C44 H28 Fe N5 O1.04 -","- C88 H56 Fe2 N10 O2.08 -","2","0.125","","Wei-Min Ching; Chuan-Hung Chuang; Chih-Wei Wu; Chih-Hsiung Peng; Chen-Hsiung Hung","Facile Nitrite Reduction and Conversion Cycle of {Fe(NO)}6/7 Species: Chemistry of Iron N-Confused Porphyrin Complexes via Protonation/Deprotonation","Journal of the American Chemical Society","2009","131","","7952","7953","10.1021/ja901796j","","","0.71073","MoKα","","0.0803","0.0496","","","0.1211","0.1321","","","","","","1.152","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104541","8.702","0.002","12.33","0.003","23.758","0.006","92.188","0.004","91.229","0.004","101.656","0.004","2493.6","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H76 N2 O W -","- C55 H76 N2 O W -","- C110 H152 N4 O2 W2 -","2","1","","Margaret M. Flook; Annie J. Jiang; Richard R. Schrock; Amir H. Hoveyda","Z-Selective Olefin Metathesis Processes Catalyzed by a Molybdenum Hexaisopropylterphenoxide Monopyrrolide Complex","Journal of the American Chemical Society","2009","131","","7962","7963","10.1021/ja902738u","","","0.71073","MoKα","","0.0822","0.0672","","","0.1587","0.1684","","","","","","1.025","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104542","17.131","0.003","13.08","0.002","13.497","0.002","90","","107.38","0.002","90","","2886.2","0.8","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 Fe N4 O2 -","- C29 H41 Fe N4 O2 -","- C116 H164 Fe4 N16 O8 -","4","1","","Zachary J. Tonzetich; Loi H. Do; Stephen J. Lippard","Dinitrosyl Iron Complexes Relevant to Rieske Cluster Nitrosylation","Journal of the American Chemical Society","2009","131","","7964","7965","10.1021/ja9030159","","","0.71073","MoKα","","0.0482","0.041","","","0.1092","0.1137","","","","","","1.044","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104543","10.7691","0.0011","19.3","0.002","27.719","0.003","90","","91.406","0.002","90","","5759.5","1","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C65 H71 Fe N5 O2 P2 -","- C65 H71 Fe N5 O2 P2 -","- C260 H284 Fe4 N20 O8 P8 -","4","1","","Zachary J. Tonzetich; Loi H. Do; Stephen J. Lippard","Dinitrosyl Iron Complexes Relevant to Rieske Cluster Nitrosylation","Journal of the American Chemical Society","2009","131","","7964","7965","10.1021/ja9030159","","","0.71073","MoKα","","0.0872","0.0698","","","0.1881","0.2063","","","","","","1.121","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104544","6.1776","0.0007","10.4112","0.0012","18.857","0.002","90","","92.794","0.003","90","","1211.4","0.2","143","1","143","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H41 N O4 -","- C23 H41 N O4 -","- C46 H82 N2 O8 -","2","1","","Michael H. Kerrigan; Sang-Jin Jeon; Young K. Chen; Luca Salvi; Patrick J. Carroll; Patrick J. Walsh","One-Pot Multicomponent Coupling Methods for the Synthesis of Diastereo- and Enantioenriched (Z)-Trisubstituted Allylic Alcohols","Journal of the American Chemical Society","2009","131","","8434","8445","10.1021/ja809821x","","","0.71069","MoKα","","0.0639","0.0342","","","0.0661","0.0787","","","","","","0.909","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104545","10.7389","0.0004","20.9329","0.0007","20.7871","0.0007","90","","90","","90","","4672.9","0.3","173","2","173","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C44 H30 Ag2 B2 F10 N10 O8 -","- C44 H30 Ag2 B2 F10 N10 O8 -","- C176 H120 Ag8 B8 F40 N40 O32 -","4","0.5","","Ming-Liang Ma; Xiao-Yan Li; Ke Wen","Coordination-Driven Self-Assembly of a Discrete Molecular Cage and an Infinite Chain of Coordination Cages Based on ortho-Linked Oxacalix[2]benzene[2]pyrazine and Oxacalix[2]arene[2]pyrazine","Journal of the American Chemical Society","2009","131","","8338","8339","10.1021/ja900291w","","","0.71073","MoKα","","0.0402","0.0395","","","0.1166","0.1175","","","","","","1.094","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104546","12.6692","0.0003","21.3336","0.0005","7.9208","0.0002","90","","90","","90","","2140.83","0.09","173","2","173","2","","","","","","","","7","P m m n :2","-P 2ab 2a","59","","","","- C11.75 H7.75 Ag0.25 B0.25 F1.25 N2 O2 -","- C11.75 H7.75 Ag0.25 B0.25 F1.25 N2 O2 -","- C94 H62 Ag2 B2 F10 N16 O16 -","8","1","","Ming-Liang Ma; Xiao-Yan Li; Ke Wen","Coordination-Driven Self-Assembly of a Discrete Molecular Cage and an Infinite Chain of Coordination Cages Based on ortho-Linked Oxacalix[2]benzene[2]pyrazine and Oxacalix[2]arene[2]pyrazine","Journal of the American Chemical Society","2009","131","","8338","8339","10.1021/ja900291w","","","0.71073","MoKα","","0.0446","0.0424","","","0.112","0.116","","","","","","1.091","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104547","9.6049","0.0019","9.6051","0.0019","19.251","0.004","82.72","0.03","82.65","0.03","88.48","0.03","1747.1","0.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H40 Cl2 Fe N6 O3 S2 -","- C35 H40 Cl2 Fe N6 O3 S2 -","- C70 H80 Cl4 Fe2 N12 O6 S4 -","2","1","","Michael J. Rose; Nolan M. Betterley; Pradip K. Mascharak","Thiolate S-Oxygenation Controls Nitric Oxide (NO) Photolability of a Synthetic Iron Nitrile Hydratase (Fe-NHase) Model Derived from Mixed Carboxamide/Thiolate Ligand","Journal of the American Chemical Society","2009","131","","8340","8341","10.1021/ja9004656","","","0.7749","synchrotron","","0.0974","0.0772","","","0.2048","0.2233","","","","","","1.062","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104548","13.4564","0.0014","18.4","0.002","18.93","0.002","86.35","0.001","79.84","0.001","79.015","0.001","4526.8","0.8","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H56.5 Cl2 Fe N5.5 O3.5 S2 -","- C42 H51.5 Cl2 Fe N5.5 O3.5 S2 -","- C168 H206 Cl8 Fe4 N22 O14 S8 -","4","2","","Michael J. Rose; Nolan M. Betterley; Pradip K. Mascharak","Thiolate S-Oxygenation Controls Nitric Oxide (NO) Photolability of a Synthetic Iron Nitrile Hydratase (Fe-NHase) Model Derived from Mixed Carboxamide/Thiolate Ligand","Journal of the American Chemical Society","2009","131","","8340","8341","10.1021/ja9004656","","","0.71073","MoKα","","0.0958","0.0613","","","0.1693","0.1886","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104549","9.1259","0.0018","11.164","0.002","19.548","0.004","90","","90","","90","","1991.6","0.7","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H23 N O3 -","- C24 H23 N O3 -","- C96 H92 N4 O12 -","4","1","","Marino J. E. Resendiz; Farnosh Family; Kerrian Fuller; Luis M. Campos; Saeed I. Khan; Natalia V. Lebedeva; Malcolm D. E. Forbes; Miguel A. Garcia-Garibay","Radical Reactions with Double Memory of Chirality (2MOC) for the Enantiospecific Synthesis of Adjacent Stereogenic Quaternary Centers in Solution: Cleavage and Bonding Faster than Radical Rotation","Journal of the American Chemical Society","2009","131","","8425","8433","10.1021/ja900781n","","","0.71073","MoKα","","0.0554","0.0405","","","0.0835","0.0911","","","","","","1.037","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104550","6.8604","0.0013","6.8604","0.0013","40.242","0.011","90","","90","","90","","1894","0.7","110","2","110","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C23 H24 N2 O3 -","- C23 H24 N2 O3 -","- C92 H96 N8 O12 -","4","0.5","","Marino J. E. Resendiz; Farnosh Family; Kerrian Fuller; Luis M. Campos; Saeed I. Khan; Natalia V. Lebedeva; Malcolm D. E. Forbes; Miguel A. Garcia-Garibay","Radical Reactions with Double Memory of Chirality (2MOC) for the Enantiospecific Synthesis of Adjacent Stereogenic Quaternary Centers in Solution: Cleavage and Bonding Faster than Radical Rotation","Journal of the American Chemical Society","2009","131","","8425","8433","10.1021/ja900781n","","","0.71073","MoKα","","0.0635","0.0591","","","0.1324","0.1339","","","","","","1.289","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104551","10.6231","0.0003","14.0223","0.0005","19.2344","0.0009","90","","90","","90","","2865.16","0.19","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H41 F3 N2 O5 S -","- C26 H41 F3 N2 O5 S -","- C104 H164 F12 N8 O20 S4 -","4","1","","Sebastian Würtz; Claudia Lohre; Roland Fröhlich; Klaus Bergander; Frank Glorius","IBiox[(-)-menthyl]: A Sterically Demanding Chiral NHC Ligand","Journal of the American Chemical Society","2009","131","","8344","8345","10.1021/ja901018g","","","1.54178","CuKα","","0.0704","0.0521","","","0.1114","0.1246","","","","","","1.026","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104552","10.6661","0.0002","12.9006","0.0002","18.6675","0.0004","90","","90","","90","","2568.63","0.08","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H40 Ag Br N2 O2 -","- C25 H40 Ag Br N2 O2 -","- C100 H160 Ag4 Br4 N8 O8 -","4","1","","Sebastian Würtz; Claudia Lohre; Roland Fröhlich; Klaus Bergander; Frank Glorius","IBiox[(-)-menthyl]: A Sterically Demanding Chiral NHC Ligand","Journal of the American Chemical Society","2009","131","","8344","8345","10.1021/ja901018g","","","0.71073","MoKα","","0.079","0.0463","","","0.0695","0.0784","","","","","","1.057","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104553","5.4069","0.0009","9.6575","0.0016","15.955","0.003","102.987","0.003","95.655","0.003","100.24","0.003","790.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H24 Cl N -","- C16 H24 Cl N -","- C32 H48 Cl2 N2 -","2","1","","Hu He; Wen-Bo Liu; Li-Xin Dai; Shu-Li You","Ir-Catalyzed Cross-Coupling of Styrene Derivatives with Allylic Carbonates: Free Amine Assisted Vinyl C-H Bond Activation","Journal of the American Chemical Society","2009","131","","8346","8347","10.1021/ja901384j","","","0.71073","MoKα","","0.0698","0.0532","","","0.1336","0.1427","","","","","","0.947","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104554","11.872","0.005","12.634","0.006","16.656","0.007","101.4","0.008","99.906","0.008","90.172","0.009","2410.7","1.8","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","","","- C26.5 H26.5 Cl N Si -","- C26.5 H26.5 Cl N Si -","- C106 H106 Cl4 N4 Si4 -","4","2","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.164","0.0937","","","0.2858","0.3211","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104555","7.6874","0.0005","11.6176","0.0008","12.1282","0.0008","105.956","0.001","106.265","0.001","99.853","0.001","962.95","0.11","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 N O Si -","- C21 H27 N O Si -","- C42 H54 N2 O2 Si2 -","2","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0428","0.04","","","0.1138","0.1159","","","","","","1.042","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104556","9.5589","0.0009","12.4419","0.0011","12.473","0.0011","60.898","0.001","75.788","0.002","89.39","0.002","1246.1","0.2","300","2","300","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H28 F3 N O Si -","- C27 H28 F3 N O Si -","- C54 H56 F6 N2 O2 Si2 -","2","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKa","","0.0476","0.0424","","","0.1168","0.1206","","","","","","1.035","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104557","8.7034","0.0006","9.7875","0.0008","13.2568","0.0008","82.294","0.001","73.449","0.001","73.152","0.001","1034.39","0.13","300","2","300","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H29 N O2 Si -","- C22 H29 N O2 Si -","- C44 H58 N2 O4 Si2 -","2","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0556","0.0491","","","0.1392","0.1437","","","","","","1.101","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104558","9.7654","0.0007","30.089","0.002","13.7152","0.001","90","","95.274","0.001","90","","4012.9","0.5","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H26 Cl N O Si -","- C21 H26 Cl N O Si -","- C168 H208 Cl8 N8 O8 Si8 -","8","2","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0738","0.0547","","","0.1561","0.1642","","","","","","0.988","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104559","8.922","0.003","15.574","0.005","18.579","0.006","94.703","0.005","96.798","0.006","99.74","0.006","2512.7","1.4","300","2","300","2","","","","","","","","8","P -1","-P 1","2","","","","- C22 H25 Cl F3 N O3 S Si -","- C22 H25 Cl F3 N O3 S Si -","- C88 H100 Cl4 F12 N4 O12 S4 Si4 -","4","2","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0732","0.0561","","","0.1599","0.1703","","","","","","1.051","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104560","8.0586","0.0013","14.782","0.002","20.24","0.003","90","","90","","90","","2411","0.6","300","2","300","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H26 F3 N Si -","- C27 H26 F3 N Si -","- C108 H104 F12 N4 Si4 -","4","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.087","0.0746","","","0.2021","0.214","","","","","","1.057","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104561","17.8271","0.0014","14.2864","0.0011","20.0246","0.0016","90","","96.779","0.001","90","","5064.3","0.7","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 N O2 S Si -","- C27 H29 N O2 S Si -","- C216 H232 N8 O16 S8 Si8 -","8","2","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.1135","0.0684","","","0.1787","0.196","","","","","","1.061","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104562","7.8753","0.0007","9.9812","0.0009","12.5882","0.0011","85.742","0.002","89.861","0.002","89.268","0.002","986.68","0.15","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H24 N2 Si -","- C22 H24 N2 Si -","- C44 H48 N4 Si2 -","2","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0745","0.0599","","","0.1836","0.196","","","","","","1.08","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104563","17.16","0.002","15.249","0.002","7.5538","0.001","90","","90","","90","","1976.6","0.4","300","2","300","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C21 H24 Cl N Si -","- C21 H24 Cl N Si -","- C84 H96 Cl4 N4 Si4 -","4","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0489","0.0438","","","0.1156","0.1202","","","","","","1.039","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104564","11.9398","0.0008","10.6673","0.0007","15.4012","0.0011","90","","90","","90","","1961.6","0.2","300","2","300","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C21 H24 Cl N Si -","- C21 H24 Cl N Si -","- C84 H96 Cl4 N4 Si4 -","4","1","","Kenji Mochida; Masaki Shimizu; Tamejiro Hiyama","Palladium-Catalyzed Intramolecular Coupling of 2-[(2-Pyrrolyl)silyl]aryl Triflates through 1,2-Silicon Migration","Journal of the American Chemical Society","2009","131","","8350","8351","10.1021/ja901622b","","","0.71073","MoKα","","0.0475","0.043","","","0.1114","0.1156","","","","","","1.055","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104565","13.7439","0.0002","23.6882","0.0003","19.7743","0.0003","90","","99.337","0.001","90","","6352.59","0.16","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C55 H57 B Cl2 F24 Ir N O2 P2 -","- C55 H56 B Cl2 F24 Ir N O2 P2 -","- C220 H224 B4 Cl8 F96 Ir4 N4 O8 P8 -","4","1","","Wesley H. Bernskoetter; Susan Kloek Hanson; Sara K. Buzak; Zoe Davis; Peter S. White; Rodney Swartz; Karen I. Goldberg; Maurice Brookhart","Investigations of Iridium-Mediated Reversible C-H Bond Cleavage: Characterization of a 16-Electron Iridium(III) Methyl Hydride Complex","Journal of the American Chemical Society","2009","131","","8603","8613","10.1021/ja901706b","","","0.71073","MoKα","","0.0452","0.0373","","","0.0939","0.099","","","","","","1.027","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104566","8.3103","0.0004","10.6257","0.0008","17.3126","0.0014","92.182","0.006","98.874","0.006","110.226","0.002","1410.41","0.17","130","2","130","2","","","","","","","","6","P -1","-P 1","2","EJK-I-18","EJK-I-18","","- C27 H44 Ir N O2 P2 -","- C27 H44 Ir N O2 P2 -","- C54 H88 Ir2 N2 O4 P4 -","2","1","","Wesley H. Bernskoetter; Susan Kloek Hanson; Sara K. Buzak; Zoe Davis; Peter S. White; Rodney Swartz; Karen I. Goldberg; Maurice Brookhart","Investigations of Iridium-Mediated Reversible C-H Bond Cleavage: Characterization of a 16-Electron Iridium(III) Methyl Hydride Complex","Journal of the American Chemical Society","2009","131","","8603","8613","10.1021/ja901706b","","","0.71073","MoKα","","0.103","0.0782","","","0.1908","0.2107","","","","","","1.027","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104567","6.9209","0.0014","11.428","0.002","11.612","0.002","87.68","0.03","88.16","0.03","79.5","0.03","902","0.3","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- H6 K7 O35 Si12 Sm3 -","- K7 O35 Si12 Sm3 -","- K7 O35 Si12 Sm3 -","1","0.5","","Duarte Ananias; Mariya Kostova; Filipe A. Almeida Paz; Albano N. C. Neto; Renaldo T. De Moura; Oscar L. Malta; Luis D. Carlos; João Rocha","Molecule-Like Eu3±Dimers Embedded in an Extended System Exhibit Unique Photoluminescence Properties","Journal of the American Chemical Society","2009","131","","8620","8626","10.1021/ja901820z","","","0.71073","MoKα","","0.0425","0.0391","","","0.0969","0.0997","","","","","","1.008","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104568","6.9007","0.0003","11.43","0.0006","11.5835","0.0006","87.695","0.002","88.471","0.002","79.589","0.002","897.7","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- Eu3 H8 K7 O36 Si12 -","- Eu3 K7 O36 Si12 -","- Eu3 K7 O36 Si12 -","1","0.5","","Duarte Ananias; Mariya Kostova; Filipe A. Almeida Paz; Albano N. C. Neto; Renaldo T. De Moura; Oscar L. Malta; Luis D. Carlos; João Rocha","Molecule-Like Eu3±Dimers Embedded in an Extended System Exhibit Unique Photoluminescence Properties","Journal of the American Chemical Society","2009","131","","8620","8626","10.1021/ja901820z","","","0.71073","MoKα","","0.0339","0.0321","","","0.0749","0.0757","","","","","","1.196","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104569","10.606","0.0015","10.606","0.0015","5.159","0.001","90","","90","","90","","580.32","0.16","293","2","293","2","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","","","- Ba Hg2 Tl2 -","- Ba Hg2 Tl2 -","- Ba4 Hg8 Tl8 -","4","0.25","","Jing-Cao Dai; Shalabh Gupta; Olivier Gourdon; Hyun-Jeong Kim; John D. Corbett","BaHg2Tl2. An Unusual Polar Intermetallic Phase with Strong Differentiation between the Neighboring Elements Mercury and Thallium","Journal of the American Chemical Society","2009","131","","8677","8682","10.1021/ja901865d","","","0.71073","MoKα","","0.058","0.0414","","","0.0772","0.0799","","","","","","1.005","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104570","10.5933","0.0006","10.5933","0.0006","5.1594","0.0003","90","","90","","90","","578.98","0.06","293","2","293","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","","","- Ba Hg2 Tl2 -","- Ba Hg2 Tl2 -","- Ba4 Hg8 Tl8 -","4","0.25","","Jing-Cao Dai; Shalabh Gupta; Olivier Gourdon; Hyun-Jeong Kim; John D. Corbett","BaHg2Tl2. An Unusual Polar Intermetallic Phase with Strong Differentiation between the Neighboring Elements Mercury and Thallium","Journal of the American Chemical Society","2009","131","","8677","8682","10.1021/ja901865d","powder diffraction","neutron","","neutron","","0.1288","0.1263","","","0.1261","0.1262","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104571","17.78","0.003","17.78","0.003","33.531","0.007","90","","90","","120","","9180","3","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C78 H90 N42 O12 Zn6 -","- C78 H90 N42 O12 Zn6 -","- C234 H270 N126 O36 Zn18 -","3","0.166667","","Jihyun An; Richard P. Fiorella; Steven J. Geib; Nathaniel L. Rosi","Synthesis, Structure, Assembly, and Modulation of the CO2 Adsorption Properties of a Zinc-Adeninate Macrocycle","Journal of the American Chemical Society","2009","131","","8401","8403","10.1021/ja901869m","","x-ray","0.71073","MoKα","","0.101","0.0716","","","0.2064","0.2233","","","","","","1.222","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104572","19.16","0.004","35.098","0.007","14.954","0.003","90","","108.7","0.03","90","","9525","4","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C87 H86 Cl2 N14 O25 -","- C87 H86 Cl1.9 N14 O24.93 -","- C348 H344 Cl7.6 N56 O99.72 -","4","1","","David Sánchez-García; Brice Kauffmann; Takahiro Kawanami; Hirotaka Ihara; Makoto Takafuji; Marie-Hélène Delville; Ivan Huc","Nanosized Hybrid Oligoamide Foldamers: Aromatic Templates for the Folding of Multiple Aliphatic Units","Journal of the American Chemical Society","2009","131","","8642","8648","10.1021/ja9019758","","","1.54178","CuKα","","0.1583","0.1498","","","0.4315","0.4463","","","","","","1.311","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104573","15.5104","0.0002","21.9149","0.0005","44.8309","0.0008","90","","98.432","0.001","90","","15073.7","0.5","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C146 H178 N20 O29 S6.5 -","- C146 H178 N20 O29 S6.375 -","- C584 H712 N80 O116 S25.5 -","4","1","","David Sánchez-García; Brice Kauffmann; Takahiro Kawanami; Hirotaka Ihara; Makoto Takafuji; Marie-Hélène Delville; Ivan Huc","Nanosized Hybrid Oligoamide Foldamers: Aromatic Templates for the Folding of Multiple Aliphatic Units","Journal of the American Chemical Society","2009","131","","8642","8648","10.1021/ja9019758","","","1.5418","CuKα","","0.1839","0.1479","","","0.3638","0.3927","","","","","","1.168","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104574","13.1809","0.0011","32.553","0.002","33.151","0.004","90","","91.912","0.007","90","","14216","2","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C151 H160 Cl0 N22 O26 -","- C151 H160 N22 O25.33 -","- C604 H640 N88 O101.32 -","4","1","","David Sánchez-García; Brice Kauffmann; Takahiro Kawanami; Hirotaka Ihara; Makoto Takafuji; Marie-Hélène Delville; Ivan Huc","Nanosized Hybrid Oligoamide Foldamers: Aromatic Templates for the Folding of Multiple Aliphatic Units","Journal of the American Chemical Society","2009","131","","8642","8648","10.1021/ja9019758","","","1.5418","CuKα","","0.1212","0.0977","","","0.2724","0.2967","","","","","","1.309","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104575","15.9229","0.0006","17.4859","0.0008","28.2835","0.0014","96.674","0.002","97.181","0.002","101.876","0.002","7563.7","0.6","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C160 H164 N24 O25.5 -","- C160 H164 N24 O25.68 -","- C320 H328 N48 O51.36 -","2","1","","David Sánchez-García; Brice Kauffmann; Takahiro Kawanami; Hirotaka Ihara; Makoto Takafuji; Marie-Hélène Delville; Ivan Huc","Nanosized Hybrid Oligoamide Foldamers: Aromatic Templates for the Folding of Multiple Aliphatic Units","Journal of the American Chemical Society","2009","131","","8642","8648","10.1021/ja9019758","","","1.5418","CuKα","","0.167","0.1407","","","0.3831","0.4045","","","","","","1.548","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104576","20.668","","24.598","","27.32","","79.04","","81.5","","79.64","","13320.5","","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C280 H303 N46 O47.5 S2 -","- C280 H303 N45 O47.5 S2 -","- C560 H606 N90 O95 S4 -","2","1","","David Sánchez-García; Brice Kauffmann; Takahiro Kawanami; Hirotaka Ihara; Makoto Takafuji; Marie-Hélène Delville; Ivan Huc","Nanosized Hybrid Oligoamide Foldamers: Aromatic Templates for the Folding of Multiple Aliphatic Units","Journal of the American Chemical Society","2009","131","","8642","8648","10.1021/ja9019758","","","0.8265","synchrotronradiaition","","0.1962","0.1842","","","0.4528","0.4677","","","","","","1.86","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104577","11.3839","0.0006","10.1664","0.0005","21.0984","0.0011","90","","101.554","0.002","90","","2392.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cyclic (Alkyl)(Amino)CarbeneAuCl","","","- C25 H37 Au Cl N -","- C25 H37 Au Cl N -","- C100 H148 Au4 Cl4 N4 -","4","1","","Xiaoming Zeng; Guido D. Frey; Rei Kinjo; Bruno Donnadieu; Guy Bertrand","Synthesis of a Simplified Version of Stable Bulky and Rigid Cyclic (Alkyl)(amino)carbenes, and Catalytic Activity of the Ensuing Gold(I) Complex in the Three-Component Preparation of 1,2-Dihydroquinoline Derivatives","Journal of the American Chemical Society","2009","131","","8690","8696","10.1021/ja902051m","","","0.71073","MoKα","","0.0391","0.0267","","","0.0518","0.0554","","","","","","1.026","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104578","9.7579","0.0017","12.115","0.002","14.384","0.003","90","","98.7","0.002","90","","1680.9","0.5","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2-ethyl-1,2 dihydro-1-methyl-4-phenyl-2-propylquinoline","","","- C21 H24.5 N -","- C21 H24.5 N -","- C84 H98 N4 -","4","1","","Xiaoming Zeng; Guido D. Frey; Rei Kinjo; Bruno Donnadieu; Guy Bertrand","Synthesis of a Simplified Version of Stable Bulky and Rigid Cyclic (Alkyl)(amino)carbenes, and Catalytic Activity of the Ensuing Gold(I) Complex in the Three-Component Preparation of 1,2-Dihydroquinoline Derivatives","Journal of the American Chemical Society","2009","131","","8690","8696","10.1021/ja902051m","","","0.71073","MoKα","","0.082","0.066","","","0.1882","0.1997","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104579","12.4922","0.0007","7.4836","0.0003","18.1749","0.0007","90","","102.338","0.0014","90","","1659.87","0.13","173.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C16 H18 Cl F3 Ir N O -","- C16 H18 Cl F3 Ir N O -","- C64 H72 Cl4 F12 Ir4 N4 O4 -","4","1","","Ryohei Yamaguchi; Chikako Ikeda; Yoshinori Takahashi; Ken-ichi Fujita","Homogeneous Catalytic System for Reversible Dehydrogenation-Hydrogenation Reactions of Nitrogen Heterocycles with Reversible Interconversion of Catalytic Species","Journal of the American Chemical Society","2009","131","","8410","8412","10.1021/ja9022623","","","0.71075","MoKα","","","0.0369","","","","0.0446","","","","","","1.014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104580","38.156","0.008","11.041","0.002","14.632","0.003","90","","93.186","0.003","90","","6155","2","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C54 H68 B2 Cl4 O12 S4 Si2 -","- C54 H68 B2 Cl4 O12 S4 Si2 -","- C216 H272 B8 Cl16 O48 S16 Si8 -","4","0.5","","Wenjun Liu; Maren Pink; Dongwhan Lee","Conjugated Polymer Sensors Built on π-Extended Borasiloxane Cages","Journal of the American Chemical Society","2009","131","","8703","8707","10.1021/ja902333p","","","0.71073","MoKα","","0.0791","0.0619","","","0.1756","0.1892","","","","","","1.081","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4104581","38.237","0.002","38.237","0.002","11.1753","0.0012","90","","90","","90","","16339","2","203","2","273","2","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","bio-MOF-1","","","- C104 H64 N20 O25 Zn8 -","- C104 H64 N20 O25 Zn8 -","- C416 H256 N80 O100 Zn32 -","4","0.25","","Jihyun An; Steven J. Geib; Nathaniel L. Rosi","Cation-Triggered Drug Release from a Porous Zinc-Adeninate Metal-Organic Framework","Journal of the American Chemical Society","2009","131","","8376","8377","10.1021/ja902972w","","","0.71073","MoKα","","0.1267","0.094","","","0.2376","0.2501","","","","","","1.528","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104582","7.478","0.0003","15.0069","0.0005","24.6083","0.0009","90","","90","","90","","2761.58","0.18","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H42 O3 Si2 -","- C25 H42 O3 Si2 -","- C100 H168 O12 Si8 -","4","1","","Amir H. Hoveyda; Pamela J. Lombardi; Robert V. O'Brien,; Adil R. Zhugralin","H-Bonding as a Control Element in Stereoselective Ru-Catalyzed Olefin Metathesis","Journal of the American Chemical Society","2009","131","","8378","8379","10.1021/ja9030903","","","","","","","","","","","","","","","","","","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104583","10.8793","0.0019","17.55","0.003","11.456","0.002","90","","100.646","0.002","90","","2149.7","0.6","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H28 N2 O2 S -","- C25 H29 N2 O2 S -","- C100 H116 N8 O8 S4 -","4","2","","Amir H. Hoveyda; Pamela J. Lombardi; Robert V. O'Brien,; Adil R. Zhugralin","H-Bonding as a Control Element in Stereoselective Ru-Catalyzed Olefin Metathesis","Journal of the American Chemical Society","2009","131","","8378","8379","10.1021/ja9030903","","","","","","","","","","","","","","","","","","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104584","6.2315","0.0012","8.0843","0.0015","10.0707","0.0019","90","","92.451","0.003","90","","506.87","0.17","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H13 Br O2 -","- C10 H13 Br O2 -","- C20 H26 Br2 O4 -","2","1","","Sang Young Yun; Jun-Cheng Zheng; Daesung Lee","Stereoelectronic Effect for the Selectivity in C-H Insertion of Alkylidene Carbenes and Its Application to the Synthesis of Platensimycin","Journal of the American Chemical Society","2009","131","","8413","8415","10.1021/ja903526g","","","0.71073","MoKα","","0.0317","0.0273","","","0.0768","0.0831","","","","","","0.539","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104585","9.623","0.005","9.685","0.005","18.137","0.007","94.26","0.04","90.13","0.04","103.56","0.05","1638.3","1.4","113.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C7 H8 F N O2 S -","- C7 H8 F N O2 S -","- C56 H64 F8 N8 O16 S8 -","8","4","","Masahito Ochiai; Takuya Okada; Norihiro Tada; Akira Yoshimura; Kazunori Miyamoto; Motoo Shiro","Difluoro-λ3-bromane-Induced Hofmann Rearrangement of Sulfonamides: Synthesis of Sulfamoyl Fluorides","Journal of the American Chemical Society","2009","131","","8392","8393","10.1021/ja903544d","","","0.71075","MoKα","","","0.0699","","","","0.1909","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104586","15.33","0.003","15.326","0.003","15.626","0.003","90","","100.6","0.03","90","","3608.6","1.3","150","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H33 B F15 P -","- C38 H33 B F15 P -","- C152 H132 B4 F60 P4 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Terminal Alkyne Activation by Frustrated and Classical Lewis Acid/Phosphine Pairs","Journal of the American Chemical Society","2009","131","","8396","8397","10.1021/ja903650w","","","0.71073","MoKα","","0.0888","0.0439","","","0.0987","0.1181","","","","","","1.015","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104587","12.5867","0.0004","16.6533","0.0005","19.4595","0.0006","90","","100.549","0.001","90","","4010","0.2","296","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[tBu3PH][PhCCAl(C6F5)3]","","","- C41 H34.25 Al Cl0.5 F15 P -","- C41 H33 Al Cl0.5 F15 P -","- C164 H132 Al4 Cl2 F60 P4 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Terminal Alkyne Activation by Frustrated and Classical Lewis Acid/Phosphine Pairs","Journal of the American Chemical Society","2009","131","","8396","8397","10.1021/ja903650w","","","0.71073","MoKα","","0.0645","0.0406","","","0.097","0.1079","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104588","13.0438","0.0005","14.3208","0.0005","14.5274","0.0005","93.602","0.001","111.425","0.001","111.947","0.002","2279.78","0.15","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H32 B Br F15 P -","- C53 H32 B Br F15 P -","- C106 H64 B2 Br2 F30 P2 -","2","1","","Meghan A. Dureen; Douglas W. Stephan","Terminal Alkyne Activation by Frustrated and Classical Lewis Acid/Phosphine Pairs","Journal of the American Chemical Society","2009","131","","8396","8397","10.1021/ja903650w","","","0.71073","MoKα","","0.0757","0.0473","","","0.1097","0.1222","","","","","","1.019","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4104589","11.7981","0.0003","12.7991","0.0004","15.8684","0.0004","90.497","0.001","99.745","0.001","115.519","0.001","2122.25","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C47.5 H27 Al Cl F15 P -","- C47.5 H27 Al Cl F15 P -","- C95 H54 Al2 Cl2 F30 P2 -","2","1","","Meghan A. Dureen; Douglas W. Stephan","Terminal Alkyne Activation by Frustrated and Classical Lewis Acid/Phosphine Pairs","Journal of the American Chemical Society","2009","131","","8396","8397","10.1021/ja903650w","","","0.71073","MoKα","","0.0554","0.0431","","","0.1152","0.1246","","","","","","1.004","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4104590","17.5355","0.0006","11.2841","0.0004","19.4421","0.0007","90","","103.055","0.002","90","","3747.6","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H21 B F15 P -","- C44 H21 B F15 P -","- C176 H84 B4 F60 P4 -","4","1","","Meghan A. Dureen; Douglas W. Stephan","Terminal Alkyne Activation by Frustrated and Classical Lewis Acid/Phosphine Pairs","Journal of the American Chemical Society","2009","131","","8396","8397","10.1021/ja903650w","","","0.71073","MoKα","","0.053","0.036","","","0.0862","0.0941","","","","","","1.037","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4104591","11.3593","0.0011","9.6066","0.0009","12.1731","0.0012","90","","109.728","0.002","90","","1250.4","0.2","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H35 N O3 -","- C30 H35 N O3 -","- C60 H70 N2 O6 -","2","1","","Robert B. Lettan; Chris V. Galliford; Chase C. Woodward; Karl A. Scheidt","Amide Enolate Additions to Acylsilanes: In Situ Generation of Unusual and Stereoselective Homoenolate Equivalents","Journal of the American Chemical Society","2009","131","","8805","8814","10.1021/ja808811u","","","0.71073","MoKα","","0.0427","0.0394","","","0.1054","0.109","","","","","","1.038","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104592","7.4375","0.0005","8.867","0.0006","14.4876","0.001","93.607","0.001","97.431","0.001","113.795","0.001","859.87","0.1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","4-Bromo-Lactam","","","- C17 H14 Br Cl N O2 -","- C17 H16 Br Cl2 N O2 -","- C34 H32 Br2 Cl4 N2 O4 -","2","1","","Robert B. Lettan; Chris V. Galliford; Chase C. Woodward; Karl A. Scheidt","Amide Enolate Additions to Acylsilanes: In Situ Generation of Unusual and Stereoselective Homoenolate Equivalents","Journal of the American Chemical Society","2009","131","","8805","8814","10.1021/ja808811u","","","0.71073","MoKα","","0.0433","0.0354","","","0.0916","0.097","","","","","","0.974","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104593","14.0078","0.0003","5.5406","0.0001","14.8626","0.0003","90","","117.008","0.001","90","","1027.71","0.04","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","N-bezoyl protected lactam","","","- C23 H17 Br2 N O3 -","- C23 H17 Br2 N O3 -","- C46 H34 Br4 N2 O6 -","2","1","","Robert B. Lettan; Chris V. Galliford; Chase C. Woodward; Karl A. Scheidt","Amide Enolate Additions to Acylsilanes: In Situ Generation of Unusual and Stereoselective Homoenolate Equivalents","Journal of the American Chemical Society","2009","131","","8805","8814","10.1021/ja808811u","","","0.71073","MoKα","","0.0437","0.0323","","","0.0712","0.1045","","","","","","1.047","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104594","8.4462","0.0009","22.7597","0.0018","11.106","0.0013","90","","91.095","0.013","90","","2134.5","0.4","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 F3 N5 O2 Pt -","- C18 H24 F3 N5 O2 Pt -","- C72 H96 F12 N20 O8 Pt4 -","4","1","","Ronald Lindner; Christoph Wagner; Dirk Steinborn","Synthesis of Trimethylplatinum(IV) Complexes with N,N- and N,O-Heterocyclic Carbene Ligands and Their Reductive C-C Elimination Reactions","Journal of the American Chemical Society","2009","131","","8861","8874","10.1021/ja901264t","","","0.71073","MoKα","","0.0665","0.0528","","","0.1206","0.13","","","","","","1.144","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104595","8.4637","0.0017","13.213","0.003","14.322","0.003","90","","95.57","0.02","90","","1594.1","0.6","220","2","220","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H24 N2 O2 Pt -","- C13 H24 N2 O2 Pt -","- C52 H96 N8 O8 Pt4 -","4","1","","Ronald Lindner; Christoph Wagner; Dirk Steinborn","Synthesis of Trimethylplatinum(IV) Complexes with N,N- and N,O-Heterocyclic Carbene Ligands and Their Reductive C-C Elimination Reactions","Journal of the American Chemical Society","2009","131","","8861","8874","10.1021/ja901264t","","","0.71073","MoKα","","0.0752","0.0662","","","0.1554","0.1626","","","","","","1.072","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104596","8.4311","0.0007","12.433","0.003","19.0694","0.0016","90","","96.35","0.007","90","","1986.7","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 B F4 N3 O Pt -","- C17 H22 B F4 N3 O Pt -","- C68 H88 B4 F16 N12 O4 Pt4 -","4","1","","Ronald Lindner; Christoph Wagner; Dirk Steinborn","Synthesis of Trimethylplatinum(IV) Complexes with N,N- and N,O-Heterocyclic Carbene Ligands and Their Reductive C-C Elimination Reactions","Journal of the American Chemical Society","2009","131","","8861","8874","10.1021/ja901264t","","","0.71073","MoKα","","0.0534","0.0406","","","0.0975","0.1056","","","","","","1.1","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104597","12.6603","0.0011","13.2237","0.0011","12.9492","0.0009","81.382","0.005","62.819","0.006","76.633","0.005","1873.8","0.3","100","1","100","1","","","","","","","","8","P -1","-P 1","2","","","","- C78 H82 Cl2 F12 N8 O2 P2 Ru2 -","- C78 H82 Cl2 F12 N8 O2 P2 Ru2 -","- C78 H82 Cl2 F12 N8 O2 P2 Ru2 -","1","0.5","","Atanu Kumar Das; Biprajit Sarkar; Jan Fiedler; Stanislav Zális; Ingo Hartenbach; Sabine Strobel; Goutam Kumar Lahiri; Wolfgang Kaim","A Five-Center Redox System: Molecular Coupling of Two Noninnocent Imino-o-benzoquinonato-Ruthenium Functions through a π Acceptor Bridge","Journal of the American Chemical Society","2009","131","","8895","8902","10.1021/ja901746x","","","0.71073","MoKα","","0.1383","0.0656","","","0.1161","0.142","","","","","","1.012","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104598","6.753","0.006","22.44","0.02","10.447","0.009","90","","92.27","0.03","90","","1582","2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 B N8 O2 -","- C13 H19 B N8 O2 -","- C52 H76 B4 N32 O8 -","4","1","","Huaping Li; Yunhua Xu; Corey V. Hoven; Chunzeng Li; Jung Hwa Seo; Guillermo C. Bazan","Molecular Design, Device Function and Surface Potential of Zwitterionic Electron Injection Layers","Journal of the American Chemical Society","2009","131","","8903","8912","10.1021/ja9018836","","","0.71073","MoKα","","0.4703","0.1622","","","0.2701","0.4084","","","","","","0.902","","","","has coordinates","178791","2020-10-21","18:00:00",""
"4104599","29.56","0.003","10.5832","0.001","21.554","0.002","90","","133.29","","90","","4908.1","0.8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H52 F12 O16 Pt4 S4 -","- C36 H52 F12 O16 Pt4 S4 -","- C144 H208 F48 O64 Pt16 S16 -","4","0.5","","Nandita M. Weliange; Endre Szuromi; Paul R. Sharp","Proton-Catalyzed Oxo-Alkene Coupling: 2-Platinaoxetane Formation","Journal of the American Chemical Society","2009","131","","8736","8737","10.1021/ja902180k","","","0.71073","MoKα","","0.0899","0.0663","","","0.1508","0.1617","","","","","","1.069","","","","has coordinates,has disorder","178791","2020-10-21","18:00:00",""
"4104600","9.5049","0.0011","13.4023","0.0014","15.0311","0.0018","81.229","0.005","72.047","0.005","79.572","0.005","1781.9","0.4","98","2","98","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H50 B2 N2 O2 Si4 -","- C30 H50 B2 N2 O2 Si4 -","- C60 H100 B4 N4 O4 Si8 -","2","1","","Holger Braunschweig; Thomas Herbst; Daniela Rais; Sundargopal Ghosh; Thomas Kupfer; Krzysztof Radacki; Andrew G. Crawford; Richard M. Ward; Todd B. Marder; Israel Fernández; Gernot Frenking","Borylene-Based Direct Functionalization of Organic Substrates: Synthesis, Characterization, and Photophysical Properties of Novel π-Conjugated Borirenes","Journal of the American Chemical Society","2009","131","","8989","8999","10.1021/ja902198z","","","0.71073","MoKα","","0.0529","0.0407","","","0.1065","0.1146","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104601","6.6063","0.0009","10.7222","0.0014","14.846","0.002","68.987","0.007","82.634","0.007","77.599","0.007","957.3","0.2","101","2","101","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H58 B2 N2 Si6 -","- C28 H58 B2 N2 Si6 -","- C28 H58 B2 N2 Si6 -","1","0.5","","Holger Braunschweig; Thomas Herbst; Daniela Rais; Sundargopal Ghosh; Thomas Kupfer; Krzysztof Radacki; Andrew G. Crawford; Richard M. Ward; Todd B. Marder; Israel Fernández; Gernot Frenking","Borylene-Based Direct Functionalization of Organic Substrates: Synthesis, Characterization, and Photophysical Properties of Novel π-Conjugated Borirenes","Journal of the American Chemical Society","2009","131","","8989","8999","10.1021/ja902198z","","","0.71073","MoKα","","0.0587","0.039","","","0.0943","0.1053","","","","","","1.081","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104602","9.2297","0.0014","10.7223","0.0017","22.792","0.004","90","","90","","90","","2255.6","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 Br N O -","- C26 H26 Br N O -","- C104 H104 Br4 N4 O4 -","4","1","","Wei Liu; Di Chen; Xia-Zhen Zhu; Xiao-Long Wan; Xue-Long Hou","Highly Diastereo- and Enantioselective Pd-Catalyzed Cyclopropanation of Acyclic Amides with Substituted Allyl Carbonates","Journal of the American Chemical Society","2009","131","","8734","8735","10.1021/ja902410w","","","0.71073","MoKα","","0.0868","0.0386","","","0.0768","0.0874","","","","","","0.927","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104603","9.5787","0.0019","20.267","0.004","19.729","0.004","90","","101.78","0.03","90","","3749.4","1.4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 B2 F30 K N3 -","- C38 B2 F30 K N3 -","- C152 B8 F120 K4 N12 -","4","1","","Arne Bernsdorf; Harald Brand; Robert Hellmann; Martin Köckerling; Axel Schulz; Alexander Villinger; Karsten Voss","Synthesis, Structure, and Bonding of Weakly Coordinating Anions Based on CN Adducts","Journal of the American Chemical Society","2009","131","","8958","8970","10.1021/ja902450b","","","0.71073","MoKα","","0.1376","0.0513","","","0.0949","0.1131","","","","","","0.927","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104604","9.3129","0.0019","12.772","0.003","23.118","0.005","78.87","0.03","83.65","0.03","88.61","0.03","2681.5","1.1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H30 Ag B2 F30 N3 O3 -","- C50 H30 Ag B2 F30 N3 O3 -","- C100 H60 Ag2 B4 F60 N6 O6 -","2","1","","Arne Bernsdorf; Harald Brand; Robert Hellmann; Martin Köckerling; Axel Schulz; Alexander Villinger; Karsten Voss","Synthesis, Structure, and Bonding of Weakly Coordinating Anions Based on CN Adducts","Journal of the American Chemical Society","2009","131","","8958","8970","10.1021/ja902450b","","","0.71073","MoKα","","0.0358","0.031","","","0.0828","0.0853","","","","","","1.053","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104605","9.2529","0.0019","13.331","0.003","23.851","0.005","83.84","0.03","82.06","0.03","79.71","0.03","2856.6","1.1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H32 B2 F30 Li N3 O4 -","- C54 H32 B2 F30 Li N3 O4 -","- C108 H64 B4 F60 Li2 N6 O8 -","2","1","","Arne Bernsdorf; Harald Brand; Robert Hellmann; Martin Köckerling; Axel Schulz; Alexander Villinger; Karsten Voss","Synthesis, Structure, and Bonding of Weakly Coordinating Anions Based on CN Adducts","Journal of the American Chemical Society","2009","131","","8958","8970","10.1021/ja902450b","","","0.71073","MoKα","","0.0819","0.044","","","0.1109","0.1223","","","","","","1.07","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104606","18.433","0.004","19.776","0.004","24.987","0.005","68.15","0.03","81.19","0.03","71.5","0.03","8011","4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C71.82 H28.38 B3 F45 K N3 O6.46 -","- C71.826 H28.383 B3 F45 K N3 O6.4565 -","- C287.304 H113.532 B12 F180 K4 N12 O25.826 -","4","2","","Arne Bernsdorf; Harald Brand; Robert Hellmann; Martin Köckerling; Axel Schulz; Alexander Villinger; Karsten Voss","Synthesis, Structure, and Bonding of Weakly Coordinating Anions Based on CN Adducts","Journal of the American Chemical Society","2009","131","","8958","8970","10.1021/ja902450b","","","0.71073","MoKα","","0.0851","0.0573","","","0.1654","0.1808","","","","","","1.099","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104607","14.916","0.008","18.504","0.009","20.187","0.009","110.387","0.014","105.512","0.011","106.621","0.015","4567","4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C90 H35 B5 F60 N5 O1.5 -","- C90 H35 B5 F60 N5 O1.5 -","- C180 H70 B10 F120 N10 O3 -","2","1","","Arne Bernsdorf; Harald Brand; Robert Hellmann; Martin Köckerling; Axel Schulz; Alexander Villinger; Karsten Voss","Synthesis, Structure, and Bonding of Weakly Coordinating Anions Based on CN Adducts","Journal of the American Chemical Society","2009","131","","8958","8970","10.1021/ja902450b","","","0.71073","MoKα","","0.0562","0.0334","","","0.0734","0.0801","","","","","","1.029","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104608","17.9158","0.0005","18.8215","0.0006","21.0662","0.0006","111.374","0.002","111.849","0.002","112.211","0.002","4938","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C92 H40 B5 F60 K N4 O4 -","- C92 H40 B5 F60 K N4 O4 -","- C184 H80 B10 F120 K2 N8 O8 -","2","1","","Arne Bernsdorf; Harald Brand; Robert Hellmann; Martin Köckerling; Axel Schulz; Alexander Villinger; Karsten Voss","Synthesis, Structure, and Bonding of Weakly Coordinating Anions Based on CN Adducts","Journal of the American Chemical Society","2009","131","","8958","8970","10.1021/ja902450b","","","0.71073","MoKα","","0.0866","0.0464","","","0.1161","0.1292","","","","","","1.051","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104609","6.3338","0.0001","15.4559","0.0003","7.2741","0.0002","90","","108.775","0.001","90","","674.2","0.03","100","2","100","2","","","","","","","synthesized","4","P 1 21 1","P 2yb","4","2-Acetamido-1,6-anhydro-4-O-benzyl-2-deoxy-3-O- [(1R)-1-(methoxycarbonyl)ethyl]-β-D-glucopyranose","","","- C12 H19 N O7 -","- C12 H19 N O7 -","- C24 H38 N2 O14 -","2","1","","Mijoon Lee; Weilie Zhang; Dusan Hesek; Bruce C. Noll; Bill Boggess; Shahriar Mobashery","Bacterial AmpD at the Crossroads of Peptidoglycan Recycling and Manifestation of Antibiotic Resistance","Journal of the American Chemical Society","2009","131","","8742","8743","10.1021/ja9025566","","x-ray","1.54178","CuKα","","0.0264","0.0264","","","0.0684","0.0684","","","","","","1.06","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104610","6.5617","0.0004","7.4785","0.0006","11.1417","0.0007","80.146","0.001","75.201","0.003","89.762","0.003","520.36","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H34 Cl2 Pd2 -","- C22 H34 Cl2 Pd2 -","- C22 H34 Cl2 Pd2 -","1","0.5","","Marc D. Walter; Rebecca A. Moorhouse; Stephanie A. Urbin; Peter S. White; Maurice Brookhart","γ-Agostic Species as Key Intermediates in the Vinyl Addition Polymerization of Norbornene with Cationic (allyl)Pd Catalysts: Synthesis and Mechanistic Insights","Journal of the American Chemical Society","2009","131","","9055","9069","10.1021/ja9025598","","","0.71073","MoKα","","0.042","0.0373","","","0.0892","0.091","","","","","","1.064","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104611","9.867","0.0002","18.4716","0.0003","13.4204","0.0003","90","","92.169","0.001","90","","2444.24","0.08","250","2","250","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H27 F6 N2 Pd Sb -","- C21 H27 F6 N2 Pd Sb -","- C84 H108 F24 N8 Pd4 Sb4 -","4","1","","Marc D. Walter; Rebecca A. Moorhouse; Stephanie A. Urbin; Peter S. White; Maurice Brookhart","γ-Agostic Species as Key Intermediates in the Vinyl Addition Polymerization of Norbornene with Cationic (allyl)Pd Catalysts: Synthesis and Mechanistic Insights","Journal of the American Chemical Society","2009","131","","9055","9069","10.1021/ja9025598","","","0.71073","MoKα","","0.0565","0.0479","","","0.1262","0.1341","","","","","","1.037","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104612","14.5005","0.0004","9.7599","0.0003","15.6128","0.0005","90","","90","","90","","2209.58","0.12","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C20 H29 F6 Pd Sb -","- C20 H29 F6 Pd Sb -","- C80 H116 F24 Pd4 Sb4 -","4","1","","Marc D. Walter; Rebecca A. Moorhouse; Stephanie A. Urbin; Peter S. White; Maurice Brookhart","γ-Agostic Species as Key Intermediates in the Vinyl Addition Polymerization of Norbornene with Cationic (allyl)Pd Catalysts: Synthesis and Mechanistic Insights","Journal of the American Chemical Society","2009","131","","9055","9069","10.1021/ja9025598","","","1.54178","CuKα","","0.0317","0.0291","","","0.0678","0.0691","","","","","","1.07","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104613","11.5854","0.0005","17.7525","0.0006","22.9995","0.0008","90","","90","","90","","4730.3","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C19 H28 Cl3 F6 Pd Sb -","- C19 H28 Cl3 F6 Pd Sb -","- C152 H224 Cl24 F48 Pd8 Sb8 -","8","1","","Marc D. Walter; Rebecca A. Moorhouse; Stephanie A. Urbin; Peter S. White; Maurice Brookhart","γ-Agostic Species as Key Intermediates in the Vinyl Addition Polymerization of Norbornene with Cationic (allyl)Pd Catalysts: Synthesis and Mechanistic Insights","Journal of the American Chemical Society","2009","131","","9055","9069","10.1021/ja9025598","","","1.54178","CuKα","","0.0562","0.0483","","","0.1187","0.1234","","","","","","1.081","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104614","9.2362","0.0004","12.7024","0.0006","20.4499","0.0009","90","","98.137","0.003","90","","2375.07","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H35 F6 Pd Sb -","- C22 H35 F6 Pd Sb -","- C88 H140 F24 Pd4 Sb4 -","4","1","","Marc D. Walter; Rebecca A. Moorhouse; Stephanie A. Urbin; Peter S. White; Maurice Brookhart","γ-Agostic Species as Key Intermediates in the Vinyl Addition Polymerization of Norbornene with Cationic (allyl)Pd Catalysts: Synthesis and Mechanistic Insights","Journal of the American Chemical Society","2009","131","","9055","9069","10.1021/ja9025598","","","1.54178","CuKα","","0.0369","0.0307","","","0.0758","0.0788","","","","","","1.012","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104615","14.2449","0.0004","14.3354","0.0004","20.8288","0.0006","94.688","0.002","94.819","0.002","102.3","0.002","4119.3","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(K-crypt)3[Ge9-(C(CH3)=CHCH2CH3)]0.5[Ge9-(C(CH2CH3)=CHCH3)]0.5 0.4bz","","- C60.25 H116.1 Ge9 K3 N6 O18 -","- C60.254 H116.103 Ge9 K3 N6 O18 -","- C120.508 H232.206 Ge18 K6 N12 O36 -","2","1","","Michael W. Hull; Slavi C. Sevov","Functionalization of Nine-Atom Deltahedral Zintl Ions with Organic Substituents: Detailed Studies of the Reactions","Journal of the American Chemical Society","2009","131","","9026","9037","10.1021/ja9025962","","","0.71073","MoKα","","0.0654","0.0477","","","0.1123","0.1217","","","","","","1.095","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104616","14.9391","0.0003","25.7127","0.0005","19.0906","0.0004","90","","93.89","0.001","90","","7316.3","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(K-crypt)2[Ge9-(CH2CH(CH2)2)2] 3en","","- C50 H86 Ge9 K2 N10 O12 -","- C50 H86 Ge9 K2 N10 O12 -","- C200 H344 Ge36 K8 N40 O48 -","4","1","","Michael W. Hull; Slavi C. Sevov","Functionalization of Nine-Atom Deltahedral Zintl Ions with Organic Substituents: Detailed Studies of the Reactions","Journal of the American Chemical Society","2009","131","","9026","9037","10.1021/ja9025962","","","0.71073","MoKα","","0.0315","0.026","","","0.0627","0.0658","","","","","","1.079","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104617","12.22","0.002","11.51","0.002","15.874","0.003","90","","90","","90","","2232.7","0.7","253","2","253","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C20 H19 Au F6 N5 P -","- C22 H8 Au F6 N3 P -","- C88 H32 Au4 F24 N12 P4 -","4","0.5","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0358","0.0317","","","0.0792","0.0808","","","","","","1.073","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104618","14.153","0.002","23.683","0.004","28.211","0.005","90","","90","","90","","9456","3","301","2","301","2","","","","","","","","6","I 21 21 21","I 2b 2c","24","","","","- C30 H35 Au F6 N3 P -","- C30 H35 Au F6 N3 P -","- C360 H420 Au12 F72 N36 P12 -","12","1.5","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0367","0.0328","","","0.0917","0.0951","","","","","","1.086","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104619","12.332","0.002","7.8178","0.001","25.914","0.004","90","","102.07","0.02","90","","2443.1","0.7","301","2","301","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H21 Au F6 N3 P -","- C26 H21 Au F6 N3 P -","- C104 H84 Au4 F24 N12 P4 -","4","1","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0249","0.0224","","","0.0556","0.0567","","","","","","1.052","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104620","12.803","0.003","14.174","0.003","21.385","0.004","90","","92.98","0.02","90","","3875.5","1.4","301","2","301","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C39 H39 Au Cl2 F6 N3 P -","- C39 H39 Au Cl2 F6 N3 P -","- C156 H156 Au4 Cl8 F24 N12 P4 -","4","1","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0526","0.0382","","","0.095","0.1053","","","","","","1.059","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104621","20.382","0.004","13.797","0.003","17.645","0.003","90","","115.82","0.03","90","","4466.6","1.9","301","2","301","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H36 Au2 F12 N6 P2 -","- C44 H36 Au2 F12 N6 P2 -","- C176 H144 Au8 F48 N24 P8 -","4","0.5","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0572","0.0436","","","0.108","0.1141","","","","","","0.947","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104622","21.34","0.004","13.782","0.003","17.768","0.004","90","","119.07","0.03","90","","4567","2","301","2","301","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H40 Au2 F12 N6 P2 -","- C46 H40 Au2 F12 N6 P2 -","- C184 H160 Au8 F48 N24 P8 -","4","0.5","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0465","0.0313","","","0.0804","0.087","","","","","","0.719","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104623","16.308","0.002","16.308","0.002","25.786","0.003","90","","90","","90","","6857.8","1.4","301","2","301","2","","","","","","","","7","P -4 21 c","P -4 2n","114","","","","- C61 H70 Au2 Cl2 F12 N6 P2 -","- C61 H70 Au2 Cl2 F12 N6 P2 -","- C244 H280 Au8 Cl8 F48 N24 P8 -","4","0.5","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.032","0.0276","","","0.0792","0.0823","","","","","","1.128","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104624","12.17","0.002","21.315","0.004","27.64","0.005","90","","100.98","0.02","90","","7039","2","301","2","301","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 Au2 F12 N6 P2 -","- C62 H72 Au2 F12 N6 P2 -","- C248 H288 Au8 F48 N24 P8 -","4","1","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0939","0.0503","","","0.1177","0.1294","","","","","","0.941","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104625","14.371","0.003","15.173","0.003","16.517","0.003","99.31","0.02","106.95","0.02","113.94","0.02","2982.8","1.4","301","2","301","2","","","","","","","","7","P -1","-P 1","2","","","","- C53 H45 Au2 Cl6 F12 N6 P2 -","- C53 H45 Au2 Cl6 F12 N6 P2 -","- C106 H90 Au4 Cl12 F24 N12 P4 -","2","1","","Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam","Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies","Journal of the American Chemical Society","2009","131","","9076","9085","10.1021/ja9027692","","","0.71073","MoKα","","0.0425","0.0346","","","0.0944","0.1005","","","","","","1.041","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104626","9.3374","0.0002","10.8037","0.0002","17.3964","0.0004","90","","95.327","0.001","90","","1747.34","0.06","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 Cr N6 -","- C20 H12 Cr N6 -","- C80 H48 Cr4 N24 -","4","1","","Juan J. Novoa; Peter W. Stephens; Mahika Weerasekare; William W. Shum; Joel S. Miller","The Tetracyanopyrazinide Dimer Dianion, [TCNP]22-. 2-Electron 8-Center Bonding","Journal of the American Chemical Society","2009","131","","9070","9075","10.1021/ja902790q","powder diffraction","","0.69862","synchrotron","","","","","","","","","","2.355","","","","","","","has coordinates,has Fobs","178792","2020-10-21","18:00:00",""
"4104627","11.859","0.005","18.165","0.007","11.25","0.004","90","","90","","90","","2423.5","1.6","123","2","123","2","","","","","","","","5","P n a 21","P 2c -2n","33","open-1a","","","- C27 H39 B N2 O -","- C27 H39 B N2 O -","- C108 H156 B4 N8 O4 -","4","1","","Oishi, Shunsuke; Yoshimoto, Junichi; Saito, Susumu","Importance of Open Structure of Nonmetal Based Catalyst in Hydrogen Bond Promoted Methanolysis of Activated Amide: Structure Dynamics between Monomer and Dimer Enabling Recombinant Covalent, Dative, and Hydrogen Bonds","Journal of the American Chemical Society","2009","131","25","8748","8749","10.1021/ja9029494","","","0.7107","MoKα","","0.1163","0.0657","","","0.1524","0.1755","","","","","","0.867","","","","has coordinates,has disorder","210885","2020-10-21","18:00:00",""
"4104628","10.165","0.005","10.657","0.005","15.576","0.007","91.12","0.006","96.552","0.006","112.679","0.007","1543","1.3","123","2","123","2","","","","","","","","5","P -1","-P 1","2","closed-1b","","","- C16 H20 B Cl N2 -","- C16 H20 B Cl N2 -","- C64 H80 B4 Cl4 N8 -","4","2","","Oishi, Shunsuke; Yoshimoto, Junichi; Saito, Susumu","Importance of Open Structure of Nonmetal Based Catalyst in Hydrogen Bond Promoted Methanolysis of Activated Amide: Structure Dynamics between Monomer and Dimer Enabling Recombinant Covalent, Dative, and Hydrogen Bonds","Journal of the American Chemical Society","2009","131","25","8748","8749","10.1021/ja9029494","","","0.7107","MoKα","","0.1832","0.0916","","","0.1889","0.2461","","","","","","1.04","","","","has coordinates","210885","2020-10-21","18:00:00",""
"4104629","9.3384","0.0002","18.7078","0.0003","19.0897","0.0003","90","","103.963","0.001","90","","3236.45","0.1","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H48 N3 P Si -","- C33 H48 N3 P Si -","- C132 H192 N12 P4 Si4 -","4","1","","David Gau; Tsuyoshi Kato; Nathalie Saffon-Merceron; Fernando P. Cossío; Antoine Baceiredo","Stable Phosphonium Sila-ylide with Reactivity as a Sila-Wittig Reagent","Journal of the American Chemical Society","2009","131","","8762","8763","10.1021/ja903540b","","","0.71073","MoKα","","0.0806","0.0462","","","0.1033","0.117","","","","","","1.023","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104630","11.4815","0.0007","19.0392","0.0012","18.8348","0.0012","90","","98.605","0.004","90","","4070.9","0.4","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H60 N3 O P Si -","- C43 H60 N3 O P Si -","- C172 H240 N12 O4 P4 Si4 -","4","1","","David Gau; Tsuyoshi Kato; Nathalie Saffon-Merceron; Fernando P. Cossío; Antoine Baceiredo","Stable Phosphonium Sila-ylide with Reactivity as a Sila-Wittig Reagent","Journal of the American Chemical Society","2009","131","","8762","8763","10.1021/ja903540b","","","0.71073","MoKα","","0.1625","0.0565","","","0.1081","0.1433","","","","","","0.925","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104631","11.9212","0.0014","13.8989","0.0016","15.3715","0.0018","86.97","0.002","84.26","0.002","84.825","0.002","2521.4","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","iPr3SiPNb[Np]Ar)3","","","- C48 H81 N3 Nb P Si -","- C48 H81 N3 Nb P Si -","- C96 H162 N6 Nb2 P2 Si2 -","2","1","","Nicholas A. Piro; Christopher C. Cummins","An Unusual P-P Double Bond Formed via Phospha-Wittig Transformation of a Terminal PO Complex","Journal of the American Chemical Society","2009","131","","8764","8765","10.1021/ja903860k","","","0.71073","MoKα","","0.07","0.0428","","","0.093","0.1046","","","","","","1.027","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104632","11.4081","0.001","15.4385","0.0014","16.768","0.0015","65.237","0.001","72.983","0.002","75.312","0.002","2534.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","iPr3SiPPMo(N[tBu]Ar)3","","","- C48 H82 Mo N3 P2 Si -","- C48 H82 Mo N3 P2 Si -","- C96 H164 Mo2 N6 P4 Si2 -","2","1","","Nicholas A. Piro; Christopher C. Cummins","An Unusual P-P Double Bond Formed via Phospha-Wittig Transformation of a Terminal PO Complex","Journal of the American Chemical Society","2009","131","","8764","8765","10.1021/ja903860k","","","0.71073","MoKα","","0.0528","0.0342","","","0.0734","0.0816","","","","","","1.013","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104633","17.287","0.005","8.552","0.002","11.053","0.003","90","","91.16","0.07","90","","1633.7","0.8","128","2","128","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 I N2 -","- C18 H17 I N2 -","- C72 H68 I4 N8 -","4","1","","P. Andrew Evans; Elizabeth A. Clizbe","Unlocking Ylide Reactivity in the Metal-Catalyzed Allylic Substitution Reaction: Stereospecific Construction of Primary Allylic Amines with Aza-Ylides","Journal of the American Chemical Society","2009","131","","8722","8723","10.1021/ja9041302","","","0.71073","MoKα","","0.0808","0.0405","","","0.0677","0.0755","","","","","","0.958","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104634","7.812","0.002","5.9774","0.0019","15.107","0.005","90","","100.213","0.006","90","","694.3","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H15 Br O3 -","- C15 H15 Br O3 -","- C30 H30 Br2 O6 -","2","1","","Ting Yang; Alessandro Ferrali; Filippo Sladojevich; Leonie Campbell; Darren J. Dixon","Brønsted Base/Lewis Acid Cooperative Catalysis in the Enantioselective Conia-Ene Reaction","Journal of the American Chemical Society","2009","131","","9140","9141","10.1021/ja9004859","","","0.71073","MoKα","","0.0446","0.0368","","","0.0812","0.104","","","","","","1.008","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104635","9.5181","0.0017","8.1566","0.0016","20.525","0.004","90","","101.954","0.004","90","","1558.9","0.5","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C15 H15 Br N2 O3 S -","- C15 H15 Br N2 O3 S -","- C60 H60 Br4 N8 O12 S4 -","4","2","","Ting Yang; Alessandro Ferrali; Filippo Sladojevich; Leonie Campbell; Darren J. Dixon","Brønsted Base/Lewis Acid Cooperative Catalysis in the Enantioselective Conia-Ene Reaction","Journal of the American Chemical Society","2009","131","","9140","9141","10.1021/ja9004859","","","0.71073","MoKα","","0.0511","0.0384","","","0.0695","0.073","","","","","","0.895","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104636","9.0724","0.0005","16.39","0.0008","9.9887","0.0005","90","","115.326","0.0005","90","","1342.53","0.12","173.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H34 Mo O2 Si -","- C30 H34 Mo O2 Si -","- C60 H68 Mo2 O4 Si2 -","2","1","","Mako Yabe-Yoshida; Chizuko Kabuto; Kuninobu Kabuto; Eunsang Kwon; Hiroyuki Sakaba","η3-Silapropargyl/Alkynylsilyl Molybdenum Complexes: Synthesis, Structure, and Reactivity toward Methanol","Journal of the American Chemical Society","2009","131","","9138","9139","10.1021/ja9005833","","","0.7107","MoKα","","","0.0307","","","","0.0747","","","","","","0.826","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104637","8.962","0.002","17.016","0.004","17.214","0.005","90","","90","","90","","2625.1","1.1","173.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H32 Mo O2 Si -","- C29 H32 Mo O2 Si -","- C116 H128 Mo4 O8 Si4 -","4","1","","Mako Yabe-Yoshida; Chizuko Kabuto; Kuninobu Kabuto; Eunsang Kwon; Hiroyuki Sakaba","η3-Silapropargyl/Alkynylsilyl Molybdenum Complexes: Synthesis, Structure, and Reactivity toward Methanol","Journal of the American Chemical Society","2009","131","","9138","9139","10.1021/ja9005833","","","0.7107","MoKα","","","0.028","","","","0.0488","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104638","11.3091","0.0008","14.9091","0.0011","18.1392","0.0011","100","0.003","96.53","0.003","99.907","0.003","2934.4","0.4","173.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C31 H38 Mo O3 Si -","- C31 H38 Mo O3 Si -","- C124 H152 Mo4 O12 Si4 -","4","2","","Mako Yabe-Yoshida; Chizuko Kabuto; Kuninobu Kabuto; Eunsang Kwon; Hiroyuki Sakaba","η3-Silapropargyl/Alkynylsilyl Molybdenum Complexes: Synthesis, Structure, and Reactivity toward Methanol","Journal of the American Chemical Society","2009","131","","9138","9139","10.1021/ja9005833","","","0.7107","MoKα","","","0.0543","","","","0.1834","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104639","10.806","0.003","15.449","0.004","16.924","0.004","90","","104.841","0.0009","90","","2731.1","1.2","173.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 Mo O3 Si -","- C30 H36 Mo O3 Si -","- C120 H144 Mo4 O12 Si4 -","4","1","","Mako Yabe-Yoshida; Chizuko Kabuto; Kuninobu Kabuto; Eunsang Kwon; Hiroyuki Sakaba","η3-Silapropargyl/Alkynylsilyl Molybdenum Complexes: Synthesis, Structure, and Reactivity toward Methanol","Journal of the American Chemical Society","2009","131","","9138","9139","10.1021/ja9005833","","","0.7107","MoKα","","","0.0374","","","","0.1111","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104640","42.8434","0.0003","42.8434","0.0003","42.8434","0.0003","90","","90","","90","","78641.5","1","173","2","173","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 H6 O5 Zn -","- C12 H4 O5 Zn -","- C1152 H384 O480 Zn96 -","96","0.5","","Dan Zhao; Daqiang Yuan; Daofeng Sun; Hong-Cai Zhou","Stabilization of Metal-Organic Frameworks with High Surface Areas by the Incorporation of Mesocavities with Microwindows","Journal of the American Chemical Society","2009","131","","9186","9188","10.1021/ja901109t","","","1.54178","CuKα","","0.0509","0.0501","","","0.1588","0.16","","","","","","1.115","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104641","42.7958","0.0006","42.7958","0.0006","42.7958","0.0006","90","","90","","90","","78379.7","1.9","173","2","173","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C12 H6 Cu O5 -","- C12 H4 Cu O5 -","- C1152 H384 Cu96 O480 -","96","0.5","","Dan Zhao; Daqiang Yuan; Daofeng Sun; Hong-Cai Zhou","Stabilization of Metal-Organic Frameworks with High Surface Areas by the Incorporation of Mesocavities with Microwindows","Journal of the American Chemical Society","2009","131","","9186","9188","10.1021/ja901109t","","","1.54178","CuKα","","0.0444","0.0423","","","0.1176","0.1187","","","","","","1.122","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104642","49.112","0.004","49.112","0.004","49.112","0.004","90","","90","","90","","118458","17","100","2","100","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C48 H27 Cu3 N O15 -","- C48 H21 Cu3 N O15 -","- C1536 H672 Cu96 N32 O480 -","32","0.166667","","Dan Zhao; Daqiang Yuan; Daofeng Sun; Hong-Cai Zhou","Stabilization of Metal-Organic Frameworks with High Surface Areas by the Incorporation of Mesocavities with Microwindows","Journal of the American Chemical Society","2009","131","","9186","9188","10.1021/ja901109t","","","0.4428","synchrotronradiation","","0.2442","0.1204","","","0.3423","0.3864","","","","","","1.104","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104643","8.0087","0.0015","11.234","0.003","30.148","0.004","90","","90","","90","","2712.4","1","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 Cl O3 S -","- C13 H15 Cl O3 S -","- C104 H120 Cl8 O24 S8 -","8","2","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","1.54184","Cu-Kα","","0.093","0.083","","","0.22","0.233","","","","","","1.11","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104644","12.0832","0.0003","12.9599","0.0002","20.2495","0.0006","90","","95.4158","0.0008","90","","3156.86","0.13","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H48 O4 S Si2 -","- C27 H48 O4 S Si2 -","- C108 H192 O16 S4 Si8 -","4","2","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","0.71073","MO-Kα","","0.088","0.044","","","0.078","0.089","","","","","","1.004","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4104645","6.4091","0.0005","7.7404","0.0007","12.1635","0.0012","87.745","0.004","86.296","0.005","67.756","0.005","557.27","0.09","150","","150","","","","","","","","","5","P 1","P 1","1","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","1","1","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","0.71073","MO-Kα","","0.05","0.041","","","0.095","0.099","","","","","","1.088","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4104646","7.8455","0.0007","12.3519","0.001","12.7612","0.0012","102.975","0.004","90.66","0.005","106.971","0.004","1148.65","0.18","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C42 H68 O8 S2 Si2 -","2","1","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","0.71073","MO-Kα","","0.08","0.046","","","0.108","0.119","","","","","","1.034","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4104647","10.4714","0.0009","8.9475","0.0006","13.4056","0.0016","90","","111.345","0.005","90","","1169.85","0.19","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C42 H68 O8 S2 Si2 -","2","1","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","0.71073","MO-Kα","","0.058","0.049","","","0.123","0.129","","","","","","1.035","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4104648","10.5248","0.0013","11.1963","0.0006","11.4028","0.0006","90","","90","","90","","1343.69","0.19","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 O3 S -","- C14 H18 O3 S -","- C56 H72 O12 S4 -","4","1","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","0.71073","MO-Kα","","0.043","0.033","","","0.077","0.08","","","","","","1.07","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4104649","8.0121","0.0005","12.8257","0.0019","12.9887","0.0013","90","","94.926","0.007","90","","1329.8","0.3","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 O3 S -","- C14 H18 O3 S -","- C56 H72 O12 S4 -","4","1","","Wan Pyo Hong; Ahmad El-Awa; Philip L. Fuchs","Reagent-Directed Allylic Quadraselection. Chemoselective Anti- and Syn-Lawton SN2' Methylation of Seven-Membered Epoxyvinylsulfones","Journal of the American Chemical Society","2009","131","","9150","9151","10.1021/ja9017557","","","0.71073","MO-Kα","","0.087","0.056","","","0.096","0.105","","","","","","1.094","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4104650","14.709","0.004","15.587","0.003","15.703","0.003","75.603","0.007","65.44","0.008","78.677","0.009","3153.9","1.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","Ce@C82(Ad)-II","Ce@C82(Ad)-II","","- C109 H50 Ce N S2 -","- C109 H50 Ce N S2 -","- C218 H100 Ce2 N2 S4 -","2","1","","Yuta Takano; Motoki Aoyagi; Michio Yamada; Hidefumi Nikawa; Zdenek Slanina; Naomi Mizorogi; Midori O. Ishitsuka; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Tatsuhisa Kato; Shigeru Nagase","Anisotropic Magnetic Behavior of Anionic Ce@C82 Carbene Adducts","Journal of the American Chemical Society","2009","131","","9340","9346","10.1021/ja902106a","","x-ray","0.71075","MoKα","","0.0715","0.0593","","","0.147","0.1539","","","","","","1.023","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104651","15.171","0.002","9.7939","0.0014","19.8","0.003","90","","107.199","0.003","90","","2810.4","0.7","273","2","273","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C63 H56 Al2 N2 O4 S2 -","- C63 H53 Al2 N2 O4 S2 -","- C126 H106 Al4 N4 O8 S4 -","2","0.5","","Masato Ohashi; Osamu Kishizaki; Haruo Ikeda; Sensuke Ogoshi","Ni(0)-Catalyzed Formation of Azaaluminacyclopentenes via Azanickelacyclopentenes: A Unique Nickel/Aluminum Double Transmetalation Reaction","Journal of the American Chemical Society","2009","131","","9160","9161","10.1021/ja903175g","","","0.71075","MoKα","","0.1018","0.0685","","","0.1801","0.2089","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104652","11.6351","0.0004","17.7899","0.0006","12.3513","0.0005","90","","105.272","0.0012","90","","2466.28","0.16","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H54 N2 O4 S2 Zn2 -","- C58 H54 N2 O4 S2 Zn2 -","- C116 H108 N4 O8 S4 Zn4 -","2","0.5","","Masato Ohashi; Osamu Kishizaki; Haruo Ikeda; Sensuke Ogoshi","Ni(0)-Catalyzed Formation of Azaaluminacyclopentenes via Azanickelacyclopentenes: A Unique Nickel/Aluminum Double Transmetalation Reaction","Journal of the American Chemical Society","2009","131","","9160","9161","10.1021/ja903175g","","","0.71075","MoKα","","0.0912","0.0436","","","0.1024","0.1352","","","","","","1.102","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104653","20.745","0.003","20.745","0.003","20.745","0.003","90","","90","","90","","8928","2","190","2","190","2","","","","","","","","6","I 2 3","I 2 2 3","197","","tris(<i>N</i>,<i>N</i>-dimethyl-<i>N'</i>,<i>N''</i>- diphenylguanidinato-κ^2^<i>N'</i>,<i>N''</i>)iridium(IV) hexafluorophosphate","","- C45 H48 F6 Ir N9 P -","- C45 H48 F6 Ir N9 P -","- C360 H384 F48 Ir8 N72 P8 -","8","0.333333","","Jan-Uwe Rohde; Wei-Tsung Lee","Stabilization of Iridium(IV) by Monoanionic Dialkyldiarylguanidinato Ligands","Journal of the American Chemical Society","2009","131","","9162","9163","10.1021/ja9033445","","","0.71073","MoKα","","0.0403","0.0312","","","0.0639","0.0674","","","","","","1.126","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104654","14.6514","0.0003","8.15258","0.00015","27.4291","0.0005","90","","105.491","","90","","3157.3","0.1","93.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H15 Br N2 O3 -","- C17 H15 Br N2 O3 -","- C136 H120 Br8 N16 O24 -","8","4","","Yuko Kato; Makoto Furutachi; Zhihua Chen; Harunobu Mitsunuma; Shigeki Matsunaga; Masakatsu Shibasaki","A Homodinuclear Mn(III)2-Schiff Base Complex for Catalytic Asymmetric 1,4-Additions of Oxindoles to Nitroalkenes","Journal of the American Chemical Society","2009","131","","9168","9169","10.1021/ja903566u","","","1.54187","CuKα","","","0.0524","","","","0.1325","","","","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104655","8.2712","0.0003","22.5001","0.0007","10.3639","0.0005","90","","112.117","0.005","90","","1786.83","0.14","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 F6 N2 O6 S2 -","- C12 H16 F6 N2 O6 S2 -","- C48 H64 F24 N8 O24 S8 -","4","1","","Michael J. Corr; Kirsty F. Gibson; Alan R. Kennedy; John A. Murphy","Amidine Dications: Isolation and [Fe]-Hydrogenase-Related Hydrogenation","Journal of the American Chemical Society","2009","131","","9174","9175","10.1021/ja9035847","","","0.71073","MoKα","","0.0563","0.032","","","0.0699","0.0736","","","","","","0.952","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104656","9.3365","0.0008","14.1848","0.0012","13.2684","0.001","90","","95.355","0.008","90","","1749.5","0.2","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 F6 N3 O6 S2 -","- C11 H15 F6 N3 O6 S2 -","- C44 H60 F24 N12 O24 S8 -","4","1","","Michael J. Corr; Kirsty F. Gibson; Alan R. Kennedy; John A. Murphy","Amidine Dications: Isolation and [Fe]-Hydrogenase-Related Hydrogenation","Journal of the American Chemical Society","2009","131","","9174","9175","10.1021/ja9035847","","","0.71073","MoKα","","0.0474","0.0389","","","0.1072","0.111","","","","","","1.113","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104657","8.0514","0.0002","11.9665","0.0002","29.3775","0.0006","90","","90","","90","","2830.44","0.1","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C35 H35 N O4 -","- C35 H35 N O4 -","- C140 H140 N4 O16 -","4","1","","Noah Z. Burns; Irina N. Krylova; Rami N. Hannoush; Phil S. Baran","Scalable Total Synthesis and Biological Evaluation of Haouamine A and Its Atropisomer","Journal of the American Chemical Society","2009","131","","9172","9173","10.1021/ja903745s","","","1.54178","CuKα","","0.0323","0.0298","","","0.075","0.0769","","","","","","1.056","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104658","7.682","0.0002","16.375","0.0005","10.8454","0.0003","90","","93.972","0.002","90","","1361","0.07","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C35 H35 N O4 -","- C35 H35 N O4 -","- C70 H70 N2 O8 -","2","1","","Noah Z. Burns; Irina N. Krylova; Rami N. Hannoush; Phil S. Baran","Scalable Total Synthesis and Biological Evaluation of Haouamine A and Its Atropisomer","Journal of the American Chemical Society","2009","131","","9172","9173","10.1021/ja903745s","","","1.54178","CuKα","","0.0303","0.0282","","","0.075","0.0772","","","","","","1.021","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104659","10.538","0.007","28.664","0.019","9.364","0.006","90","","108.383","0.01","90","","2684","3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H33 N O4 -","- C35 H33 N O4 -","- C140 H132 N4 O16 -","4","1","","Noah Z. Burns; Irina N. Krylova; Rami N. Hannoush; Phil S. Baran","Scalable Total Synthesis and Biological Evaluation of Haouamine A and Its Atropisomer","Journal of the American Chemical Society","2009","131","","9172","9173","10.1021/ja903745s","","","0.71073","MoKα","","0.0604","0.0474","","","0.1235","0.1348","","","","","","1.044","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104660","17.58","0.002","22.673","0.003","27.942","0.004","113.887","0.002","95.475","0.002","105.025","0.002","9579","2","129","2","129","2","","","","","","","","6","P 1","P 1","1","","","","- C19 H19 Br N2 O2 S -","- C19 H19 Br N2 O2 S -","- C380 H380 Br20 N40 O40 S20 -","20","20","","Florian Kleinbeck; F. Dean Toste","Gold(I)-Catalyzed Enantioselective Ring Expansion of Allenylcyclopropanols","Journal of the American Chemical Society","2009","131","","9178","9179","10.1021/ja904055z","","","0.71073","MoKα","","0.1367","0.0659","","","0.1312","0.1535","","","","","","1.146","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104661","12.29","0.002","16.966","0.003","17.644","0.003","90","","93.728","0.004","90","","3671.2","1.1","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","holkd22","","","- C78 H126 Co2 N6 O2 -","- C78 H126 Co2 N6 O2 -","- C156 H252 Co4 N12 O4 -","2","0.5","","Keying Ding; Aaron W. Pierpont; William W. Brennessel; Gudrun Lukat-Rodgers; Kenton R. Rodgers; Thomas R. Cundari; Eckhard Bill; Patrick L. Holland","Cobalt-Dinitrogen Complexes with Weakened N-N Bonds","Journal of the American Chemical Society","2009","131","","9471","9472","10.1021/ja808783u","","","0.71073","MoKα","","0.0623","0.0385","","","0.0953","0.106","","","","","","1.011","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104662","12.6815","0.0011","12.856","0.0011","24.425","0.002","88.476","0.002","88.613","0.002","63.648","0.001","3566.7","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","holph04","","","- C70 H106 Co2 N6 Na2 -","- C70 H106 Co2 N6 Na2 -","- C140 H212 Co4 N12 Na4 -","2","1","","Keying Ding; Aaron W. Pierpont; William W. Brennessel; Gudrun Lukat-Rodgers; Kenton R. Rodgers; Thomas R. Cundari; Eckhard Bill; Patrick L. Holland","Cobalt-Dinitrogen Complexes with Weakened N-N Bonds","Journal of the American Chemical Society","2009","131","","9471","9472","10.1021/ja808783u","","","0.71073","MoKα","","0.1933","0.0894","","","0.195","0.2217","","","","","","0.967","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104663","22.557","0.004","21.451","0.004","15.372","0.003","90","","100.242","0.002","90","","7320","2","100","0.1","100","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","holkd14","","","- C70 H106 Co2 K2 N6 -","- C70 H106 Co2 K2 N6 -","- C280 H424 Co8 K8 N24 -","4","0.5","","Keying Ding; Aaron W. Pierpont; William W. Brennessel; Gudrun Lukat-Rodgers; Kenton R. Rodgers; Thomas R. Cundari; Eckhard Bill; Patrick L. Holland","Cobalt-Dinitrogen Complexes with Weakened N-N Bonds","Journal of the American Chemical Society","2009","131","","9471","9472","10.1021/ja808783u","","","0.71073","MoKα","","0.0832","0.0454","","","0.097","0.1061","","","","","","1.022","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104664","13.085","0.001","13.9206","0.0011","22.1213","0.0018","75.075","0.001","73.717","0.001","68.526","0.001","3544.8","0.5","193","2","193","2","","","","","","","","4","P -1","-P 1","2","holjs14","","","- C72.5 H112 Fe2 N6 -","- C72.5 H112 Fe2 N6 -","- C145 H224 Fe4 N12 -","2","1","","Keying Ding; Aaron W. Pierpont; William W. Brennessel; Gudrun Lukat-Rodgers; Kenton R. Rodgers; Thomas R. Cundari; Eckhard Bill; Patrick L. Holland","Cobalt-Dinitrogen Complexes with Weakened N-N Bonds","Journal of the American Chemical Society","2009","131","","9471","9472","10.1021/ja808783u","","","0.71073","MoKα","","0.1103","0.075","","","0.1412","0.154","","","","","","1.131","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104665","25.993","0.006","25.993","0.006","31.681","0.007","90","","90","","90","","21405","8","80","2","80","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H81 N24 O42.82 Pd3 -","- C68 H81 N24.668 O45.292 Pd3 -","- C544 H648 N197.344 O362.336 Pd24 -","8","0.5","","Jeremy K. Klosterman; Munetaka Iwamura; Tahei Tahara; Makoto Fujita","Energy Transfer in a Mechanically Trapped Exciplex","Journal of the American Chemical Society","2009","131","","9478","9479","10.1021/ja901674g","","","0.71073","MoKα","","0.1058","0.081","","","0.2147","0.2349","","","","","","1.1","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104666","13.1047","0.0005","13.3397","0.0005","26.0901","0.0009","90","","90.013","0.001","90","","4560.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H73 N6 O12 Tb -","- C38 H73 N6 O12 Tb -","- C152 H292 N24 O48 Tb4 -","4","1","","Morgan L. Cable; James P. Kirby; Dana J. Levine; Micah J. Manary; Harry B. Gray; Adrian Ponce","Detection of Bacterial Spores with Lanthanide-Macrocycle Binary Complexes","Journal of the American Chemical Society","2009","131","","9562","9570","10.1021/ja902291v","","","0.71073","MoKα","","0.09","0.0384","","","0.0639","0.0717","","","","","","1.077","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4104667","13.1473","0.0004","13.2269","0.0004","26.2248","0.0008","90","","90.054","0.001","90","","4560.4","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H72.25 Eu N6 O12 -","- C38 H72.37 Eu N6 O12 -","- C152 H289.48 Eu4 N24 O48 -","4","1","","Morgan L. Cable; James P. Kirby; Dana J. Levine; Micah J. Manary; Harry B. Gray; Adrian Ponce","Detection of Bacterial Spores with Lanthanide-Macrocycle Binary Complexes","Journal of the American Chemical Society","2009","131","","9562","9570","10.1021/ja902291v","","","0.71073","MoKα","","0.1187","0.0437","","","0.075","0.0854","","","","","","1.004","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4104668","13.1742","0.0004","13.186","0.0004","26.113","0.0008","90","","90.372","0.001","90","","4536.1","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H71 Dy N6 O12 -","- C38 H71 Dy N6 O12 -","- C152 H284 Dy4 N24 O48 -","4","1","","Morgan L. Cable; James P. Kirby; Dana J. Levine; Micah J. Manary; Harry B. Gray; Adrian Ponce","Detection of Bacterial Spores with Lanthanide-Macrocycle Binary Complexes","Journal of the American Chemical Society","2009","131","","9562","9570","10.1021/ja902291v","","","0.71073","MoKα","","0.0995","0.0408","","","0.0721","0.0806","","","","","","1.029","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4104669","13.0658","0.0004","13.4504","0.0004","26.1778","0.0007","90","","90.324","0.001","90","","4600.4","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37.75 H71 N6 O11.25 Sm -","- C37.731 H71 N6 O11.269 Sm -","- C150.924 H284 N24 O45.076 Sm4 -","4","1","","Morgan L. Cable; James P. Kirby; Dana J. Levine; Micah J. Manary; Harry B. Gray; Adrian Ponce","Detection of Bacterial Spores with Lanthanide-Macrocycle Binary Complexes","Journal of the American Chemical Society","2009","131","","9562","9570","10.1021/ja902291v","","","0.71073","MoKα","","0.0997","0.0422","","","0.0734","0.0821","","","","","","1.124","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4104670","10.4063","0.0004","15.4367","0.0005","27.923","0.001","90","","90","","90","","4485.5","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H23 B10 Cl Pd S2 -","- C16 H23 B10 Cl Pd S2 -","- C128 H184 B80 Cl8 Pd8 S16 -","8","1","","Alexander M. Spokoyny; Matthew G. Reuter; Charlotte L. Stern; Mark A. Ratner; Tamar Seideman; Chad A. Mirkin","Carborane-Based Pincers: Synthesis and Structure of SeBSe and SBS Pd(II) Complexes","Journal of the American Chemical Society","2009","131","","9482","9483","10.1021/ja902526k","","","0.71073","MoKα","","0.0578","0.0495","","","0.1073","0.1166","","","","","","1.239","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104671","12.4086","0.0003","11.5587","0.0002","16.2997","0.0003","90","","109.173","0.001","90","","2208.15","0.08","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 B10 Cl Pd Se2 -","- C16 H23 B10 Cl Pd Se2 -","- C64 H92 B40 Cl4 Pd4 Se8 -","4","1","","Alexander M. Spokoyny; Matthew G. Reuter; Charlotte L. Stern; Mark A. Ratner; Tamar Seideman; Chad A. Mirkin","Carborane-Based Pincers: Synthesis and Structure of SeBSe and SBS Pd(II) Complexes","Journal of the American Chemical Society","2009","131","","9482","9483","10.1021/ja902526k","","","0.71073","MoKα","","0.0362","0.0253","","","0.0606","0.0642","","","","","","1.143","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104672","13.9886","0.0011","7.4843","0.0004","14.8896","0.001","90","","112.969","0.003","90","","1435.27","0.17","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Ba I5 Nb O16 -","- Ba I5 Nb O16 -","- Ba4 I20 Nb4 O64 -","4","1","","Chuan-Fu Sun; Chun-Li Hu; Xiang Xu; Ji-Bei Ling; Ting Hu; Fang Kong; Xi-Fa Long; Jiang-Gao Mao","BaNbO(IO3)5: A New Polar Material with a Very Large SHG Response","Journal of the American Chemical Society","2009","131","","9486","9487","10.1021/ja9030566","","","0.71073","MoKα","","0.032","0.0317","","","0.0837","0.084","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104673","13.0697","0.0002","13.5755","0.0003","18.2169","0.0003","87.206","0.001","77.527","0.001","64.003","0.001","2832.69","0.09","100","","100","","","","","","","","toluene","6","P -1","-P 1","2","","N-pyridine-tris(triphenylsiloxy)-molybdenum-nitride","","- C66 H58 Mo N2 O3 Si3 -","- C66 H50 Mo N2 O3 Si3 -","- C132 H100 Mo2 N4 O6 Si6 -","2","1","","Martin Bindl; Robert Stade; Eike K. Heilmann; Alexandre Picot; Richard Goddard; Alois Fürstner","Molybdenum Nitride Complexes with Ph3SiO Ligands Are Exceedingly Practical and Tolerant Precatalysts for Alkyne Metathesis and Efficient Nitrogen Transfer Agents","Journal of the American Chemical Society","2009","131","","9468","9470","10.1021/ja903259g","","","0.71073","MoKα","","0.0784","0.0586","","","0.1433","0.1565","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104674","12.2558","0.0001","15.2007","0.0001","23.4902","0.0002","90","","94.7499","0.0005","90","","4361.12","0.06","160","1","160","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H54 Cl2 N2 O Ru -","- C51 H54 Cl2 N2 O Ru -","- C204 H216 Cl8 N8 O4 Ru4 -","4","1","","Michele Gatti; Ludovic Vieille-Petit; Xinjun Luan; Ronaldo Mariz; Emma Drinkel; Anthony Linden; Reto Dorta","Impact of NHC Ligand Conformation and Solvent Concentration on the Ruthenium-Catalyzed Ring-Closing Metathesis Reaction","Journal of the American Chemical Society","2009","131","","9498","9499","10.1021/ja903554v","","","0.71073","MoKα","","0.0538","0.0346","","","0.0771","0.0864","","","","","","1.032","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104675","21.4578","0.0004","11.7706","0.0002","36.694","0.0007","90","","104.011","0.0008","90","","8992.1","0.3","160","1","160","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H58 Cl2 N2 O Ru -","- C51 H58 Cl2 N2 O Ru -","- C408 H464 Cl16 N16 O8 Ru8 -","8","1","","Michele Gatti; Ludovic Vieille-Petit; Xinjun Luan; Ronaldo Mariz; Emma Drinkel; Anthony Linden; Reto Dorta","Impact of NHC Ligand Conformation and Solvent Concentration on the Ruthenium-Catalyzed Ring-Closing Metathesis Reaction","Journal of the American Chemical Society","2009","131","","9498","9499","10.1021/ja903554v","","","0.71073","MoKα","","0.0517","0.0386","","","0.0863","0.0928","","","","","","1.025","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104676","19.153","0.012","6.945","0.004","19.384","0.013","90","","105.996","0.009","90","","2479","3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H36 B Br N2 -","- C26 H36 B Br N2 -","- C104 H144 B4 Br4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.1086","0.0912","","","0.2386","0.257","","","","","","1.099","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104677","7.4883","0.0002","9.4835","0.0001","18.5512","0.0004","77.6015","0.0008","86.8095","0.0012","80.4265","0.0012","1268.5","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H36 B I N2 -","- C26 H36 B I N2 -","- C52 H72 B2 I2 N4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.71069","MoKα","","0.0168","0.0165","","","0.0421","0.0423","","","","","","1.106","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104678","19.222","0.014","6.924","0.005","19.362","0.014","90","","105.271","0.003","90","","2486","3","103.15","","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H38 B Br N2 -","- C26 H38 B Br N2 -","- C104 H152 B4 Br4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0688","0.0647","","","0.1569","0.1599","","","","","","1.111","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104679","17.0118","0.0011","19.5103","0.0011","18.357","0.0011","90","","90","","90","","6092.8","0.6","103","2","103","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H46 B Li N2 O2 -","- C30 H46 B Li N2 O2 -","- C240 H368 B8 Li8 N16 O16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.71069","MoKα","","0.1036","0.0814","","","0.2329","0.2575","","","","","","1.071","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104680","11.5625","0.001","19.603","0.002","28.941","0.002","90","","90","","90","","6559.8","1","103.15","","103","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H52 B Li N2 O2 -","- C34 H52 B Li N2 O2 -","- C272 H416 B8 Li8 N16 O16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0892","0.0874","","","0.1634","0.1642","","","","","","1.223","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104681","12.58","0.003","16.395","0.004","16.766","0.004","90","","90","","90","","3458","1.4","103.15","","103","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C34 H54 B Li N2 O2 -","- C34 H54 B Li N2 O2 -","- C136 H216 B4 Li4 N8 O8 -","4","0.5","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.053","0.0481","","","0.114","0.1169","","","","","","1.139","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104682","11.19","0.011","17.754","0.017","18.41","0.018","90","","99.29","0.006","90","","3609","6","103.15","","103","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H54 B Li N2 O2 -","- C38 H54 B Li N2 O2 -","- C152 H216 B4 Li4 N8 O8 -","4","0.5","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.1072","0.0829","","","0.1853","0.1993","","","","","","1.155","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104683","18.891","0.005","15.567","0.004","16.711","0.005","90","","90","","90","","4914","2","120","2","120","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C26 H37 B N2 -","- C26 H37 B N2 -","- C208 H296 B8 N16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0717","0.0638","","","0.155","0.1633","","","","","","1.067","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104684","19.035","0.009","15.615","0.007","16.723","0.007","90","","90","","90","","4971","4","103.15","","103","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C26 H39 B N2 -","- C26 H39 B N2 -","- C208 H312 B8 N16 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.078","0.069","","","0.1372","0.1411","","","","","","1.276","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104685","10.45","0.006","12.028","0.009","12.684","0.007","69.23","0.05","67","0.05","75.57","0.06","1360.8","1.6","103.15","","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H39 B N2 -","- C30 H39 B N2 -","- C60 H78 B2 N4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0834","0.0629","","","0.1622","0.1813","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104686","7.413","0.005","9.362","0.007","18.458","0.014","77.366","0.018","86.92","0.02","77.526","0.019","1220.4","1.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H39 B N2 -","- C27 H39 B N2 -","- C54 H78 B2 N4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.1329","0.0925","","","0.2483","0.2771","","","","","","1.107","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104687","12.099","0.004","13.535","0.004","18.125","0.006","90","","90","","90","","2968.1","1.6","103.15","","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H43 B N2 -","- C33 H43 B N2 -","- C132 H172 B4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0363","0.0351","","","0.0841","0.0849","","","","","","1.081","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104688","12.205","0.003","13.677","0.003","17.907","0.004","90","","90","","90","","2989.2","1.2","103.15","","103","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H43 B N2 O -","- C33 H43 B N2 O -","- C132 H172 B4 N8 O4 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0419","0.0402","","","0.1034","0.1051","","","","","","1.086","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104689","12.66","0.006","15.48","0.008","14.755","0.007","90","","90.479","0.002","90","","2892","2","103.15","","103","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H41 B N2 O -","- C33 H41 B N2 O -","- C132 H164 B4 N8 O4 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0782","0.0572","","","0.1295","0.1415","","","","","","1.122","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104690","9.294","0.004","11.154","0.004","14.663","0.006","81.83","0.011","82.698","0.011","85.549","0.011","1489.7","1","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H43 B N2 O -","- C33 H43 B N2 O -","- C66 H86 B2 N4 O2 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0825","0.0554","","","0.1337","0.1498","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104691","9.3","0.003","12.312","0.004","25.655","0.008","90","","94.2715","0.0014","90","","2929.4","1.6","103.15","","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H45 B N2 O2 -","- C31 H45 B N2 O2 -","- C124 H180 B4 N8 O8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0641","0.0559","","","0.1134","0.1174","","","","","","1.189","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104692","9.474","0.004","10.358","0.005","16.62","0.009","81.12","0.03","74.61","0.03","71.7","0.02","1488.4","1.3","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H41 B N2 O2 -","- C33 H41 B N2 O2 -","- C66 H82 B2 N4 O4 -","2","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0949","0.0653","","","0.1472","0.1659","","","","","","1.154","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104693","18.522","0.004","15.505","0.004","16.871","0.004","90","","90","","90","","4845","2","103.15","","103","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C26 H37 B N2 O -","- C26 H37 B N2 O -","- C208 H296 B8 N16 O8 -","8","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0796","0.0725","","","0.1389","0.142","","","","","","1.287","","","","has coordinates,has disorder","178792","2020-10-21","18:00:00",""
"4104694","13.378","0.01","12.642","0.009","16.528","0.011","90","","95.338","0.005","90","","2783","3","103.15","","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H41 B N2 -","- C32 H41 B N2 -","- C128 H164 B4 N8 -","4","1","","Yasutomo Segawa; Yuta Suzuki; Makoto Yamashita; Kyoko Nozaki","Chemistry of Boryllithium: Synthesis, Structure, and Reactivity","Journal of the American Chemical Society","2009","131","","9600","9600","10.1021/ja903763a","","","0.7107","MoKα","","0.0633","0.0498","","","0.1071","0.1137","","","","","","1.108","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104695","7.9585","0.0004","7.5081","0.0004","18.6463","0.001","90","","90","","90","","1114.18","0.1","173","2","173","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H16 Cl N -","- C11 H16 Cl N -","- C44 H64 Cl4 N4 -","4","1","","Mark R. Crimmin; Merle Arrowsmith; Anthony G. M. Barrett; Ian J. Casely; Michael S. Hill; Panayiotis A. Procopiou","Intramolecular Hydroamination of Aminoalkenes by Calcium and Magnesium Complexes: A Synthetic and Mechanistic Study","Journal of the American Chemical Society","2009","131","","9670","9685","10.1021/ja9003377","","x-ray","0.71073","MoKα","","0.0795","0.0523","","","0.1162","0.1287","","","","","","1.008","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104696","16.6728","0.0005","13.871","0.0005","18.4067","0.0006","90","","107.207","0.0012","90","","4066.4","0.2","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C29 H18 B F4 N -","- C29 H18 B F4 N -","- C232 H144 B8 F32 N8 -","8","2","","Dongqing Wu; Wojciech Pisula; Volker Enkelmann; Xinliang Feng; Klaus Müllen","Controllable Columnar Organization of Positively Charged Polycyclic Aromatic Hydrocarbons by Choice of Counterions","Journal of the American Chemical Society","2009","131","","9620","9621","10.1021/ja902420u","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104697","17.5903","0.0006","13.7262","0.0005","23.4413","0.0007","90","","100.24","","90","","5569.7","0.3","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C73 H58 N2 O9 S2 -","- C73 H58 N2 O9 S2 -","- C292 H232 N8 O36 S8 -","4","1","","Dongqing Wu; Wojciech Pisula; Volker Enkelmann; Xinliang Feng; Klaus Müllen","Controllable Columnar Organization of Positively Charged Polycyclic Aromatic Hydrocarbons by Choice of Counterions","Journal of the American Chemical Society","2009","131","","9620","9621","10.1021/ja902420u","","","0.71073","MoKα","","0.0527","0.0538","","0.0534","0.0534","0.0534","","","","","","0.7939","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104698","10.1185","0.0006","12.5498","0.0006","19.3212","0.0014","90","","102.632","0.005","90","","2394.1","0.3","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C44 H54 F12 N6 O P2 Ru -","- C44 H54 F12 N6 O P2 Ru -","- C88 H108 F24 N12 O2 P4 Ru2 -","2","1","","Lei Gong; Seann P. Mulcahy; Klaus Harms; Eric Meggers","Chiral-Auxiliary-Mediated Asymmetric Synthesis of Tris-Heteroleptic Ruthenium Polypyridyl Complexes","Journal of the American Chemical Society","2009","131","","9602","9603","10.1021/ja9031665","","","0.71073","MoKα","","0.075","0.053","","","0.1026","0.1098","","","","","","0.952","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104699","15.2056","0.0012","13.6226","0.0006","36.577","0.003","90","","98.17","0.006","90","","7499.7","0.9","100","2","100","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C35 H36 Cl2 F6 N5 O2 P Ru -","- C35 H36 Cl2 F6 N5 O2 P Ru -","- C280 H288 Cl16 F48 N40 O16 P8 Ru8 -","8","2","","Lei Gong; Seann P. Mulcahy; Klaus Harms; Eric Meggers","Chiral-Auxiliary-Mediated Asymmetric Synthesis of Tris-Heteroleptic Ruthenium Polypyridyl Complexes","Journal of the American Chemical Society","2009","131","","9602","9603","10.1021/ja9031665","","","0.71073","MoKα","","0.1488","0.0845","","","0.1774","0.1989","","","","","","0.862","","","","has coordinates","178792","2020-10-21","18:00:00",""
"4104700","11.36","0.011","27.82","0.02","12.44","0.012","90","","109.908","0.01","90","","3697","6","113.1","","","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C55 H59 Cl2 F6 Mn4 N7 O24 S2 -","- C55.54 H48 Cl2 F5.82 Mn4 N6.9 O24.3 S2 -","- C111.08 H96 Cl4 F11.64 Mn8 N13.8 O48.6 S4 -","2","0.5","","Masakazu Morimoto; Hitoshi Miyasaka; Masahiro Yamashita; Masahiro Irie","Coordination Assemblies of [Mn4] Single-Molecule Magnets Linked by Photochromic Ligands: Photochemical Control of the Magnetic Properties","Journal of the American Chemical Society","2009","131","","9823","9835","10.1021/ja903366d","","","0.7107","MoK?","","","0.0959","","","","0.1983","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104701","32.5","0.02","14.219","0.008","14.468","0.009","90","","104.848","0.006","90","","6463","7","93.1","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C53 H56 Cl2 F6 Mn4 N6 O24 S2 -","- C53 H44 Cl2 F6 Mn4 N6 O24 S2 -","- C212 H176 Cl8 F24 Mn16 N24 O96 S8 -","4","0.5","","Masakazu Morimoto; Hitoshi Miyasaka; Masahiro Yamashita; Masahiro Irie","Coordination Assemblies of [Mn4] Single-Molecule Magnets Linked by Photochromic Ligands: Photochemical Control of the Magnetic Properties","Journal of the American Chemical Society","2009","131","","9823","9835","10.1021/ja903366d","","","0.7107","MoKa","","","0.0601","","","","0.1489","","","","","","1.053","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104702","10.6583","0.0004","9.8999","0.0004","12.4412","0.0007","90","","109.694","0.0019","90","","1235.96","0.1","93.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H27 N2 O P -","- C30 H27 N2 O P -","- C60 H54 N4 O2 P2 -","2","1","","Liang Yin; Motomu Kanai; Masakatsu Shibasaki","Nucleophile Generation via Decarboxylation: Asymmetric Construction of Contiguous Trisubstituted and Quaternary Stereocenters through a Cu(I)-Catalyzed Decarboxylative Mannich-Type Reaction","Journal of the American Chemical Society","2009","131","","9610","9611","10.1021/ja9036675","","","1.54187","CuKα","","","0.0581","","","","0.139","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104703","8.3136","0.0002","8.7575","0.0002","10.6508","0.0003","78.823","0.001","67.434","0.001","62.095","0.001","632.72","0.03","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C30 H37 N O6 -","- C30 H37 N O6 -","- C30 H37 N O6 -","1","1","","Mohammad Movassaghi; Meiliana Tjandra; Jun Qi","Total Synthesis of (-)-Himandrine","Journal of the American Chemical Society","2009","131","","9648","9650","10.1021/ja903790y","","","1.54178","CuKα","","0.0273","0.0268","","","0.0704","0.0707","","","","","","1.05","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104704","19.342","0.0002","21.149","0.0002","20.209","0.0002","90","","104.358","0.001","90","","8008.56","0.14","150","2","150","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C76 H93 B F24 N8 Ru -","- C76 H93 B F24 N8 Ru -","- C304 H372 B4 F96 N32 Ru4 -","4","1","","L. Jonas L. Häller; Elena Mas-Marzá; Aitor Moreno; John P. Lowe; Stuart A. Macgregor; Mary F. Mahon; Paul S. Pregosin; Michael K. Whittlesey","Formation of [Ru(NHC)4(η2-O2)H]+: An Unusual, High Frequency Hydride Chemical Shift and Facile, Reversible Coordination of O2","Journal of the American Chemical Society","2009","131","","9618","9619","10.1021/ja9039345","","","0.71073","MoKα","","0.0825","0.0533","","","0.1183","0.1355","","","","","","1.048","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104705","19.049","0.0002","21.272","0.0003","20.325","0.0003","90","","103.628","0.001","90","","8004.03","0.19","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C76 H93 B F24 N8 O2 Ru -","- C76 H92 B F24 N8 O2 Ru -","- C304 H368 B4 F96 N32 O8 Ru4 -","4","1","","L. Jonas L. Häller; Elena Mas-Marzá; Aitor Moreno; John P. Lowe; Stuart A. Macgregor; Mary F. Mahon; Paul S. Pregosin; Michael K. Whittlesey","Formation of [Ru(NHC)4(η2-O2)H]+: An Unusual, High Frequency Hydride Chemical Shift and Facile, Reversible Coordination of O2","Journal of the American Chemical Society","2009","131","","9618","9619","10.1021/ja9039345","","","0.71073","MoKα","","0.134","0.0673","","","0.1492","0.1796","","","","","","1.066","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104706","19.572","0.0003","21.174","0.0003","20.244","0.0003","90","","104.875","0.001","90","","8108.3","0.2","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C77 H93 B F24 N8 O Ru -","- C77 H92 B F24 N8 O Ru -","- C308 H368 B4 F96 N32 O4 Ru4 -","4","1","","L. Jonas L. Häller; Elena Mas-Marzá; Aitor Moreno; John P. Lowe; Stuart A. Macgregor; Mary F. Mahon; Paul S. Pregosin; Michael K. Whittlesey","Formation of [Ru(NHC)4(η2-O2)H]+: An Unusual, High Frequency Hydride Chemical Shift and Facile, Reversible Coordination of O2","Journal of the American Chemical Society","2009","131","","9618","9619","10.1021/ja9039345","","","0.71073","MoKα","","0.1121","0.0664","","","0.1453","0.1739","","","","","","1.057","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104707","6.245","0.003","8.43","0.01","20.3","0.01","90","","90.82","0.03","90","","1068.6","1.5","","","300","","","","","","","","","5","P 1 21 1","P 2yb","4","","Tetrathiafulvalene-2-carboxylic acid_ammonium salt","","- C7 H7 N O2 S4 -","- C7 H7 N O2 S4 -","- C28 H28 N4 O8 S16 -","4","2","","Yuka Kobayashi; Mayu Yoshioka; Kazuhiko Saigo; Daisuke Hashizume; Takashi Ogura","Hydrogen-Bonding-Assisted Self-Doping in Tetrathiafulvalene (TTF) Conductor","Journal of the American Chemical Society","2009","131","","9995","10002","10.1021/ja809425b","powder diffraction","","1.3038","synchrotron","","0.0404","","","","","","","0.0913","4.7024","","","","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104708","21.123","0.003","11.8915","0.0017","14.321","0.002","90","","90","","90","","3597.2","0.9","173","2","173","2","","","","","","","","9","P 21 21 2","P 2 2ab","18","","","","- C68 H67 Br2 Cl2 D10 N2 O4.5 P2 Pd2 -","- C68 Br2 Cl2 D77 N2 O4.5 P2 Pd2 -","- C136 Br4 Cl4 D154 N4 O9 P4 Pd4 -","2","0.5","","Craig P. Butts; Emane Filali; Guy C. Lloyd-Jones; Per-Ola Norrby; David A. Sale; York Schramm","Structure-Based Rationale for Selectivity in the Asymmetric Allylic Alkylation of Cycloalkenyl Esters Employing the Trost 'Standard Ligand' (TSL): Isolation, Analysis and Alkylation of the Monomeric form of the Cationic η3-Cyclohexenyl Complex [(η3-c-C6H9)Pd(TSL)]+","Journal of the American Chemical Society","2009","131","","9945","9957","10.1021/ja8099757","","","0.71073","MoKα","","0.0242","0.0237","","","0.0636","0.0639","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104709","23.061","0.01","13.414","0.01","14.877","0.01","90","","127.395","0.01","90","","3656","4","100","2","100","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H55 Au Cl P2 -","- C39.45 H60 Au Cl P2 -","- C157.8 H240 Au4 Cl4 P8 -","4","0.5","","David V. Partyka; Marlena P. Washington; Thomas G. Gray; James B. Updegraff III; John F. Turner; John D. Protasiewicz","Unusual Phosphorus-Phosphorus Double Bond Contraction upon Mono- and Di-auration of a Diphosphene","Journal of the American Chemical Society","2009","131","","10041","10048","10.1021/ja900813v","","","0.71073","MoKα","","0.0728","0.0556","","","0.1451","0.1629","","","","","","1.281","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104710","8.8414","0.0013","9.2149","0.0014","12.2231","0.0014","99.669","0.002","99.41","0.002","99.408","0.003","949.6","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H58 Au2 Cl2 P2 -","- C36 H58 Au2 Cl2 P2 -","- C36 H58 Au2 Cl2 P2 -","1","0.5","","David V. Partyka; Marlena P. Washington; Thomas G. Gray; James B. Updegraff III; John F. Turner; John D. Protasiewicz","Unusual Phosphorus-Phosphorus Double Bond Contraction upon Mono- and Di-auration of a Diphosphene","Journal of the American Chemical Society","2009","131","","10041","10048","10.1021/ja900813v","","","0.71073","MoKα","","0.0534","0.0461","","","0.1284","0.1376","","","","","","1.121","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104711","18.502","0.0012","18.502","0.0012","36.985","0.005","90","","90","","90","","12661","2","220","2","220","2","","","","","","","","4","I 41/a :2","-I 4ad","88","dimer","dimer","","- C30 H46 N2 O6 -","- C30 H46 N2 O6 -","- C480 H736 N32 O96 -","16","1","","Christoph Riplinger; Joseph P. Y. Kao; Gerald M. Rosen; Velavan Kathirvelu; Gareth R. Eaton; Sandra S. Eaton; Andrei Kutateladze; Frank Neese","Interaction of Radical Pairs Through-Bond and Through-Space: Scope and Limitations of the Point-Dipole Approximation in Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2009","131","","10092","10106","10.1021/ja901150j","","","0.71073","MoKα","","0.0879","0.0542","","","0.109","0.1221","","","","","","1","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104712","8.82","0.0004","10.6264","0.0004","50.784","0.002","90","","90","","90","","4759.7","0.3","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C64 H32 N16 Tb -","- C64 H32 N16 Tb -","- C256 H128 N64 Tb4 -","4","1","","Keiichi Katoh; Yusuke Yoshida; Masahiro Yamashita; Hitoshi Miyasaka; Brian K. Breedlove; Takashi Kajiwara; Shinya Takaishi; Naoto Ishikawa; Hironari Isshiki; Yan Feng Zhang; Tadahiro Komeda; Masakazu Yamagishi; Jun Takeya","Direct Observation of Lanthanide(III)-Phthalocyanine Molecules on Au(111) by Using Scanning Tunneling Microscopy and Scanning Tunneling Spectroscopy and Thin-Film Field-Effect Transistor Properties of Tb(III)- and Dy(III)-Phthalocyanine Molecules","Journal of the American Chemical Society","2009","131","","9967","9976","10.1021/ja902349t","","","0.7107","MoKα","","","0.0608","","","","0.1333","","","","","","1.156","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104713","8.8121","0.0002","10.6081","0.0003","50.7087","0.0015","90","","90","","90","","4740.2","0.2","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C64 H32 Dy N16 -","- C64 H32 Dy N16 -","- C256 H128 Dy4 N64 -","4","1","","Keiichi Katoh; Yusuke Yoshida; Masahiro Yamashita; Hitoshi Miyasaka; Brian K. Breedlove; Takashi Kajiwara; Shinya Takaishi; Naoto Ishikawa; Hironari Isshiki; Yan Feng Zhang; Tadahiro Komeda; Masakazu Yamagishi; Jun Takeya","Direct Observation of Lanthanide(III)-Phthalocyanine Molecules on Au(111) by Using Scanning Tunneling Microscopy and Scanning Tunneling Spectroscopy and Thin-Film Field-Effect Transistor Properties of Tb(III)- and Dy(III)-Phthalocyanine Molecules","Journal of the American Chemical Society","2009","131","","9967","9976","10.1021/ja902349t","","","0.7107","MoKα","","","0.0504","","","","0.1082","","","","","","1.171","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104714","8.835","0.003","10.616","0.004","50.789","0.017","90","","90","","90","","4764","3","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C64 H32 N16 Y -","- C64 H32 N16 Y -","- C256 H128 N64 Y4 -","4","1","","Keiichi Katoh; Yusuke Yoshida; Masahiro Yamashita; Hitoshi Miyasaka; Brian K. Breedlove; Takashi Kajiwara; Shinya Takaishi; Naoto Ishikawa; Hironari Isshiki; Yan Feng Zhang; Tadahiro Komeda; Masakazu Yamagishi; Jun Takeya","Direct Observation of Lanthanide(III)-Phthalocyanine Molecules on Au(111) by Using Scanning Tunneling Microscopy and Scanning Tunneling Spectroscopy and Thin-Film Field-Effect Transistor Properties of Tb(III)- and Dy(III)-Phthalocyanine Molecules","Journal of the American Chemical Society","2009","131","","9967","9976","10.1021/ja902349t","","","0.7107","MoKα","","","0.0721","","","","0.1576","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104715","12.9583","0.0008","10.9835","0.0007","12.9596","0.0007","90","","90","","90","","1844.51","0.19","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","Sodium Mercury Stannide","","","- Hg2.39 Na5 Sn9.61 -","- Hg2.39 Na5 Sn9.61 -","- Hg9.56 Na20 Sn38.44 -","4","0.5","","Siméon Ponou; Sung-Jin Kim; Thomas F. Fässler","Synthesis and Characterization of Na5M2+xSn10-x (x~ 0.5, M = Zn, Hg) - A Doped Tetrahedral Framework Structure","Journal of the American Chemical Society","2009","131","","10246","10252","10.1021/ja902664c","","","0.71073","MoKα","","0.0474","0.0329","","","0.0761","0.0784","","","","","","1.1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104716","12.7717","0.0007","10.8042","0.0007","12.7774","0.0009","90","","90","","90","","1763.13","0.19","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- Na5 Sn9.72 Zn2.28 -","- Na5 Sn9.722 Zn2.278 -","- Na20 Sn38.888 Zn9.112 -","4","0.5","","Siméon Ponou; Sung-Jin Kim; Thomas F. Fässler","Synthesis and Characterization of Na5M2+xSn10-x (x~ 0.5, M = Zn, Hg) - A Doped Tetrahedral Framework Structure","Journal of the American Chemical Society","2009","131","","10246","10252","10.1021/ja902664c","","","0.71073","MoKα","","0.0481","0.0353","","","0.0696","0.0716","","","","","","1.219","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104717","10.48","0.002","13.107","0.003","13.399","0.003","114.54","0.03","92.11","0.03","102.31","0.03","1619.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H16 Cu2 F12 N2 O9 -","- C26 H16 Cu2 F12 N2 O9 -","- C52 H32 Cu4 F24 N4 O18 -","2","1","","Andrew Ozarowski; Iwona B. Szymańska; Tadeusz Muzioł; Julia Jezierska","High-Field EPR and Magnetic Susceptibility Studies on Binuclear and Tetranuclear Copper Trifluoroacetate Complexes. X-ray Structure Determination of Three Tetranuclear Quinoline Adducts of Copper(II) Trifluoroacetate","Journal of the American Chemical Society","2009","131","","10279","10292","10.1021/ja902695y","","","0.71073","MoKα","","0.0723","0.0465","","","0.1104","0.1233","","","","","","0.98","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104718","15.278","0.003","23.227","0.005","34.895","0.007","90","","90","","90","","12383","4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C52.2 H32.8 Cu4 F18 N4 O13 -","- C52.2 H28 Cu4 F18 N4 O13 -","- C417.6 H224 Cu32 F144 N32 O104 -","8","1","","Andrew Ozarowski; Iwona B. Szymańska; Tadeusz Muzioł; Julia Jezierska","High-Field EPR and Magnetic Susceptibility Studies on Binuclear and Tetranuclear Copper Trifluoroacetate Complexes. X-ray Structure Determination of Three Tetranuclear Quinoline Adducts of Copper(II) Trifluoroacetate","Journal of the American Chemical Society","2009","131","","10279","10292","10.1021/ja902695y","","","0.71073","MoKα","","0.1098","0.1049","","","0.2294","0.233","","","","","","1.266","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104719","21.933","0.004","11.176","0.002","23.927","0.005","90","","97.41","0.03","90","","5816","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52.8 H32.8 Cu4 F18 N4 O13 -","- C50 H28 Cu4 F18 N4 O13 -","- C200 H112 Cu16 F72 N16 O52 -","4","1","","Andrew Ozarowski; Iwona B. Szymańska; Tadeusz Muzioł; Julia Jezierska","High-Field EPR and Magnetic Susceptibility Studies on Binuclear and Tetranuclear Copper Trifluoroacetate Complexes. X-ray Structure Determination of Three Tetranuclear Quinoline Adducts of Copper(II) Trifluoroacetate","Journal of the American Chemical Society","2009","131","","10279","10292","10.1021/ja902695y","","","0.71073","MoKα","","0.1085","0.0845","","","0.2032","0.224","","","","","","1.114","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104720","22.2245","0.0002","12.7995","0.0001","23.5634","0.0002","90","","116.462","0.0005","90","","6000.62","0.09","200","","200","","","","","","","","local","7","P 1 21/c 1","-P 2ybc","14","","","","- C70 H60 Cl N O4 P4 Ru -","- C70 H60 Cl N O4 P4 Ru -","- C280 H240 Cl4 N4 O16 P16 Ru4 -","4","1","","Bandar Babgi; Luca Rigamonti; Marie P. Cifuentes; T. Christopher Corkery; Michael D. Randles; Torsten Schwich; Simon Petrie; Robert Stranger; Ayele Teshome; Inge Asselberghs; Koen Clays; Marek Samoc; Mark G. Humphrey","Length-Dependent Convergence and Saturation Behavior of Electrochemical, Linear Optical, Quadratic Nonlinear Optical, and cubic Nonlinear Optical Properties of Dipolar Alkynylruthenium Complexes with Oligo(phenyleneethynylene) Bridges","Journal of the American Chemical Society","2009","131","","10293","10307","10.1021/ja902793z","","","0.71073","MoKα","","0.0565","0.0425","","0.2097","0.1517","0.2097","","","","","","0.7401","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104721","11.249","0.002","17.344","0.003","18.91","0.004","90","","97.509","0.002","90","","3657.8","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H57 Fe Lu N2 O Si2 -","- C35 H57 Fe Lu N2 O Si2 -","- C140 H228 Fe4 Lu4 N8 O4 Si8 -","4","1","","Colin T. Carver; Diego Benitez; Kevin L. Miller; Bryan N. Williams; Ekaterina Tkatchouk; William A. Goddard; Paula L. Diaconescu","Reactions of Group III Biheterocyclic Complexes","Journal of the American Chemical Society","2009","131","","10269","10278","10.1021/ja902794w","","","0.71073","MoKα","","0.0384","0.0269","","","0.0538","0.0577","","","","","","1.031","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104722","16.1271","0.0019","10.5039","0.0013","27.189","0.003","90","","95.68","0.001","90","","4583.1","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H63 Fe N4 Sc Si2 -","- C50 H63 Fe N4 Sc Si2 -","- C200 H252 Fe4 N16 Sc4 Si8 -","4","1","","Colin T. Carver; Diego Benitez; Kevin L. Miller; Bryan N. Williams; Ekaterina Tkatchouk; William A. Goddard; Paula L. Diaconescu","Reactions of Group III Biheterocyclic Complexes","Journal of the American Chemical Society","2009","131","","10269","10278","10.1021/ja902794w","","","0.71073","MoKα","","0.1209","0.0544","","","0.0996","0.1237","","","","","","0.992","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104723","16.782","0.003","13.647","0.002","18.368","0.003","90","","109.108","0.002","90","","3974.9","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H55 Fe N4 Sc Si2 -","- C43 H55 Fe N4 Sc Si2 -","- C172 H220 Fe4 N16 Sc4 Si8 -","4","1","","Colin T. Carver; Diego Benitez; Kevin L. Miller; Bryan N. Williams; Ekaterina Tkatchouk; William A. Goddard; Paula L. Diaconescu","Reactions of Group III Biheterocyclic Complexes","Journal of the American Chemical Society","2009","131","","10269","10278","10.1021/ja902794w","","","0.71073","MoKα","","0.0902","0.0447","","","0.1019","0.1197","","","","","","1.012","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104724","11.5417","0.0017","33.162","0.005","11.1501","0.0017","90","","110.935","0.002","90","","3985.9","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H55 Fe N4 Sc Si2 -","- C42 H55 Fe N4 Sc Si2 -","- C168 H220 Fe4 N16 Sc4 Si8 -","4","1","","Colin T. Carver; Diego Benitez; Kevin L. Miller; Bryan N. Williams; Ekaterina Tkatchouk; William A. Goddard; Paula L. Diaconescu","Reactions of Group III Biheterocyclic Complexes","Journal of the American Chemical Society","2009","131","","10269","10278","10.1021/ja902794w","","","0.71073","MoKα","","0.156","0.0843","","","0.1983","0.2331","","","","","","1.036","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104725","21.624","0.001","18.57","0.001","27.038","0.002","90","","94.238","0.001","90","","10827.6","1.1","153.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C104 H70 B2 F48 Pd8 -","- C104 H58 B2 F48 Pd8 -","- C416 H232 B8 F192 Pd32 -","4","0.5","","Tetsuro Murahashi; Ryou Inoue; Kentaro Usui; Sensuke Ogoshi","Square Tetrapalladium Sheet Sandwich Complexes: Cyclononatetraenyl as a Versatile Face-Capping Ligand","Journal of the American Chemical Society","2009","131","","9888","9889","10.1021/ja903679f","","","0.7107","MoKα","","","0.0861","","","","0.239","","","","","","1.169","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104726","9.265","0.0002","13.355","0.0006","18.832","0.0008","98.802","0.002","98.343","0.002","99.888","0.003","2233.09","0.15","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","(CO)2Rh(Si3C2)","","- C35 H73 O2 Rh Si6 -","- C35 H73 O2 Rh Si6 -","- C70 H146 O4 Rh2 Si12 -","2","1","","Hiroyuki Yasuda; Vladimir Ya. Lee; Akira Sekiguchi","η5-1,2,3-Trisilacyclopentadienyl - A Ligand for Transition Metal Complexes: Rhodium Half-Sandwich and Ruthenium Sandwich","Journal of the American Chemical Society","2009","131","","9902","9903","10.1021/ja9038664","","","0.7107","MoKα","","0.0436","0.0362","","","0.0945","0.0979","","","","","","1.025","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104727","7.3945","0.0003","17.416","0.0006","8.8582","0.0003","90","","90.934","0.001","90","","1140.63","0.07","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H15 N O -","- C13 H15 N O -","- C52 H60 N4 O4 -","4","2","","Alexander M. Taylor; Ryan A. Altman; Stephen L. Buchwald","Palladium-Catalyzed Enantioselective α-Arylation and α-Vinylation of Oxindoles Facilitated by an Axially Chiral P-Stereogenic Ligand","Journal of the American Chemical Society","2009","131","","9900","9901","10.1021/ja903880q","","","1.54178","CuKα","","0.0307","0.0307","","","0.0848","0.0848","","","","","","1.095","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104728","11.989","0.002","16.896","0.003","17.378","0.004","90","","90","","90","","3520.2","1.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- Al3 Br2 Cl12 S8 Sb7 -","- Al3 Br2 Cl12 S8 Sb7 -","- Al12 Br8 Cl48 S32 Sb28 -","4","1","","Qichun Zhang; In Chung; Joon I. Jang; John B. Ketterson; Mercouri G. Kanatzidis","Chalcogenide Chemistry in Ionic Liquids: Nonlinear Optical Wave-Mixing Properties of the Double-Cubane Compound [Sb7S8Br2](AlCl4)3","Journal of the American Chemical Society","2009","131","","9896","9897","10.1021/ja903881m","","","0.71073","MoKα","","0.0396","0.0361","","","0.0847","0.086","","","","","","1.126","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104729","7.9858","0.0001","9.1574","0.0002","9.4523","","62.025","0.006","82.335","0.007","72.873","0.007","583.39","0.04","113.1","","","","","","","","","","","5","P -1","-P 1","2","(NH4)2(adp)[Zn2(ox)3](H2O)3","","","- C12 H24 N2 O19 Zn2 -","- C12 N2 O19 Zn2 -","- C12 N2 O19 Zn2 -","1","0.5","","Masaaki Sadakiyo; Teppei Yamada; Hiroshi Kitagawa","Rational Designs for Highly Proton-Conductive Metal-Organic Frameworks","Journal of the American Chemical Society","2009","131","","9906","9907","10.1021/ja9040016","","","0.7107","MoKα","","","0.0429","","","","0.1779","","","","","","1.337","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104730","9.5265","0.0004","11.6603","0.0005","14.3458","0.0007","76.604","0.001","89.071","0.001","87.194","0.001","1548.32","0.12","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H27 B F15 N2 O P -","- C30 H27 B F15 N2 O P -","- C60 H54 B2 F30 N4 O2 P2 -","2","1","","Edwin Otten; Rebecca C. Neu; Douglas W. Stephan","Complexation of Nitrous Oxide by Frustrated Lewis Pairs","Journal of the American Chemical Society","2009","131","","9918","9919","10.1021/ja904377v","","","0.71073","MoKα","","0.0322","0.0286","","","0.0751","0.0778","","","","","","1.013","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104731","10.3832","0.0008","11.9066","0.0009","14.5601","0.0012","70.621","0.004","76.818","0.004","65.912","0.004","1541.2","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H32 B F10 N2 O P -","- C30 H32 B F10 N2 O P -","- C60 H64 B2 F20 N4 O2 P2 -","2","1","","Edwin Otten; Rebecca C. Neu; Douglas W. Stephan","Complexation of Nitrous Oxide by Frustrated Lewis Pairs","Journal of the American Chemical Society","2009","131","","9918","9919","10.1021/ja904377v","","","0.71073","MoKα","","0.0546","0.0377","","","0.1043","0.1151","","","","","","1.021","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104732","15.2657","0.0016","14.4366","0.0015","14.4993","0.0015","90","","102.217","0.001","90","","3123.1","0.6","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","jonrr09","Tp*Rh(CNneopentyl)(CH2CH2CHCl)Cl","","- C25 H41 B Cl4 N7 Rh -","- C25 H41 B Cl4 N7 Rh -","- C100 H164 B4 Cl16 N28 Rh4 -","4","1","","Andrew J. Vetter; Ryan D. Rieth; William W. Brennessel; William D. Jones","Selective C-H Activation of Haloalkanes using a Rhodiumtrispyrazolylborate Complex","Journal of the American Chemical Society","2009","131","","10742","10752","10.1021/ja9002316","","","0.71073","MoKα","","0.1085","0.0598","","","0.1399","0.1633","","","","","","1.023","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104733","15.9656","0.0014","11.1054","0.001","17.0087","0.0015","90","","92.865","0.002","90","","3011.9","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","JONAV09","Tp*Rh(CNneopentyl)(CH2Cl)Cl","","- C22 H35 B Cl2 N7 Rh -","- C22 H35 B Cl2 N7 Rh -","- C88 H140 B4 Cl8 N28 Rh4 -","4","1","","Andrew J. Vetter; Ryan D. Rieth; William W. Brennessel; William D. Jones","Selective C-H Activation of Haloalkanes using a Rhodiumtrispyrazolylborate Complex","Journal of the American Chemical Society","2009","131","","10742","10752","10.1021/ja9002316","","","0.71073","MoKα","","0.0574","0.0402","","","0.103","0.1075","","","","","","1.036","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104734","9.0905","0.0006","29.6972","0.0017","10.6304","0.0006","90","","109.9","0.001","90","","2698.4","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","JONAV12","Tp*Rh(CNneopentyl)(CHCl2)Cl","","- C22 H34 B Cl3 N7 Rh -","- C22 H34 B Cl3 N7 Rh -","- C88 H136 B4 Cl12 N28 Rh4 -","4","1","","Andrew J. Vetter; Ryan D. Rieth; William W. Brennessel; William D. Jones","Selective C-H Activation of Haloalkanes using a Rhodiumtrispyrazolylborate Complex","Journal of the American Chemical Society","2009","131","","10742","10752","10.1021/ja9002316","","","0.71073","MoKα","","0.0241","0.0228","","","0.0571","0.0576","","","","","","1.129","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104735","8.8138","0.0007","10.9244","0.0009","31.42","0.002","90","","90.574","0.001","90","","3025.1","0.4","100","0.1","100","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","jonav11","Tp*Rh(CNneopentyl)(CH2CH2CH2CH2CH2F)Cl","","- C26 H40 B Cl F N7 Rh -","- C26 H40 B Cl F N7 Rh -","- C104 H160 B4 Cl4 F4 N28 Rh4 -","4","1","","Andrew J. Vetter; Ryan D. Rieth; William W. Brennessel; William D. Jones","Selective C-H Activation of Haloalkanes using a Rhodiumtrispyrazolylborate Complex","Journal of the American Chemical Society","2009","131","","10742","10752","10.1021/ja9002316","","","0.71073","MoKα","","0.0414","0.0389","","","0.1146","0.1162","","","","","","1.023","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104736","11.638","0.003","19.638","0.004","12.081","0.003","90","","105.992","0.003","90","","2654.2","1.1","213","2","213","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C50 H74 Cl3 Li N2 O4 U -","- C50 H75 Cl3 Li N2 O4 U -","- C100 H150 Cl6 Li2 N4 O8 U2 -","2","0.5","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.0538","0.0422","","","0.1139","0.1221","","","","","","1.086","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104737","20.987","0.006","22.191","0.006","11.62","0.003","90","","90","","90","","5412","3","198","2","198","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C50 H74 Cl3 Li2 N2 O4 U -","- C50 H74 Cl3 Li2 N2 O4 U -","- C200 H296 Cl12 Li8 N8 O16 U4 -","4","0.5","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.0839","0.0515","","","0.1283","0.1506","","","","","","1.047","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104738","12.078","0.003","12.843","0.004","18.629","0.005","74.947","0.004","89.875","0.005","62.15","0.004","2443.2","1.2","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H70 Cl2 Li N2 O3 U -","- C46 H70 Cl2 Li N2 O3 U -","- C92 H140 Cl4 Li2 N4 O6 U2 -","2","1","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.0962","0.0636","","","0.152","0.1693","","","","","","1.026","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104739","10.944","0.004","12.922","0.005","18.617","0.009","70.233","0.006","80.328","0.008","67.287","0.006","2283.4","1.6","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H65 Cl2 Li N2 O3 U -","- C46 H65 Cl2 Li N2 O3 U -","- C92 H130 Cl4 Li2 N4 O6 U2 -","2","1","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.1151","0.0717","","","0.1497","0.1682","","","","","","1.084","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104740","13.2626","0.0015","26.292","0.003","17.4106","0.0019","90","","95.039","0.002","90","","6047.6","1.2","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C54 H89 Cl Li2 N2 O9 U -","- C54 H89 Cl Li2 N2 O9 U -","- C216 H356 Cl4 Li8 N8 O36 U4 -","4","1","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.1209","0.0704","","","0.1517","0.173","","","","","","1.013","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104741","11.302","0.003","12.323","0.003","20.387","0.005","96.782","0.004","92.6","0.005","94.776","0.005","2805.4","1.2","208","2","208","2","","","","","","","","7","P -1","-P 1","2","","","","- C50.42 H82.28 Cl1.58 Li N2 O8.43 U -","- C50.43 H82.29 Cl1.57 Li N2 O8.43 U -","- C100.86 H164.58 Cl3.14 Li2 N4 O16.86 U2 -","2","1","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.0973","0.0644","","","0.1441","0.1551","","","","","","1.094","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104742","13.85","0.003","22.875","0.005","14.573","0.003","90","","111.063","0.003","90","","4308.5","1.6","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H60 N2 Na2 O5 U -","- C41 H60 N2 Na2 O5 U -","- C164 H240 N8 Na8 O20 U4 -","4","1","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.0783","0.044","","","0.1003","0.1174","","","","","","1.039","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104743","13.448","0.005","40.927","0.015","14.033","0.005","90","","104.17","0.006","90","","7489","5","206","2","206","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C80 H113 Li N4 O4 U -","- C80 H113 Li N4 O4 U -","- C320 H452 Li4 N16 O16 U4 -","4","1","","Ilia Korobkov; Serge Gorelsky; Sandro Gambarotta","Reduced Uranium Complexes: Synthetic and DFT Study of the Role of π Ligation in the Stabilization of Uranium Species in a Formal Low-Valent State","Journal of the American Chemical Society","2009","131","","10406","10420","10.1021/ja9002525","","","0.71073","MoKα","","0.0917","0.057","","","0.0965","0.1056","","","","","","1.08","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104744","21.889","0.005","10.156","0.005","34.909","0.005","90","0.005","90.715","0.005","90","0.005","7760","4","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H36 N4 O13 Zn2 -","- C33 H20 N2 O10 Zn2 -","- C264 H160 N16 O80 Zn16 -","8","1","","Masakazu Higuchi; Daisuke Tanaka; Satoshi Horike; Hirotoshi Sakamoto; Kohei Nakamura; Yohei Takashima; Yuh Hijikata; Nobuhiro Yanai; Jungeun Kim; Kenichi Kato; Yoshiki Kubota; Masaki Takata; Susumu Kitagawa","Porous Coordination Polymer with Pyridinium Cationic Surface, [Zn2(tpa)2(cpb)]","Journal of the American Chemical Society","2009","131","","10336","10337","10.1021/ja900373v","","","0.71069","MoKα","","0.0944","0.064","","","0.1706","0.1887","","","","","","0.979","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104745","28.7749","0.0003","28.7749","0.0003","24.4911","0.0006","90","","90","","90","","20278.5","0.6","123","2","123","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C93 H124 Ag3 N9 O26 -","- C93 H84 Ag3 N9 O26 -","- C744 H672 Ag24 N72 O208 -","8","1","","Guozan Yuan; Chengfeng Zhu; Yan Liu; Weimin Xuan; Yong Cui","Anion-Driven Conformational Polymorphism in Homochiral Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","10452","10460","10.1021/ja901154p","","","1.54178","CuKα","","0.0665","0.064","","","0.1693","0.1718","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104746","23.6519","0.0003","23.6519","0.0003","39.4914","0.001","90","","90","","120","","19132.2","0.6","123","2","123","2","","","","","","","","7","R 3 2 :H","R 3 2""","155","","","","- C31.5 H40.83 Ag F N3 O5.83 P0.17 -","- C31.5 H40.83 Ag F N3 O5.83 P0.166667 -","- C567 H734.94 Ag18 F18 N54 O104.94 P3 -","18","1","","Guozan Yuan; Chengfeng Zhu; Yan Liu; Weimin Xuan; Yong Cui","Anion-Driven Conformational Polymorphism in Homochiral Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","10452","10460","10.1021/ja901154p","","","1.54178","CuKα","","0.0542","0.0521","","","0.1502","0.1535","","","","","","1.093","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104747","17.4625","0.0002","17.4625","0.0002","24.1023","0.0007","90","","90","","90","","7349.7","0.2","123","2","123","2","","","","","","","","6","P 43 2 2","P 4cw 2c","95","","","","- C28 H34 Ag Cl N2 O9 -","- C28 H28 Ag Cl N2 O9 -","- C224 H224 Ag8 Cl8 N16 O72 -","8","1","","Guozan Yuan; Chengfeng Zhu; Yan Liu; Weimin Xuan; Yong Cui","Anion-Driven Conformational Polymorphism in Homochiral Helical Coordination Polymers","Journal of the American Chemical Society","2009","131","","10452","10460","10.1021/ja901154p","","","1.54178","CuKα","","0.0602","0.0598","","","0.1588","0.1592","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104748","40.497","0.001","17.8762","0.0006","18.4624","0.0007","90","","101.81","0.002","90","","13082.6","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H45 F6 N2 Ni P3 -","- C29 H45 F6 N2 Ni P3 -","- C464 H720 F96 N32 Ni16 P48 -","16","2","","Tobias Steinke; Bryan K. Shaw; Howard Jong; Brian O. Patrick; Michael D. Fryzuk; Jennifer C. Green","Noninnocent Behavior of Ancillary Ligands: Apparent Trans Coupling of a Saturated N-Heterocyclic Carbene Unit with an Ethyl Ligand Mediated by Nickel","Journal of the American Chemical Society","2009","131","","10461","10466","10.1021/ja901346g","","","0.71069","MoKα","","0.0756","0.0423","","","0.0901","0.105","","","","","","1.017","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104749","28.0108","0.001","12.6124","0.0002","18.5089","0.0006","90","","125.62","0.0011","90","","5315.5","0.3","80.1","","80","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H29 Cl N2 O8 -","- C27.265 H29 Cl0.95 N2.02 O8.07 -","- C218.12 H232 Cl7.6 N16.16 O64.56 -","8","1","","K. C. Nicolaou; Xiao-Shui Peng; Ya-Ping Sun; Damien Polet; Bin Zou; Chek Shik Lim; David Y.-K. Chen","Total Synthesis and Biological Evaluation of Cortistatins A and J and Analogues Thereof","Journal of the American Chemical Society","2009","131","","10587","10597","10.1021/ja902939t","","x-ray","0.71075","MoKα","","","0.0818","","","","0.0825","","","","","","3.837","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104750","8.8065","0.0005","9.5799","0.0003","13.8828","0.001","90","","96.494","0.003","90","","1163.71","0.11","93.1","","93","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 O3 -","- C13.21 H16 O2.64 -","- C52.84 H64 O10.56 -","4","1","","K. C. Nicolaou; Xiao-Shui Peng; Ya-Ping Sun; Damien Polet; Bin Zou; Chek Shik Lim; David Y.-K. Chen","Total Synthesis and Biological Evaluation of Cortistatins A and J and Analogues Thereof","Journal of the American Chemical Society","2009","131","","10587","10597","10.1021/ja902939t","","x-ray","0.71075","MoKα","","","0.0978","","","","0.1195","","","","","","8.066","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104751","11.7346","0.0007","9.0075","0.0004","11.8751","0.0008","90","","108.844","0.003","90","","1187.91","0.12","93.1","","93","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 O3 -","- C20.56 H25.32 O4.12 -","- C61.68 H75.96 O12.36 -","3","0.75","","K. C. Nicolaou; Xiao-Shui Peng; Ya-Ping Sun; Damien Polet; Bin Zou; Chek Shik Lim; David Y.-K. Chen","Total Synthesis and Biological Evaluation of Cortistatins A and J and Analogues Thereof","Journal of the American Chemical Society","2009","131","","10587","10597","10.1021/ja902939t","","x-ray","0.71075","MoKα","","","0.0725","","","","0.0778","","","","","","6.121","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104752","9.9221","0.0008","10.2588","0.0005","11.1446","0.0006","74.368","0.011","89.014","0.013","79.68","0.012","1074.19","0.14","113.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H29 N O4 -","- C34.71 H46.9 N1.4 O5.57 -","- C69.42 H93.8 N2.8 O11.14 -","2","1","","K. C. Nicolaou; Xiao-Shui Peng; Ya-Ping Sun; Damien Polet; Bin Zou; Chek Shik Lim; David Y.-K. Chen","Total Synthesis and Biological Evaluation of Cortistatins A and J and Analogues Thereof","Journal of the American Chemical Society","2009","131","","10587","10597","10.1021/ja902939t","","","0.7107","MoKα","","","0.0808","","","","0.0787","","","","","","3.758","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104753","21.2168","0.0005","14.3508","0.0003","12.0623","0.0002","90","","99.802","0.001","90","","3619.09","0.13","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-(Bis-2,6-diisopropylphenyl)-2-(2',3',4',5'-tetraethylphospholyl)- dihydro-1,3,2-diazaphosphole","","- C38 H56 N2 P2 -","- C38 H56 N2 P2 -","- C152 H224 N8 P8 -","4","1","","Sebastian Burck; Kathrin Götz; Martin Kaupp; Martin Nieger; Johannes Weber; Jörn Schmedt auf der Günne; Dietrich Gudat","Diphosphines with Strongly Polarized P-P Bonds: Hybrids between Covalent Molecules and Donor-Acceptor Adducts with Flexible Molecular Structures","Journal of the American Chemical Society","2009","131","","10763","10774","10.1021/ja903156p","","","0.71073","MoKα","","0.0653","0.0377","","","0.0843","0.0915","","","","","","0.952","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104754","9.219","0.0002","20.3427","0.0005","34.1942","0.0009","90","","90","","90","","6412.8","0.3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,3-Dimesityl-2-(2',3',4',5'-tetraethylphospholyl)- 4,5-dimethyl-dihydro-1,3,2-diazaphosphole","","- C34 H48 N2 P2 -","- C34 H48 N2 P2 -","- C272 H384 N16 P16 -","8","1","","Sebastian Burck; Kathrin Götz; Martin Kaupp; Martin Nieger; Johannes Weber; Jörn Schmedt auf der Günne; Dietrich Gudat","Diphosphines with Strongly Polarized P-P Bonds: Hybrids between Covalent Molecules and Donor-Acceptor Adducts with Flexible Molecular Structures","Journal of the American Chemical Society","2009","131","","10763","10774","10.1021/ja903156p","","","0.71073","MoKα","","0.1608","0.0978","","","0.1581","0.1833","","","","","","1.161","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104755","8.6178","0.0002","9.0995","0.0003","17.0578","0.0006","84.3","0.002","77.191","0.002","68.197","0.002","1210.83","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","1,3-Dmesityl-2-(3',4'-dimethyl-phospholyl)‒dihydro-1,3,2-diazaphosphole","","- C26 H32 N2 P2 -","- C26 H32 N2 P2 -","- C52 H64 N4 P4 -","2","1","","Sebastian Burck; Kathrin Götz; Martin Kaupp; Martin Nieger; Johannes Weber; Jörn Schmedt auf der Günne; Dietrich Gudat","Diphosphines with Strongly Polarized P-P Bonds: Hybrids between Covalent Molecules and Donor-Acceptor Adducts with Flexible Molecular Structures","Journal of the American Chemical Society","2009","131","","10763","10774","10.1021/ja903156p","","","0.71073","MoKα","","0.0469","0.0347","","","0.095","0.1005","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104756","8.5577","0.0003","26.0553","0.0011","13.8925","0.0007","90","","95.64","0.002","90","","3082.7","0.2","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Bis(2',6'-dimethylphenyl)-2-2-(2',4'-dimethyl-3',5'-diphenylphospholyl)- dihydro-1,3,2-diazaphosphole","","- C36 H36 N2 P2 -","- C36 H36 N2 P2 -","- C144 H144 N8 P8 -","4","1","","Sebastian Burck; Kathrin Götz; Martin Kaupp; Martin Nieger; Johannes Weber; Jörn Schmedt auf der Günne; Dietrich Gudat","Diphosphines with Strongly Polarized P-P Bonds: Hybrids between Covalent Molecules and Donor-Acceptor Adducts with Flexible Molecular Structures","Journal of the American Chemical Society","2009","131","","10763","10774","10.1021/ja903156p","","","0.71073","MoKα","","0.1087","0.0481","","","0.0818","0.0931","","","","","","0.903","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104757","10.6195","0.0003","19.4211","0.0006","20.5732","0.0008","108.629","0.002","95.211","0.002","104.049","0.002","3834.5","0.2","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","1,3-(Bis-2,6-diisopropylphenyl)-2-(2',3',4',5'-tetraethylphospholyl)- 4,5-dimethyl-dihydro-1,3,2-diazaphosphole","","- C40 H60 N2 P2 -","- C40 H60 N2 P2 -","- C160 H240 N8 P8 -","4","2","","Sebastian Burck; Kathrin Götz; Martin Kaupp; Martin Nieger; Johannes Weber; Jörn Schmedt auf der Günne; Dietrich Gudat","Diphosphines with Strongly Polarized P-P Bonds: Hybrids between Covalent Molecules and Donor-Acceptor Adducts with Flexible Molecular Structures","Journal of the American Chemical Society","2009","131","","10763","10774","10.1021/ja903156p","","","0.71073","MoKα","","0.1418","0.0528","","","0.0898","0.1062","","","","","","0.849","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104758","17.238","0.002","14.184","0.002","4.1973","0.0006","90","","90","","90","","1026.3","0.2","100","2","100","2","","","","","","","","2","P m n 21","P 2ac -2","31","","triindeno[1,2,3-bc:1',2',3'-ef:1'',2'',3''-kl]corannulene","","- C38 H16 -","- C38 H16 -","- C76 H32 -","2","0.5","","Brian D. Steinberg; Edward A. Jackson; Alexander S. Filatov; Atsushi Wakamiya; Marina A. Petrukhina; Lawrence T. Scott","Aromatic π-Systems More Curved Than C60. The Complete Family of All Indenocorannulenes Synthesized by Iterative Microwave-Assisted Intramolecular Arylations","Journal of the American Chemical Society","2009","131","","10537","10545","10.1021/ja9031852","","","0.71073","MoKα","","0.0639","0.0493","","","0.1158","0.1241","","","","","","1.059","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104759","3.8711","0.0005","31.278","0.004","12.2437","0.0016","90","","93.423","0.002","90","","1479.8","0.3","173","2","173","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","monoindeno[1,2,3-bc]corannulene","","- C26 H12 -","- C26 H12 -","- C104 H48 -","4","1","","Brian D. Steinberg; Edward A. Jackson; Alexander S. Filatov; Atsushi Wakamiya; Marina A. Petrukhina; Lawrence T. Scott","Aromatic π-Systems More Curved Than C60. The Complete Family of All Indenocorannulenes Synthesized by Iterative Microwave-Assisted Intramolecular Arylations","Journal of the American Chemical Society","2009","131","","10537","10545","10.1021/ja9031852","","","0.71073","MoKα","","0.1492","0.0733","","","0.1206","0.1466","","","","","","0.994","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104760","22.801","0.011","19.793","0.01","3.9073","0.0019","90","","90","","90","","1763.4","1.5","100","2","100","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","diindeno[1,2,3-bc:1',2',3'-ef]corannulene","","- C32 H14 -","- C32 H14 -","- C128 H56 -","4","0.5","","Brian D. Steinberg; Edward A. Jackson; Alexander S. Filatov; Atsushi Wakamiya; Marina A. Petrukhina; Lawrence T. Scott","Aromatic π-Systems More Curved Than C60. The Complete Family of All Indenocorannulenes Synthesized by Iterative Microwave-Assisted Intramolecular Arylations","Journal of the American Chemical Society","2009","131","","10537","10545","10.1021/ja9031852","","","0.71073","Mo-Kα","","0.1779","0.0711","","","0.0956","0.1224","","","","","","1.013","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104761","26.018","0.005","9.2556","0.0016","7.6909","0.0013","90","","90","","90","","1852.1","0.6","193","2","193","2","","","","","","","","2","C m c 21","C 2c -2","36","","diindeno[1,2,3-bc:1',2',3'-hi]corannulene","","- C32 H14 -","- C32 H14 -","- C128 H56 -","4","0.5","","Brian D. Steinberg; Edward A. Jackson; Alexander S. Filatov; Atsushi Wakamiya; Marina A. Petrukhina; Lawrence T. Scott","Aromatic π-Systems More Curved Than C60. The Complete Family of All Indenocorannulenes Synthesized by Iterative Microwave-Assisted Intramolecular Arylations","Journal of the American Chemical Society","2009","131","","10537","10545","10.1021/ja9031852","","","0.71073","MoKα","","0.0417","0.0381","","","0.0884","0.0905","","","","","","1.007","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104762","25.578","0.004","4.0865","0.0006","42.62","0.007","90","","101.367","0.003","90","","4367.5","1.2","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","triindeno[1,2,3-bc:1',2',3'-ef:1'',2'',3''-hi]corannulene","","- C38.25 H16 S0.5 -","- C38.25 H16 S0.5 -","- C306 H128 S4 -","8","2","","Brian D. Steinberg; Edward A. Jackson; Alexander S. Filatov; Atsushi Wakamiya; Marina A. Petrukhina; Lawrence T. Scott","Aromatic π-Systems More Curved Than C60. The Complete Family of All Indenocorannulenes Synthesized by Iterative Microwave-Assisted Intramolecular Arylations","Journal of the American Chemical Society","2009","131","","10537","10545","10.1021/ja9031852","","","0.71073","MoKα","","0.1126","0.0662","","","0.1538","0.1834","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104763","20.195","0.003","20.195","0.003","20.195","0.003","90","","90","","90","","8236","2","293","2","293","2","","","","","","","","5","P m -3 n","-P 4n 2 3","223","","","","- C65 H24 In8 N36 O50 -","- C64.248 H21.912 In8 N34.13 O49.416 -","- C128.496 H43.824 In16 N68.26 O98.832 -","2","0.0416667","","Dorina F. Sava; Victor Ch. Kravtsov; Juergen Eckert; Jarrod F. Eubank; Farid Nouar; Mohamed Eddaoudi","Exceptional Stability and High Hydrogen Uptake in Hydrogen-Bonded Metal-Organic Cubes Possessing ACO and AST Zeolite-like Topologies","Journal of the American Chemical Society","2009","131","","10394","10396","10.1021/ja903287v","","","0.71073","MoKα","","0.1274","0.0442","","","0.0779","0.0868","","","","","","1.001","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104764","22.418","0.006","22.418","0.006","22.418","0.006","90","","90","","90","","11267","5","298","2","298","2","","","","","","","","5","F m -3","-F 2 2 3","202","","","","- C60 H50 In8 N45 O48 -","- C60 H32 In8 N42.28 O48 -","- C240 H128 In32 N169.12 O192 -","4","0.0416667","","Dorina F. Sava; Victor Ch. Kravtsov; Juergen Eckert; Jarrod F. Eubank; Farid Nouar; Mohamed Eddaoudi","Exceptional Stability and High Hydrogen Uptake in Hydrogen-Bonded Metal-Organic Cubes Possessing ACO and AST Zeolite-like Topologies","Journal of the American Chemical Society","2009","131","","10394","10396","10.1021/ja903287v","","","0.71073","MoKα","","0.1054","0.0611","","","0.1503","0.1665","","","","","","1","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104765","8.168","0.009","10.273","0.012","15.11","0.04","74.76","0.13","80.9","0.2","73.56","0.08","1168","4","298","","","","","","","","","","Local laboratory","5","P -1","-P 1","2","","","","- C24 H20 N4 O4 Ru -","- C24 H20 N4 O4 Ru -","- C48 H40 N8 O8 Ru2 -","2","1","","Lele Duan; Andreas Fischer; Yunhua Xu; Licheng Sun","Isolated Seven-Coordinate Ru(IV) Dimer Complex with [HOHOH]-Bridging Ligand as an Intermediate for Catalytic Water Oxidation","Journal of the American Chemical Society","2009","131","","10397","10399","10.1021/ja9034686","","","0.71073","MoKα","","0.0824","0.06","","","0.132","0.1445","","","","","","1.136","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104766","8.214","0.0006","13.284","0.004","14.513","0.004","79.7","0.02","87.324","0.013","83.863","0.015","1548.5","0.7","173","","","","","","","","","","Local laboratory","7","P -1","-P 1","2","","","","- C52 H53 F18 N10 O12 P3 Ru2 -","- C52 H53 F18 N10 O12 P3 Ru2 -","- C52 H53 F18 N10 O12 P3 Ru2 -","1","0.5","","Lele Duan; Andreas Fischer; Yunhua Xu; Licheng Sun","Isolated Seven-Coordinate Ru(IV) Dimer Complex with [HOHOH]-Bridging Ligand as an Intermediate for Catalytic Water Oxidation","Journal of the American Chemical Society","2009","131","","10397","10399","10.1021/ja9034686","","","0.71073","MoKα","","0.063","0.042","","","0.0954","0.1037","","","","","","1.053","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104767","9.7889","0.0005","17.493","0.0009","14.3574","0.0008","90","","97.52","0.0015","90","","2437.4","0.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H78 Ni2 O2 P2 -","- C48 H78 Ni2 O2 P2 -","- C96 H156 Ni4 O4 P4 -","2","0.5","","Sensuke Ogoshi; Toshifumi Haba; Masato Ohashi","Nickel-Catalyzed Direct Conjugate Addition of Simple Alkenes to Enones","Journal of the American Chemical Society","2009","131","","10350","10351","10.1021/ja903510u","","","0.71074","MoKα","","0.0694","0.0374","","","0.0934","0.1109","","","","","","1.062","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104768","10.2869","0.0002","18.8067","0.0002","14.3938","0.0006","90","","93.17","0.003","90","","2780.4","0.13","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H90 Ni2 O2 P2 -","- C60 H90 Ni2 O2 P2 -","- C120 H180 Ni4 O4 P4 -","2","0.5","","Sensuke Ogoshi; Toshifumi Haba; Masato Ohashi","Nickel-Catalyzed Direct Conjugate Addition of Simple Alkenes to Enones","Journal of the American Chemical Society","2009","131","","10350","10351","10.1021/ja903510u","","","0.71069","MoKα","","0.0782","0.0474","","","0.093","0.1013","","","","","","0.978","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104769","6.6925","0.0006","11.4684","0.001","20.9665","0.0018","90","","90","","90","","1609.2","0.2","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","","Mathieu Branca; Sébastien Pena; Régis Guillot; Didier Gori; Valérie Alezra; Cyrille Kouklovsky","Memory of Chirality of Tertiary Aromatic Amides: A Simple and Efficient Method for the Enantioselective Synthesis of Quaternary α-Amino Acids","Journal of the American Chemical Society","2009","131","","10711","10718","10.1021/ja9039604","","x-ray","0.71073","MoKα","","0.0426","0.0382","","","0.0952","0.0989","","","","","","1.096","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104770","7.866","0.0003","6.7057","0.0002","14.2336","0.0005","90","","105.39","0.001","90","","723.86","0.04","100","1","100","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H17 N O3 -","- C17 H17 N O3 -","- C34 H34 N2 O6 -","2","1","","Mathieu Branca; Sébastien Pena; Régis Guillot; Didier Gori; Valérie Alezra; Cyrille Kouklovsky","Memory of Chirality of Tertiary Aromatic Amides: A Simple and Efficient Method for the Enantioselective Synthesis of Quaternary α-Amino Acids","Journal of the American Chemical Society","2009","131","","10711","10718","10.1021/ja9039604","","x-ray","0.71073","MoKα","","0.0502","0.044","","","0.1144","0.1218","","","","","","1.063","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104771","7.713","0.005","14.863","0.005","31.233","0.005","90","","90","","90","","3580","3","100","1","100","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C23 H21 N O3 -","- C23 H21 N O3 -","- C184 H168 N8 O24 -","8","1","","Mathieu Branca; Sébastien Pena; Régis Guillot; Didier Gori; Valérie Alezra; Cyrille Kouklovsky","Memory of Chirality of Tertiary Aromatic Amides: A Simple and Efficient Method for the Enantioselective Synthesis of Quaternary α-Amino Acids","Journal of the American Chemical Society","2009","131","","10711","10718","10.1021/ja9039604","","x-ray","0.71069","MoKα","","0.0969","0.0781","","","0.192","0.1995","","","","","","1.172","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104772","7.6288","0.0003","19.7515","0.001","24.028","0.001","75.136","0.002","82.376","0.002","88.422","0.002","3468.4","0.3","100","1","100","1","","","","","","","","5","P 1","P 1","1","","","","- C19 H21 N O3 S -","- C19 H21 N O3 S -","- C152 H168 N8 O24 S8 -","8","8","","Mathieu Branca; Sébastien Pena; Régis Guillot; Didier Gori; Valérie Alezra; Cyrille Kouklovsky","Memory of Chirality of Tertiary Aromatic Amides: A Simple and Efficient Method for the Enantioselective Synthesis of Quaternary α-Amino Acids","Journal of the American Chemical Society","2009","131","","10711","10718","10.1021/ja9039604","","x-ray","0.71073","MoKα","","0.0617","0.0511","","","0.1227","0.1286","","","","","","1.043","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104773","10.7125","0.0015","7.4605","0.0009","11.5388","0.0017","90","","91.512","0.004","90","","921.9","0.2","100","1","100","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H23 N O3 S -","- C20 H23 N O3 S -","- C40 H46 N2 O6 S2 -","2","1","","Mathieu Branca; Sébastien Pena; Régis Guillot; Didier Gori; Valérie Alezra; Cyrille Kouklovsky","Memory of Chirality of Tertiary Aromatic Amides: A Simple and Efficient Method for the Enantioselective Synthesis of Quaternary α-Amino Acids","Journal of the American Chemical Society","2009","131","","10711","10718","10.1021/ja9039604","","x-ray","0.71073","MoKα","","0.0452","0.0395","","","0.0983","0.1021","","","","","","1.035","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104774","13.8645","0.0003","16.9859","0.0003","20.7527","0.0004","97.901","0.001","99.315","0.001","92.528","0.001","4766.03","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C114 H112 B2 Fe2 N4 P6 -","- C114 H112 B2 Fe2 N4 P6 -","- C228 H224 B4 Fe4 N8 P12 -","2","1","","Caroline T. Saouma; Peter Müller; Jonas C. Peters","Characterization of Structurally Unusual Diiron NxHy Complexes","Journal of the American Chemical Society","2009","131","","10358","10359","10.1021/ja903967z","","","1.54178","CuKα","","0.0626","0.0558","","","0.1503","0.1557","","","","","","1.059","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104775","15.914","0.003","27.596","0.004","25.488","0.004","90","","97.306","0.003","90","","11103","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C110 H202 B2 Fe2 N4 O3 P6 -","- C110 H202 B2 Fe2 N4 O3 P6 -","- C440 H808 B8 Fe8 N16 O12 P24 -","4","0.5","","Caroline T. Saouma; Peter Müller; Jonas C. Peters","Characterization of Structurally Unusual Diiron NxHy Complexes","Journal of the American Chemical Society","2009","131","","10358","10359","10.1021/ja903967z","","","0.71073","MoKα","","0.1471","0.1303","","","0.3042","0.312","","","","","","1.265","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104776","16.47","0.002","27.384","0.004","25.154","0.005","90","","93.697","0.002","90","","11321","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C110 H204 B2 Fe2 N4 O4 P6 -","- C110 H204 B2 Fe2 N4 O4 P6 -","- C440 H816 B8 Fe8 N16 O16 P24 -","4","0.5","","Caroline T. Saouma; Peter Müller; Jonas C. Peters","Characterization of Structurally Unusual Diiron NxHy Complexes","Journal of the American Chemical Society","2009","131","","10358","10359","10.1021/ja903967z","","","0.71073","MoKα","","0.1417","0.0717","","","0.152","0.2045","","","","","","1.203","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104777","13.57","0.0017","13.8818","0.0019","28.049","0.005","95.483","0.004","95.884","0.004","118.639","0.002","4549.1","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H104 B2 Fe2 N4 P6 -","- C108 H104 B2 Fe2 N4 P6 -","- C216 H208 B4 Fe4 N8 P12 -","2","1","","Caroline T. Saouma; Peter Müller; Jonas C. Peters","Characterization of Structurally Unusual Diiron NxHy Complexes","Journal of the American Chemical Society","2009","131","","10358","10359","10.1021/ja903967z","","","0.71073","MoKα","","0.1172","0.0676","","","0.1718","0.205","","","","","","1.037","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104778","16.4689","0.0004","14.2851","0.0003","37.7006","0.0008","90","","101.267","0.001","90","","8698.5","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C105 H114 B2 Fe2 N2 P6 -","- C105 H114.001 B2 Fe2 N2.001 P6 -","- C420 H456.004 B8 Fe8 N8.004 P24 -","4","1","","Caroline T. Saouma; Peter Müller; Jonas C. Peters","Characterization of Structurally Unusual Diiron NxHy Complexes","Journal of the American Chemical Society","2009","131","","10358","10359","10.1021/ja903967z","","","1.54178","CuKα","","0.0642","0.0542","","","0.1292","0.1354","","","","","","1.058","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104779","10.7606","0.0018","14.085","0.002","21.094","0.004","90.729","0.002","90.393","0.002","95.057","0.002","3184.3","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H40 F6 Mo N2 O -","- C32 H40 F6 Mo N2 O -","- C128 H160 F24 Mo4 N8 O4 -","4","2","","Yeon-Ju Lee; Richard R. Schrock; Amir H. Hoveyda","Endo-Selective Enyne Ring-Closing Metathesis Promoted by Stereogenic-at-Mo Monoalkoxide and Monoaryloxide Complexes. Efficient Synthesis of Cyclic Dienes Not Accessible through Reactions with Ru Carbenes","Journal of the American Chemical Society","2009","131","","10652","10661","10.1021/ja904098h","","","0.71073","MoKα","","0.0716","0.051","","","0.1033","0.1109","","","","","","1.028","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104780","43.321","0.007","12.988","0.002","14.383","0.002","90","","106.856","0.002","90","","7745","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H50 Mo N2 O -","- C46 H50 Mo N2 O -","- C368 H400 Mo8 N16 O8 -","8","1","","Yeon-Ju Lee; Richard R. Schrock; Amir H. Hoveyda","Endo-Selective Enyne Ring-Closing Metathesis Promoted by Stereogenic-at-Mo Monoalkoxide and Monoaryloxide Complexes. Efficient Synthesis of Cyclic Dienes Not Accessible through Reactions with Ru Carbenes","Journal of the American Chemical Society","2009","131","","10652","10661","10.1021/ja904098h","","","0.71073","MoKα","","0.048","0.037","","","0.0796","0.0842","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104781","12.414","0.003","27.088","0.006","13.856","0.004","90","","103.893","0.004","90","","4523","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H57.96 Br0.04 Mo N2 O -","- C58 H57.962 Br0.038 Mo N2 O -","- C232 H231.848 Br0.152 Mo4 N8 O4 -","4","1","","Yeon-Ju Lee; Richard R. Schrock; Amir H. Hoveyda","Endo-Selective Enyne Ring-Closing Metathesis Promoted by Stereogenic-at-Mo Monoalkoxide and Monoaryloxide Complexes. Efficient Synthesis of Cyclic Dienes Not Accessible through Reactions with Ru Carbenes","Journal of the American Chemical Society","2009","131","","10652","10661","10.1021/ja904098h","","","0.71073","MoKα","","0.1359","0.0735","","","0.1238","0.1454","","","","","","1.057","","","","has coordinates,has disorder","178793","2020-10-21","18:00:00",""
"4104782","9.2507","0.0019","8.0261","0.0016","22.16","0.004","90","","101.61","0.03","90","","1611.7","0.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H21 N O2 S -","- C17 H21 N O2 S -","- C68 H84 N4 O8 S4 -","4","2","","Yeon-Ju Lee; Richard R. Schrock; Amir H. Hoveyda","Endo-Selective Enyne Ring-Closing Metathesis Promoted by Stereogenic-at-Mo Monoalkoxide and Monoaryloxide Complexes. Efficient Synthesis of Cyclic Dienes Not Accessible through Reactions with Ru Carbenes","Journal of the American Chemical Society","2009","131","","10652","10661","10.1021/ja904098h","","","0.71073","MoKα","","0.076","0.0477","","","0.0854","0.0963","","","","","","0.995","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104783","14.7945","0.0008","7.6873","0.0005","10.2968","0.0008","90","","107.147","0.003","90","","1119","0.13","153","2","153","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C27 H18 Br2 -","- C27 H18 Br2 -","- C54 H36 Br4 -","2","0.5","","Xiaotao Pu; Xiangbing Qi; Joseph M. Ready","Allenes in Asymmetric Catalysis: Asymmetric Ring Opening of meso-Epoxides Catalyzed by Allene-Containing Phosphine Oxides","Journal of the American Chemical Society","2009","131","","10364","10365","10.1021/ja9041127","","","0.7107","MoKα","","0.0378","0.0322","","","0.0757","0.079","","","","","","1.062","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104784","10.8456","0.0004","16.0031","0.0005","11.1904","0.0005","90","","96.834","0.002","90","","1928.44","0.13","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C51 H40 O3 P2 -","- C51 H40 O3 P2 -","- C102 H80 O6 P4 -","2","1","","Xiaotao Pu; Xiangbing Qi; Joseph M. Ready","Allenes in Asymmetric Catalysis: Asymmetric Ring Opening of meso-Epoxides Catalyzed by Allene-Containing Phosphine Oxides","Journal of the American Chemical Society","2009","131","","10364","10365","10.1021/ja9041127","","","1.5418","CuKα","","0.0829","0.0583","","","0.1005","0.1219","","","","","","1.145","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104785","21.7401","0.0005","19.5657","0.001","54.261","0.002","90","","94.895","0.001","90","","22996.3","1.5","123","1","123","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Final","Final","","- C180 H168 B8 F32 N24 P8 Pd4 -","- C180 H168 B8 F32 N24 P8 Pd4 -","- C720 H672 B32 F128 N96 P32 Pd16 -","4","1","","Jinzhen Lu; David R. Turner; Lindsay P. Harding; Lindsay T. Byrne; Murray V. Baker; Stuart R. Batten","Octapi Interactions: Self-Assembly of a Pd-Based [2]Catenane Driven by Eightfold π Interactions","Journal of the American Chemical Society","2009","131","","10372","10373","10.1021/ja9041912","","","0.71073","MoKα","","0.1529","0.0946","","","0.2524","0.2846","","","","","","1.053","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104786","28.414","0.012","41.636","0.008","29.307","0.007","90","","90","","90","","34672","18","123","2","123","2","","","","","","","","9","P n n a","-P 2a 2bc","52","{[(dppp)Pd(LPr)]2.4OTF}4.5Toluene","{[(dppp)Pd(LPr)]2.4OTF}.4.5Toluene","","- C127.5 H125.5 F12 N12 O12 P4 Pd2 Pt0 S4 -","- C127.5 H124 F12 N12 O12 P4 Pd2 S4 -","- C1020 H992 F96 N96 O96 P32 Pd16 S32 -","8","1","","Jinzhen Lu; David R. Turner; Lindsay P. Harding; Lindsay T. Byrne; Murray V. Baker; Stuart R. Batten","Octapi Interactions: Self-Assembly of a Pd-Based [2]Catenane Driven by Eightfold π Interactions","Journal of the American Chemical Society","2009","131","","10372","10373","10.1021/ja9041912","","","0.77343","Synchrotron","","0.1668","0.1487","","","0.434","0.4549","","","","","","2.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104787","6.7723","0.0004","14.7754","0.0009","18.9647","0.001","110.205","0.003","100.064","0.003","90.673","0.004","1748.15","0.18","150","2","150","2","","","","","","","Leszek Rupnicki","5","P 1","P 1","1","","","","- C19 H21 N O4 S -","- C19 H21 N O4 S -","- C76 H84 N4 O16 S4 -","4","4","","Leszek Rupnicki; Aakarsh Saxena; Hon Wai Lam","Aromatic Heterocycles as Activating Groups for Asymmetric Conjugate Addition Reactions. Enantioselective Copper-Catalyzed Reduction of 2-Alkenylheteroarenes","Journal of the American Chemical Society","2009","131","","10386","10387","10.1021/ja904365h","","","0.71073","MoKα","","0.08","0.0712","","","0.167","0.1762","","","","","","1.039","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104788","10.9142","0.0015","16.979","0.002","25.765","0.004","90","","100.067","0.003","90","","4701.1","1.1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H76 N8 Si6 U2 -","- C30 H76 N8 Si6 U2 -","- C120 H304 N32 Si24 U8 -","4","1","","Benedict M. Gardner; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle","A Crystallizable Dinuclear Tuck-In-Tuck-Over Tuck-Over Dialkyl Tren Uranium Complex and Double Dearylation of BPh4- To Give the BPh2-Functionalized Metallocycle [U{N(CH2CH2NSiMe3)2(CH2CH2NSiMe2CHBPh2)}(THF)]","Journal of the American Chemical Society","2009","131","","10388","10389","10.1021/ja904459q","","","0.71073","MoKα","","0.0481","0.0282","","","0.0563","0.0616","","","","","","1.016","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104789","10.0582","0.001","18.9912","0.0019","19.5054","0.0019","90","","100.881","0.002","90","","3658.9","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H55 B N4 O Si3 U -","- C31 H55 B N4 O Si3 U -","- C124 H220 B4 N16 O4 Si12 U4 -","4","1","","Benedict M. Gardner; Jonathan McMaster; William Lewis; Alexander J. Blake; Stephen T. Liddle","A Crystallizable Dinuclear Tuck-In-Tuck-Over Tuck-Over Dialkyl Tren Uranium Complex and Double Dearylation of BPh4- To Give the BPh2-Functionalized Metallocycle [U{N(CH2CH2NSiMe3)2(CH2CH2NSiMe2CHBPh2)}(THF)]","Journal of the American Chemical Society","2009","131","","10388","10389","10.1021/ja904459q","","","0.71073","MoKα","","0.0635","0.04","","","0.0695","0.0747","","","","","","1.043","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104790","8.4421","0.0017","10.189","0.002","12.446","0.003","90","","104.63","0.03","90","","1035.9","0.4","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H20 Br N O2 -","- C24 H20 Br N O2 -","- C48 H40 Br2 N2 O4 -","2","1","","Luo Yang; De-Xian Wang; Zhi-Tang Huang; Mei-Xiang Wang","Cr(III)(salen)Cl Catalyzed Enantioselective Intramolecular Addition of Tertiary Enamides to Ketones: A General Access to Enantioenriched 1H-Pyrrol-2(3H)-one Derivatives Bearing a Hydroxylated Quaternary Carbon Atom","Journal of the American Chemical Society","2009","131","","10390","10391","10.1021/ja904534t","","","0.71073","MoKα","","0.0773","0.0371","","","0.0503","0.0586","","","","","","0.651","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104791","7.1582","0.0014","12.936","0.003","11.286","0.002","90","","91.01","0.03","90","","1044.9","0.4","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H25 N O4 -","- C26 H25 N O4 -","- C52 H50 N2 O8 -","2","1","","Luo Yang; De-Xian Wang; Zhi-Tang Huang; Mei-Xiang Wang","Cr(III)(salen)Cl Catalyzed Enantioselective Intramolecular Addition of Tertiary Enamides to Ketones: A General Access to Enantioenriched 1H-Pyrrol-2(3H)-one Derivatives Bearing a Hydroxylated Quaternary Carbon Atom","Journal of the American Chemical Society","2009","131","","10390","10391","10.1021/ja904534t","","","0.71073","MoKα","","0.0437","0.0375","","","0.0857","0.0973","","","","","","1.126","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104792","6.069","0.0004","12.594","0.002","15.485","0.0007","90","","90","","90","","1183.6","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","fidarestat","((2S,4S)-6-fluoro-2',5'-dioxospiro[chroman-4,4'-imidazolidine]-2-carboxamide","","- C12 H10 F N3 O4 -","- C12 H10 F N3 O4 -","- C48 H40 F4 N12 O16 -","4","1","","Bertrand Fournier; El-Eulmi Bendeif; Benoît Guillot; Alberto Podjarny; Claude Lecomte; Christian Jelsch","Charge Density and Electrostatic Interactions of Fidarestat, an Inhibitor of Human Aldose Reductase","Journal of the American Chemical Society","2009","131","","10929","10941","10.1021/ja8095015","","","0.45","synchrotron","","0.0374","0.0374","","","0.0198","0.0198","","","","","","0.398","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104793","14.918","0.005","15.596","0.005","16.442","0.005","90","","105.606","0.005","90","","3684","2","100","1","100","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 Mn2 N6 O13 -","- C34 H34 Mn2 N6 O13 -","- C136 H136 Mn8 N24 O52 -","4","1","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1016","0.0731","","","0.141","0.2045","","","","","","1.044","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104794","17.777","0.007","15.303","0.005","16.267","0.006","90","","113.51","0.005","90","","4058","3","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H35 Mn2 N9 O8 -","- C38 H35 Mn2 N9 O8 -","- C152 H140 Mn8 N36 O32 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.0932","0.0649","","","0.1537","0.2191","","","","","","1.051","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104795","18.237","0.006","15.078","0.003","16.285","0.005","90","","114.835","0.005","90","","4064","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Mn N4 O4 -","- C20 H16 Mn N4 O4 -","- C160 H128 Mn8 N32 O32 -","8","1","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.108","0.072","","","0.1844","0.244","","","","","","1.075","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104796","18.826","0.007","14.89","0.002","16.288","0.004","90","","112.937","0.006","90","","4205","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 Mn N4 O4 -","- C22 H20 Mn N4 O4 -","- C176 H160 Mn8 N32 O32 -","8","1","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1072","0.0701","","","0.1849","0.2352","","","","","","1.047","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104797","18.874","0.006","14.891","0.005","16.299","0.004","90","","114.015","0.002","90","","4184","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 Mn N4 O4 -","- C22 H20 Mn N4 O4 -","- C176 H160 Mn8 N32 O32 -","8","1","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1181","0.0733","","","0.187","0.2406","","","","","","1.044","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104798","18.406","0.007","15.041","0.005","16.344","0.004","90","","111.54","0.004","90","","4209","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H46 Mn2 N6 O15 -","- C34 H34 Mn2 N6 O15 -","- C136 H136 Mn8 N24 O60 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1011","0.0649","","","0.1511","0.2207","","","","","","1.053","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104799","18.409","0.007","15.009","0.006","16.341","0.006","90","","111.682","0.007","90","","4196","3","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H46 Mn2 N6 O15 -","- C34 H34 Mn2 N6 O15 -","- C136 H136 Mn8 N24 O60 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1079","0.0675","","","0.1549","0.2241","","","","","","1.078","","","","has coordinates","178793","2020-10-21","18:00:00",""
"4104800","18.408","0.006","15.037","0.005","16.357","0.006","90","","111.575","0.005","90","","4210","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H46 Mn2 N6 O15 -","- C34 H34 Mn2 N6 O15 -","- C136 H136 Mn8 N24 O60 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1064","0.0645","","","0.1524","0.2114","","","","","","1.064","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104801","18.421","0.005","15.029","0.004","16.355","0.005","90","","111.668","0.006","90","","4208","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H46 Mn2 N6 O15 -","- C34 H34 Mn2 N6 O15 -","- C136 H136 Mn8 N24 O60 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1024","0.0637","","","0.1586","0.221","","","","","","1.052","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104802","18.343","0.006","15.054","0.004","16.343","0.005","90","","111.808","0.004","90","","4190","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H46 Mn2 N6 O15 -","- C34 H34 Mn2 N6 O15 -","- C136 H136 Mn8 N24 O60 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1019","0.0633","","","0.1515","0.2186","","","","","","1.065","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104803","18.278","0.006","15.032","0.004","16.444","0.005","90","","112.032","0.005","90","","4188","2","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H46 Mn2 N6 O15 -","- C34 H38 Mn2 N6 O15 -","- C136 H152 Mn8 N24 O60 -","4","0.5","","Madhab C. Das; Parimal K. Bharadwaj","A Porous Coordination Polymer Exhibiting Reversible Single-Crystal to Single-Crystal Substitution Reactions at Mn(II) Centers by Nitrile Guest Molecules","Journal of the American Chemical Society","2009","131","","10942","10949","10.1021/ja9006035","","","0.71069","MoKα","","0.1024","0.0615","","","0.1497","0.2141","","","","","","1.065","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104804","11.5336","0.0016","22.057","0.003","20.237","0.003","90","","105.548","0.002","90","","4959.8","1.2","90","","90","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","La@C80C6H3Cl2","La@C80C6H3Cl2","","- C96.5 H15 Cl2 La -","- C96.5 H15 Cl2 La0.9998 -","- C386 H60 Cl8 La3.9992 -","4","1","","Hidefumi Nikawa; Tomoya Yamada; Baopeng Cao; Naomi Mizorogi; Zdenek Slanina; Takahiro Tsuchiya; Takeshi Akasaka; Kenji Yoza; Shigeru Nagase","Missing Metallofullerene with C80 Cage","Journal of the American Chemical Society","2009","131","","10950","10954","10.1021/ja900972r","","x-ray","0.71073","MoKα","","0.1155","0.0983","","","0.2288","0.239","","","","","","1.118","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104805","12.0071","0.001","13.9633","0.0011","15.6648","0.0013","90","","101.654","0.001","90","","2572.2","0.4","85","2","85","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H28 N2 O4 Pd -","- C32 H28 N2 O4 Pd -","- C128 H112 N8 O16 Pd4 -","4","0.5","","Joy M. Racowski; Allison R. Dick; Melanie S. Sanford","Detailed Study of C-O and C-C Bond-Forming Reductive Elimination from Stable C2N2O2-Ligated Palladium(IV) Complexes","Journal of the American Chemical Society","2009","131","","10974","10983","10.1021/ja9014474","","","0.71073","MoKα","","0.0397","0.034","","","0.0774","0.0796","","","","","","1.124","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104806","27.265","0.002","14.1208","0.0011","16.7774","0.0014","90","","112.087","0.001","90","","5985.3","0.8","85","2","85","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H38 N2 O4 Pd -","- C34 H38 N2 O4 Pd -","- C272 H304 N16 O32 Pd8 -","8","1","","Joy M. Racowski; Allison R. Dick; Melanie S. Sanford","Detailed Study of C-O and C-C Bond-Forming Reductive Elimination from Stable C2N2O2-Ligated Palladium(IV) Complexes","Journal of the American Chemical Society","2009","131","","10974","10983","10.1021/ja9014474","","","0.71073","MoKα","","0.0625","0.0565","","","0.1712","0.1795","","","","","","1.067","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104807","7.2574","0.0013","7.2574","0.0013","7.256","0.003","90","","90","","90","","382.17","0.19","375","2","375","2","","","","","","","","5","P 4/m m m","-P 4 2","123","[Fe(pz)Ni(CN)4]","","","- C8 H4 Fe N6 Ni -","- C8 H4 Fe N6 Ni -","- C8 H4 Fe N6 Ni -","1","0.0625","","Peter D. Southon; Lang Liu; Elizabeth A. Fellows; David J. Price; Gregory J. Halder; Karena W. Chapman; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Dynamic Interplay between Spin-Crossover and Host-Guest Function in a Nanoporous Metal-Organic Framework Material","Journal of the American Chemical Society","2009","131","","10998","11009","10.1021/ja902187d","","","0.71073","MoKα","","0.0969","0.0464","","","0.0994","0.1182","","","","","","0.962","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104808","7.1139","0.0003","6.9109","0.0004","6.7799","0.0003","90","","90","","90","","333.32","0.03","150","2","150","2","","","","","","","","6","P m m m","-P 2 2","47","[Fe(pz)Ni(CN)4].2H2O","","","- C8 H8 Fe N6 Ni O2 -","- C8 H4 Fe N6 Ni O1.998 -","- C8 H4 Fe N6 Ni O1.998 -","1","0.125","","Peter D. Southon; Lang Liu; Elizabeth A. Fellows; David J. Price; Gregory J. Halder; Karena W. Chapman; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Dynamic Interplay between Spin-Crossover and Host-Guest Function in a Nanoporous Metal-Organic Framework Material","Journal of the American Chemical Society","2009","131","","10998","11009","10.1021/ja902187d","","","0.71073","MoKα","","0.0394","0.0334","","","0.0885","0.0936","","","","","","1.118","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104809","7.028","0.003","7.01","0.003","6.725","0.002","90","","90","","90","","331.3","0.2","150","2","150","2","","","","","","","","6","P m m m","-P 2 2","47","[Fe(pz)Ni(CN)4].2H2O","","","- C8 H8 Fe N6 Ni O2 -","- C8 H4 Fe N6 Ni O2 -","- C8 H4 Fe N6 Ni O2 -","1","0.125","","Peter D. Southon; Lang Liu; Elizabeth A. Fellows; David J. Price; Gregory J. Halder; Karena W. Chapman; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Dynamic Interplay between Spin-Crossover and Host-Guest Function in a Nanoporous Metal-Organic Framework Material","Journal of the American Chemical Society","2009","131","","10998","11009","10.1021/ja902187d","","","0.71073","MoKα","","0.0688","0.0362","","","0.0779","0.0943","","","","","","1.153","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104810","7.2666","0.0003","7.2696","0.0003","7.2421","0.0003","90","","90","","90","","382.57","0.03","301","2","301","2","","","","","","","","6","P m m m","-P 2 2","47","[Fe(pz)Ni(CN)4].2H2O","","","- C8 H8 Fe N6 Ni O2 -","- C8 H4 Fe N6 Ni O1.984 -","- C8 H4 Fe N6 Ni O1.984 -","1","0.125","","Peter D. Southon; Lang Liu; Elizabeth A. Fellows; David J. Price; Gregory J. Halder; Karena W. Chapman; Boujemaa Moubaraki; Keith S. Murray; Jean-François Létard; Cameron J. Kepert","Dynamic Interplay between Spin-Crossover and Host-Guest Function in a Nanoporous Metal-Organic Framework Material","Journal of the American Chemical Society","2009","131","","10998","11009","10.1021/ja902187d","","","0.71073","MoKα","","0.0541","0.0393","","","0.1083","0.12","","","","","","1.227","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104811","8.01","0.002","10.902","0.002","20.373","0.005","90","","90","","90","","1779.1","0.7","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 Br N2 O -","- C20 H25 Br N2 O -","- C80 H100 Br4 N8 O4 -","4","1","","Michael E. Muratore; Chloe A. Holloway; Adam W. Pilling; R. Ian Storer; Graham Trevitt; Darren J. Dixon","Enantioselective Brønsted Acid-Catalyzed N-Acyliminium Cyclization Cascades","Journal of the American Chemical Society","2009","131","","10796","10797","10.1021/ja9024885","","","0.71073","MoKα","","0.0535","0.0399","","","0.0699","0.0733","","","","","","0.969","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104812","10.82","0.15","11.82","0.18","12.36","0.18","63.7","0.3","75.1","0.3","84.1","0.4","1369","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[BTBr][B(C6F5)3]","","","- C48 H6 B2 Br2 F30 N4 S2 -","- C48 H6 B2 Br2 F30 N4 S2 -","- C48 H6 B2 Br2 F30 N4 S2 -","1","0.5","","Gregory C. Welch; Robert Coffin; Jeff Peet; Guillermo C. Bazan","Band Gap Control in Conjugated Oligomers via Lewis Acids","Journal of the American Chemical Society","2009","131","","10802","10803","10.1021/ja902789w","","","0.71073","MoKα","","0.0655","0.0433","","","0.1132","0.1274","","","","","","1.028","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4104813","13.283","0.004","24.629","0.008","32.79","0.01","80.537","0.005","83.396","0.004","80.793","0.005","10401","6","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","holkd15","(diketiminate)cobalt(II) hydride dimer","","- C77 H116 Co2 N4 -","- C77 H116 Co2 N4 -","- C462 H696 Co12 N24 -","6","3","","Keying Ding; William W. Brennessel; Patrick L. Holland","Three-Coordinate and Four-Coordinate Cobalt Hydride Complexes That React with Dinitrogen","Journal of the American Chemical Society","2009","131","","10804","10805","10.1021/ja902812y","","","0.71073","MoKα","","0.1656","0.0732","","","0.1358","0.1699","","","","","","1.007","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104814","14.078","0.002","15.47","0.002","19.469","0.003","75.232","0.002","69.676","0.002","77.776","0.002","3809.1","0.9","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","holkd18","potassium (diketiminate)cobalt(I) hydride","","- C78 H123 Co2 K2 N4 -","- C78 H123 Co2 K2 N4 -","- C156 H246 Co4 K4 N8 -","2","1","","Keying Ding; William W. Brennessel; Patrick L. Holland","Three-Coordinate and Four-Coordinate Cobalt Hydride Complexes That React with Dinitrogen","Journal of the American Chemical Society","2009","131","","10804","10805","10.1021/ja902812y","","","0.71073","MoKα","","0.0865","0.0467","","","0.1106","0.1267","","","","","","1.026","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104815","9.6029","0.0006","17.8932","0.0012","21.6988","0.0014","90","","95.06","0.001","90","","3713.9","0.4","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","holkd21","(diketiminate)cobalt(II) cyclohexyl","","- C41 H64 Co N2 -","- C41 H64 Co N2 -","- C164 H256 Co4 N8 -","4","1","","Keying Ding; William W. Brennessel; Patrick L. Holland","Three-Coordinate and Four-Coordinate Cobalt Hydride Complexes That React with Dinitrogen","Journal of the American Chemical Society","2009","131","","10804","10805","10.1021/ja902812y","","","0.71073","MoKα","","0.1","0.0537","","","0.1115","0.131","","","","","","1.012","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104816","12.2397","0.0006","12.8327","0.0006","15.0834","0.0007","74.211","0.001","82.325","0.001","73.693","0.001","2183.83","0.18","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H148 Dy2 N2 O12 -","- C88 H148 Dy2 N2 O12 -","- C88 H148 Dy2 N2 O12 -","1","0.5","","William J. Evans; Ming Fang; Gaël Zucchi; Filipp Furche; Joseph W. Ziller; Ryan M. Hoekstra; Jeffrey I. Zink","Isolation of Dysprosium and Yttrium Complexes of a Three-Electron Reduction Product in the Activation of Dinitrogen, the (N2)3- Radical","Journal of the American Chemical Society","2009","131","","11195","11202","10.1021/ja9036753","","","0.71073","MoKα","","0.0625","0.0441","","","0.1028","0.1131","","","","","","1.083","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104817","15.5427","0.0005","12.0654","0.0004","24.6783","0.0008","90","","105.225","0.001","90","","4465.5","0.3","178","2","178","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C86 H132 Dy2 N2 O8 -","- C86 H132 Dy2 N2 O8 -","- C172 H264 Dy4 N4 O16 -","2","0.5","","William J. Evans; Ming Fang; Gaël Zucchi; Filipp Furche; Joseph W. Ziller; Ryan M. Hoekstra; Jeffrey I. Zink","Isolation of Dysprosium and Yttrium Complexes of a Three-Electron Reduction Product in the Activation of Dinitrogen, the (N2)3- Radical","Journal of the American Chemical Society","2009","131","","11195","11202","10.1021/ja9036753","","","0.71073","MoKα","","0.0804","0.0494","","","0.1476","0.1664","","","","","","1.122","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104818","12.8686","0.0006","13.3829","0.0006","16.2559","0.0007","109.267","0.0007","99.9592","0.0008","104.579","0.0008","2455.21","0.19","138","2","138","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H164 Dy2 K N2 O14 -","- C96 H164 Dy2 K N2 O14 -","- C96 H164 Dy2 K N2 O14 -","1","0.5","","William J. Evans; Ming Fang; Gaël Zucchi; Filipp Furche; Joseph W. Ziller; Ryan M. Hoekstra; Jeffrey I. Zink","Isolation of Dysprosium and Yttrium Complexes of a Three-Electron Reduction Product in the Activation of Dinitrogen, the (N2)3- Radical","Journal of the American Chemical Society","2009","131","","11195","11202","10.1021/ja9036753","","","0.71073","MoKα","","0.0546","0.0369","","","0.0853","0.0948","","","","","","1.083","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104819","14.0906","0.0009","18.0226","0.0012","19.2315","0.0013","68.061","0.0011","85.6165","0.0011","68.4163","0.0011","4201.9","0.5","138","2","138","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H122 Dy2 K N2 O7 -","- C74 H122 Dy2 K N2 O7 -","- C148 H244 Dy4 K2 N4 O14 -","2","1","","William J. Evans; Ming Fang; Gaël Zucchi; Filipp Furche; Joseph W. Ziller; Ryan M. Hoekstra; Jeffrey I. Zink","Isolation of Dysprosium and Yttrium Complexes of a Three-Electron Reduction Product in the Activation of Dinitrogen, the (N2)3- Radical","Journal of the American Chemical Society","2009","131","","11195","11202","10.1021/ja9036753","","","0.71073","MoKα","","0.07","0.0532","","","0.1466","0.1616","","","","","","1.07","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104820","16.4627","0.0009","24.9416","0.0013","19.9471","0.0011","90","","93.684","0.001","90","","8173.5","0.8","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H136 K N6 O8 Si8 Y2 -","- C56 H88 K N6 O8 Si8 Y2 -","- C224 H352 K4 N24 O32 Si32 Y8 -","4","1","","William J. Evans; Ming Fang; Gaël Zucchi; Filipp Furche; Joseph W. Ziller; Ryan M. Hoekstra; Jeffrey I. Zink","Isolation of Dysprosium and Yttrium Complexes of a Three-Electron Reduction Product in the Activation of Dinitrogen, the (N2)3- Radical","Journal of the American Chemical Society","2009","131","","11195","11202","10.1021/ja9036753","","","0.71073","MoKα","","0.0698","0.0567","","","0.1593","0.1706","","","","","","1.031","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104821","12.481","0.003","21.371","0.005","22.304","0.005","90","","105.071","0.003","90","","5745","2","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35.5 H92 K N6 O2 Si8 Y2 -","- C35.5 H88 K N6 O2 Si8 Y2 -","- C142 H352 K4 N24 O8 Si32 Y8 -","4","1","","William J. Evans; Ming Fang; Gaël Zucchi; Filipp Furche; Joseph W. Ziller; Ryan M. Hoekstra; Jeffrey I. Zink","Isolation of Dysprosium and Yttrium Complexes of a Three-Electron Reduction Product in the Activation of Dinitrogen, the (N2)3- Radical","Journal of the American Chemical Society","2009","131","","11195","11202","10.1021/ja9036753","","","0.71073","MoKα","","0.0646","0.0372","","","0.0808","0.091","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104822","49.248","0.01","9.3164","0.0019","26.135","0.005","90","","119.15","0.03","90","","10472","5","178","2","178","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C55.63 H67 Ir N P2 Si -","- C55.632 H67 Ir N P2 Si -","- C445.056 H536 Ir8 N8 P16 Si8 -","8","1","","Elisa Calimano; T. Don Tilley","Synthesis and Structure of PNP-Supported Iridium Silyl and Silylene Complexes: Catalytic Hydrosilation of Alkenes","Journal of the American Chemical Society","2009","131","","11161","11173","10.1021/ja903737j","","","0.71073","MoKα","","0.0814","0.0457","","","0.0873","0.097","","","","","","0.971","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104823","9.404","0.002","16.248","0.003","21.85","0.005","90","","94.913","0.004","90","","3326.3","1.2","152","2","152","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H54 Ir N P2 -","- C34 H54 Ir N P2 -","- C136 H216 Ir4 N4 P8 -","4","1","","Elisa Calimano; T. Don Tilley","Synthesis and Structure of PNP-Supported Iridium Silyl and Silylene Complexes: Catalytic Hydrosilation of Alkenes","Journal of the American Chemical Society","2009","131","","11161","11173","10.1021/ja903737j","","","0.71073","MoKα","","0.0898","0.0504","","","0.0971","0.108","","","","","","1.022","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104824","10.3748","0.0017","13.775","0.002","19.886","0.003","79.423","0.003","80.422","0.003","80.345","0.003","2727","0.7","159","2","159","2","","","","","","","","9","P -1","-P 1","2","","","","- C84 H116 B22 Br12 F Ir2 N2 P4 Si2 -","- C84 H116 B22 Br12 F Ir2 N2 P4 Si2 -","- C84 H116 B22 Br12 F Ir2 N2 P4 Si2 -","1","0.5","","Elisa Calimano; T. Don Tilley","Synthesis and Structure of PNP-Supported Iridium Silyl and Silylene Complexes: Catalytic Hydrosilation of Alkenes","Journal of the American Chemical Society","2009","131","","11161","11173","10.1021/ja903737j","","","0.71073","MoKα","","0.08","0.0459","","","0.0947","0.1052","","","","","","0.968","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104825","11.9761","0.0006","16.7276","0.0008","19.2367","0.0009","70.984","0.001","77.004","0.001","89.949","0.001","3539.1","0.3","135","2","135","2","","","","","","","","8","P -1","-P 1","2","","","","- C51 H66 B11 Br6 Ir N P2 Si2 -","- C51 H66 B11 Br6 Ir N P2 Si2 -","- C102 H132 B22 Br12 Ir2 N2 P4 Si4 -","2","1","","Elisa Calimano; T. Don Tilley","Synthesis and Structure of PNP-Supported Iridium Silyl and Silylene Complexes: Catalytic Hydrosilation of Alkenes","Journal of the American Chemical Society","2009","131","","11161","11173","10.1021/ja903737j","","","0.71073","MoKα","","0.0582","0.04","","","0.0847","0.0887","","","","","","0.989","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104826","9.8899","0.0009","10.3026","0.001","10.4367","0.001","106.082","0.002","99.487","0.002","117.495","0.002","851.26","0.14","193","2","193","2","","","","","","","","5","P 1","P 1","1","","","","- C30 H58 Co N4 S2 -","- C30 H58 Co N4 S2 -","- C30 H58 Co N4 S2 -","1","1","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.0519","0.0439","","","0.0871","0.0914","","","","","","0.936","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104827","19.057","0.003","12.78","0.0019","39.863","0.006","90","","92.948","0.003","90","","9696","3","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H84 Co4 P4 S4 -","- C36 Co4 P4 S4 -","- C288 Co32 P32 S32 -","8","1","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.0919","0.0749","","","0.1981","0.2109","","","","","","1.07","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104828","12.4418","0.0011","12.4418","0.0011","16.575","0.002","90","","90","","90","","2565.8","0.4","193","2","293","2","","","","","","","","7","I -4 2 m","I -4 2","121","","","","- C36 H84 B Co4 F4 P4 S4 -","- C36 H84 B Co4 F4 P4 S4 -","- C72 H168 B2 Co8 F8 P8 S8 -","2","0.125","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.026","0.0255","","","0.0672","0.0677","","","","","","1.009","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104829","14.321","0.003","20.38","0.005","18.726","0.004","90","","96.093","0.004","90","","5435","2","105","2","105","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C44 H80 Co4 N8 S4 -","- C44 H80 Co4 N8 S4 -","- C176 H320 Co16 N32 S16 -","4","1","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.0205","0.02","","","0.0489","0.0492","","","","","","1.027","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104830","9.5068","0.0004","18.5603","0.0007","20.3237","0.0008","85.581","0.002","87.589","0.003","88.381","0.002","3571.1","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H100 B Co4 N8 S4 -","- C68 H100 B Co4 N8 S4 -","- C136 H200 B2 Co8 N16 S8 -","2","1","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.0597","0.0447","","","0.1117","0.1215","","","","","","1.034","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104831","12.3518","0.0006","12.4877","0.0006","13.9495","0.0007","73.96","0.001","84.74","0.001","64.229","0.001","1861.2","0.16","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H126 Co8 P6 S8 -","- C54 H126 Co8 P6 S8 -","- C54 H126 Co8 P6 S8 -","1","0.5","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.0393","0.0344","","","0.0893","0.094","","","","","","1.027","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104832","13.5596","0.0007","20.8973","0.001","41.467","0.002","86.085","0.001","81.22","0.001","88.473","0.001","11583.7","1","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H126 B Co8 F4 P6 S8 -","- C54 H98 B Co8 F4 P6 S8 -","- C324 H588 B6 Co48 F24 P36 S48 -","6","3","","Liang Deng; Eckhard Bill; Karl Wieghardt; R. H. Holm","Cubane-Type Co4S4 Clusters: Synthesis, Redox Series, and Magnetic Ground States","Journal of the American Chemical Society","2009","131","","11213","11221","10.1021/ja903847a","","","0.71073","MoKα","","0.0785","0.0538","","","0.143","0.1589","","","","","","1.047","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104833","7.6286","0.0007","11.181","0.0012","12.0135","0.0013","107.145","0.005","95.759","0.005","105.904","0.004","923.21","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","SW-V-172b","sarpong09","","- C22 H24 N2 O2 S -","- C22 H24 N2 O2 S -","- C44 H48 N4 O4 S2 -","2","1","","Scott P. West; Alakesh Bisai; Andrew D. Lim; Raja R. Narayan; Richmond Sarpong","Total Synthesis of (+)-Lyconadin A and Related Compounds via Oxidative C-N Bond Formation","Journal of the American Chemical Society","2009","131","","11187","11194","10.1021/ja903868n","","","1.54178","CuKα","","0.0386","0.0381","","","0.1016","0.1021","","","","","","1.034","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104834","5.1506","0.0005","30.99","0.003","10.7824","0.0011","90","","90.789","0.007","90","","1720.9","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","SW-V-122d","sarpong05","","- C19 H27 N O4 -","- C19 H27 N O4 -","- C76 H108 N4 O16 -","4","2","","Scott P. West; Alakesh Bisai; Andrew D. Lim; Raja R. Narayan; Richmond Sarpong","Total Synthesis of (+)-Lyconadin A and Related Compounds via Oxidative C-N Bond Formation","Journal of the American Chemical Society","2009","131","","11187","11194","10.1021/ja903868n","","","1.54178","CuKα","","0.049","0.0414","","","0.0969","0.1007","","","","","","1.04","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104835","7.3398","0.0007","8.3066","0.0008","13.8028","0.0013","84.584","0.002","75.864","0.002","68.311","0.002","758.28","0.13","139","2","139","2","","","","","","","","5","P -1","-P 1","2","SW-V-89","sarpong04","","- C16 H21 Cl N2 O -","- C16 H21 Cl N2 O -","- C32 H42 Cl2 N4 O2 -","2","1","","Scott P. West; Alakesh Bisai; Andrew D. Lim; Raja R. Narayan; Richmond Sarpong","Total Synthesis of (+)-Lyconadin A and Related Compounds via Oxidative C-N Bond Formation","Journal of the American Chemical Society","2009","131","","11187","11194","10.1021/ja903868n","","","0.71073","MoKα","","0.0581","0.0444","","","0.1087","0.1193","","","","","","1.028","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104836","11.129","0.001","14.816","0.002","13.034","0.001","90","","107.184","0.002","90","","2053.2","0.4","176.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 N2 O3 -","- C22 H32 N2 O3 -","- C88 H128 N8 O12 -","4","1","","Scott P. West; Alakesh Bisai; Andrew D. Lim; Raja R. Narayan; Richmond Sarpong","Total Synthesis of (+)-Lyconadin A and Related Compounds via Oxidative C-N Bond Formation","Journal of the American Chemical Society","2009","131","","11187","11194","10.1021/ja903868n","","","0.7107","MoKα","","0.0609","0.0403","","0.053","","0.0494","","","","","","1.818","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104837","10.5537","0.0008","10.9345","0.0007","11.9132","0.0008","69.127","0.001","83.691","0.001","77.491","0.001","1253.25","0.15","165.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C27 H32 N2 O7 -","- C27 H32 N2 O7 -","- C54 H64 N4 O14 -","2","1","","Scott P. West; Alakesh Bisai; Andrew D. Lim; Raja R. Narayan; Richmond Sarpong","Total Synthesis of (+)-Lyconadin A and Related Compounds via Oxidative C-N Bond Formation","Journal of the American Chemical Society","2009","131","","11187","11194","10.1021/ja903868n","","","0.7107","MoKα","","0.0546","0.0386","","0.0593","","0.0546","","","","","","1.734","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104838","5.4233","0.0011","10.61","0.002","11.629","0.002","90","","90","","90","","669.1","0.2","200","2","200","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Eu2 N3 Si -","- Eu2 N3 Si -","- Eu16 N24 Si8 -","8","","","Martin Zeuner; Sandro Pagano; Philipp Matthes; Daniel Bichler; Dirk Johrendt; Thomas Harmening; Rainer Pöttgen; Wolfgang Schnick","Mixed Valence Europium Nitridosilicate Eu2SiN3","Journal of the American Chemical Society","2009","131","","11242","11248","10.1021/ja9040237","","","0.71073","MoKα","","0.0167","0.0159","","","0.0318","0.032","","","","","","1.182","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104839","14.707","0.0002","14.707","0.0002","10.8676","0.0003","90","","90","","120","","2035.69","0.07","293","2","293","2","","","","","","","","7","P -3","-P 3","147","","","","- C36 H84 Cu8 F12 O12 P8 Se12 -","- C36 H84 Cu8 F12 O12 P8 Se12 -","- C36 H84 Cu8 F12 O12 P8 Se12 -","1","0.166667","","C. W. Liu; Bijay Sarkar; Yao-Jheng Huang; Ping-Kuei Liao; Ju-Chun Wang; Jean-Yves Saillard; Samia Kahlal","Octanuclear Copper(I) Clusters Inscribed in a Se12 Icosahedron: Anion-Induced Modulation of the Core Size and Symmetry","Journal of the American Chemical Society","2009","131","","11222","11233","10.1021/ja904089t","","","0.71073","MoKα","","0.0723","0.041","","","0.1062","0.119","","","","","","1.017","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104840","24.2417","0.0008","13.1352","0.0005","24.8846","0.0007","90","","91.783","0.001","90","","7919.9","0.5","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H84 Cu8 F7 O12 P7 Se12 -","- C36 H84 Cu8 F7 O12 P7 Se12 -","- C144 H336 Cu32 F28 O48 P28 Se48 -","4","0.5","","C. W. Liu; Bijay Sarkar; Yao-Jheng Huang; Ping-Kuei Liao; Ju-Chun Wang; Jean-Yves Saillard; Samia Kahlal","Octanuclear Copper(I) Clusters Inscribed in a Se12 Icosahedron: Anion-Induced Modulation of the Core Size and Symmetry","Journal of the American Chemical Society","2009","131","","11222","11233","10.1021/ja904089t","","","0.71073","MoKα","","0.1488","0.0535","","","0.1204","0.1495","","","","","","0.859","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104841","17.7369","0.0008","17.7369","0.0008","72.654","0.003","90","","90","","120","","19794.5","1.5","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C27 H63 Cu8 F7 O12 P7 Se12 -","- C27 H63 Cu8 F7 O12 P7 Se12 -","- C324 H756 Cu96 F84 O144 P84 Se144 -","12","0.333333","","C. W. Liu; Bijay Sarkar; Yao-Jheng Huang; Ping-Kuei Liao; Ju-Chun Wang; Jean-Yves Saillard; Samia Kahlal","Octanuclear Copper(I) Clusters Inscribed in a Se12 Icosahedron: Anion-Induced Modulation of the Core Size and Symmetry","Journal of the American Chemical Society","2009","131","","11222","11233","10.1021/ja904089t","","","0.71073","MoKα","","0.0772","0.0484","","","0.1568","0.1812","","","","","","1.131","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104842","24.254","0.003","13.0874","0.0014","24.861","0.004","90","","91.879","0.005","90","","7887.2","1.8","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H85 Cu8 F6 O12 P7 Se12 -","- C36 H83 Cu8 F6 O12 P7 Se12 -","- C144 H332 Cu32 F24 O48 P28 Se48 -","4","0.5","","C. W. Liu; Bijay Sarkar; Yao-Jheng Huang; Ping-Kuei Liao; Ju-Chun Wang; Jean-Yves Saillard; Samia Kahlal","Octanuclear Copper(I) Clusters Inscribed in a Se12 Icosahedron: Anion-Induced Modulation of the Core Size and Symmetry","Journal of the American Chemical Society","2009","131","","11222","11233","10.1021/ja904089t","","","0.71073","MoKα","","0.0917","0.0518","","","0.1309","0.1441","","","","","","1.053","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104843","17.6955","0.0003","17.6955","0.0003","71.878","0.003","90","","90","","120","","19491.8","0.9","298","2","298","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C24 H61 Cu8 F6 O12 P7 Se12 -","- C24 H61 Cu8 F6 O12 P7 Se12 -","- C288 H732 Cu96 F72 O144 P84 Se144 -","12","0.333333","","C. W. Liu; Bijay Sarkar; Yao-Jheng Huang; Ping-Kuei Liao; Ju-Chun Wang; Jean-Yves Saillard; Samia Kahlal","Octanuclear Copper(I) Clusters Inscribed in a Se12 Icosahedron: Anion-Induced Modulation of the Core Size and Symmetry","Journal of the American Chemical Society","2009","131","","11222","11233","10.1021/ja904089t","","","0.71073","MoKα","","0.0685","0.0518","","","0.1505","0.162","","","","","","1.091","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104844","22.448","0.0003","22.448","0.0003","12.6834","0.0003","90","","90","","120","","5535.05","0.17","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C36 H84 Cu8 O12 P6 S Se12 -","- C36 H84 Cu8 O12 P6 S Se12 -","- C108 H252 Cu24 O36 P18 S3 Se36 -","3","0.166667","","C. W. Liu; Bijay Sarkar; Yao-Jheng Huang; Ping-Kuei Liao; Ju-Chun Wang; Jean-Yves Saillard; Samia Kahlal","Octanuclear Copper(I) Clusters Inscribed in a Se12 Icosahedron: Anion-Induced Modulation of the Core Size and Symmetry","Journal of the American Chemical Society","2009","131","","11222","11233","10.1021/ja904089t","","","0.71073","MoKα","","0.0679","0.0368","","","0.0915","0.1053","","","","","","1.017","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104845","9.66","0.003","17.181","0.005","18.96","0.006","90","","90","","90","","3146.8","1.7","203","2","203","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C30 H45 B N2 O2 S2 -","- C30 H41 B N2 O2 S2 -","- C120 H164 B4 N8 O8 S8 -","4","0.5","","Shau-Hua Ueng; Andrey Solovyev; Xinting Yuan; Steven J. Geib; Louis Fensterbank; Emmanuel Lacôte; Max Malacria; Martin Newcomb; John C. Walton; Dennis P. Curran","N-Heterocyclic Carbene Boryl Radicals: A New Class of Boron-Centered Radical","Journal of the American Chemical Society","2009","131","","11256","11262","10.1021/ja904103x","","","0.71073","MoKα","","0.1165","0.0911","","","0.2269","0.2337","","","","","","1.754","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104846","14.1188","0.0019","14.337","0.002","20.757","0.002","90","","90.754","0.009","90","","4201.3","0.9","250","2","250","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H57 B N2 O2 S2 -","- C41 H57 B N2 O2 S2 -","- C164 H228 B4 N8 O8 S8 -","4","1","","Shau-Hua Ueng; Andrey Solovyev; Xinting Yuan; Steven J. Geib; Louis Fensterbank; Emmanuel Lacôte; Max Malacria; Martin Newcomb; John C. Walton; Dennis P. Curran","N-Heterocyclic Carbene Boryl Radicals: A New Class of Boron-Centered Radical","Journal of the American Chemical Society","2009","131","","11256","11262","10.1021/ja904103x","","","0.71073","MoKα","","0.1788","0.0702","","","0.1694","0.2268","","","","","","1.019","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104847","9.0868","0.0003","12.6753","0.0005","17.8359","0.0007","82.848","0.001","78.796","0.001","80.426","0.001","1978.04","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","TAP(Dipp)Au(3-hexyne)","","","- C38 H44 Au F14 N3 -","- C38 H44 Au F14 N3 -","- C76 H88 Au2 F28 N6 -","2","1","","H. V. Rasika Dias; Jaime A. Flores; Jiang Wu; Peter Kroll","Monomeric Copper(I), Silver(I), and Gold(I) Alkyne Complexes and the Coinage Metal Family Group Trends","Journal of the American Chemical Society","2009","131","","11249","11255","10.1021/ja904232v","","","0.71073","MoKα","","0.0323","0.032","","","0.0864","0.0866","","","","","","1.17","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104848","9.1036","0.0003","12.5604","0.0005","17.6485","0.0006","81.606","0.001","79.605","0.001","80.286","0.001","1942.49","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","TAP(Dipp)Cu(3-hexyne)","","","- C38 H44 Cu F14 N3 -","- C38 H44 Cu F14 N3 -","- C76 H88 Cu2 F28 N6 -","2","1","","H. V. Rasika Dias; Jaime A. Flores; Jiang Wu; Peter Kroll","Monomeric Copper(I), Silver(I), and Gold(I) Alkyne Complexes and the Coinage Metal Family Group Trends","Journal of the American Chemical Society","2009","131","","11249","11255","10.1021/ja904232v","","","0.71073","MoKα","","0.0414","0.0379","","","0.0997","0.1025","","","","","","1.082","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104849","9.1356","0.0006","12.7961","0.0009","17.7376","0.0012","82.756","0.001","78.647","0.001","80.038","0.001","1993.2","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","TAP(Dipp)Ag(3-hexyne)","","","- C38 H44 Ag F14 N3 -","- C38 H44 Ag F14 N3 -","- C76 H88 Ag2 F28 N6 -","2","1","","H. V. Rasika Dias; Jaime A. Flores; Jiang Wu; Peter Kroll","Monomeric Copper(I), Silver(I), and Gold(I) Alkyne Complexes and the Coinage Metal Family Group Trends","Journal of the American Chemical Society","2009","131","","11249","11255","10.1021/ja904232v","","","0.71073","MoKα","","0.0355","0.0333","","","0.0852","0.0869","","","","","","1.054","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104850","5.6745","0.0003","13.5498","0.0006","17.9944","0.0008","90","","90","","90","","1383.56","0.11","296","2","120","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C12 H15 Br N2 O3 S -","- C12 H15 Br N2 O3 S -","- C48 H60 Br4 N8 O12 S4 -","4","1","","Daniel A. DiRocco; Kevin M. Oberg; Derek M. Dalton; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Heterocyclic Aldehydes with Nitroalkenes: Backbone Fluorination Improves Selectivity","Journal of the American Chemical Society","2009","131","","10872","10874","10.1021/ja904375q","","","0.71073","MoKα","","0.0455","0.0317","","","0.0543","0.0577","","","","","","0.876","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104851","9.9726","0.0003","7.6892","0.0002","11.052","0.0004","90","","102.604","0.002","90","","827.06","0.04","296","2","120","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H12 B F10 N3 -","- C14 H12 B F10 N3 -","- C28 H24 B2 F20 N6 -","2","1","","Daniel A. DiRocco; Kevin M. Oberg; Derek M. Dalton; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Heterocyclic Aldehydes with Nitroalkenes: Backbone Fluorination Improves Selectivity","Journal of the American Chemical Society","2009","131","","10872","10874","10.1021/ja904375q","","","0.71073","MoKα","","0.0543","0.0388","","","0.0899","0.1026","","","","","","1.018","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104852","9.9082","0.0003","7.7653","0.0003","11.0984","0.0004","90","","106.157","0.002","90","","820.19","0.05","296","2","120","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H12 B F10 N3 -","- C14 H12 B F10 N3 -","- C28 H24 B2 F20 N6 -","2","1","","Daniel A. DiRocco; Kevin M. Oberg; Derek M. Dalton; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Heterocyclic Aldehydes with Nitroalkenes: Backbone Fluorination Improves Selectivity","Journal of the American Chemical Society","2009","131","","10872","10874","10.1021/ja904375q","","","0.71073","MoKα","","0.0753","0.0518","","","0.1283","0.1502","","","","","","1.044","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104853","9.9143","0.0003","7.5803","0.0002","11.2293","0.0003","90","","107.608","0.001","90","","804.38","0.04","120","","120","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H13 B F9 N3 -","- C14 H13 B F9 N3 -","- C28 H26 B2 F18 N6 -","2","1","","Daniel A. DiRocco; Kevin M. Oberg; Derek M. Dalton; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Heterocyclic Aldehydes with Nitroalkenes: Backbone Fluorination Improves Selectivity","Journal of the American Chemical Society","2009","131","","10872","10874","10.1021/ja904375q","","","0.71073","MoKα","","0.0863","0.0464","","","0.0778","0.0906","","","","","","1.013","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104854","10.8932","0.0008","7.6975","0.0005","16.135","0.0014","90","","98.254","0.004","90","","1338.91","0.18","120","","120","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C11 H6 B F10 N3 -","- C11 H6 B F10 N3 -","- C44 H24 B4 F40 N12 -","4","2","","Daniel A. DiRocco; Kevin M. Oberg; Derek M. Dalton; Tomislav Rovis","Catalytic Asymmetric Intermolecular Stetter Reaction of Heterocyclic Aldehydes with Nitroalkenes: Backbone Fluorination Improves Selectivity","Journal of the American Chemical Society","2009","131","","10872","10874","10.1021/ja904375q","","","0.71073","MoKα","","0.081","0.0468","","","0.1013","0.123","","","","","","0.998","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104855","13.748","0.004","9.038","0.003","18.722","0.006","90","","94.1207","0.0013","90","","2320.3","1.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 Cl N2 Sn -","- C26 H27 Cl N2 Sn -","- C104 H108 Cl4 N8 Sn4 -","4","1","","Junji Kobayashi; Tomokatsu Kushida; Takayuki Kawashima","Synthesis and Reversible Control of the Fluorescent Properties of a Divalent Tin Dipyrromethene","Journal of the American Chemical Society","2009","131","","10836","10837","10.1021/ja904470m","","","0.7107","MoKα","","0.0218","0.02","","","0.0541","0.0551","","","","","","1.075","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104856","11.3006","0.0005","14.5461","0.0001","16.9925","0.0001","67.311","0.009","80.428","0.011","81.174","0.011","2528.9","0.2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H50 F6 N4 O6 S2 Sn2 -","- C49 H50 F6 N4 O6 S2 Sn2 -","- C98 H100 F12 N8 O12 S4 Sn4 -","2","1","","Junji Kobayashi; Tomokatsu Kushida; Takayuki Kawashima","Synthesis and Reversible Control of the Fluorescent Properties of a Divalent Tin Dipyrromethene","Journal of the American Chemical Society","2009","131","","10836","10837","10.1021/ja904470m","","","0.7107","MoKα","","0.0412","0.0369","","","0.0991","0.1027","","","","","","1.042","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104857","10.2743","0.0002","33.9203","0.0007","13.2436","0.0003","90","","96.521","0.002","90","","4585.63","0.17","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C47 H64 Br2 Mo N2 O2 Si -","- C47 H64 Br2 Mo N2 O2 Si -","- C188 H256 Br8 Mo4 N8 O8 Si4 -","4","2","","Smaranda C. Marinescu; Richard R. Schrock; Peter Müller; Amir H. Hoveyda","Ethenolysis Reactions Catalyzed by Imido Alkylidene Monoaryloxide Monopyrrolide (MAP) Complexes of Molybdenum","Journal of the American Chemical Society","2009","131","","10840","10841","10.1021/ja904786y","","","1.54178","CuKα","","0.0541","0.0455","","","0.1062","0.111","","","","","","1.02","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104858","6.6601","0.0014","11.827","0.003","9.66","0.002","90","","97.035","0.003","90","","755.2","0.3","125","2","125","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C17 H26 O4 -","- C17 H26 O4 -","- C34 H52 O8 -","2","1","","Zhang Wang; Sun-Joon Min; Samuel J. Danishefsky","Total Synthesis and Structural Revision of (\±)-Tricholomalides A and B","Journal of the American Chemical Society","2009","131","","10848","10849","10.1021/ja9049433","","","0.71073","MoKα","","0.0432","0.0351","","","0.0868","0.0906","","","","","","1.054","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104859","6.2233","0.0005","16.3511","0.0013","17.7582","0.0014","99.257","0.001","93.699","0.001","96.031","0.001","1767.5","0.2","125","2","125","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H28 O4 -","- C20 H28 O4 -","- C80 H112 O16 -","4","2","","Zhang Wang; Sun-Joon Min; Samuel J. Danishefsky","Total Synthesis and Structural Revision of (\±)-Tricholomalides A and B","Journal of the American Chemical Society","2009","131","","10848","10849","10.1021/ja9049433","","","0.71073","MoKα","","0.171","0.0686","","","0.1455","0.1856","","","","","","0.946","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104860","6.4098","0.001","13.194","0.002","21.041","0.003","90","","92.226","0.003","90","","1778.1","0.5","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 O5 -","- C20 H28 O5 -","- C80 H112 O20 -","4","1","","Zhang Wang; Sun-Joon Min; Samuel J. Danishefsky","Total Synthesis and Structural Revision of (\±)-Tricholomalides A and B","Journal of the American Chemical Society","2009","131","","10848","10849","10.1021/ja9049433","","","0.71073","MoKα","","0.1485","0.047","","","0.0686","0.084","","","","","","0.835","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104861","33.206","0.003","6.6255","0.0006","19.8029","0.0019","90","","124.831","0.001","90","","3576.2","0.6","125","2","125","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H28 O5 -","- C20 H28 O5 -","- C160 H224 O40 -","8","1","","Zhang Wang; Sun-Joon Min; Samuel J. Danishefsky","Total Synthesis and Structural Revision of (\±)-Tricholomalides A and B","Journal of the American Chemical Society","2009","131","","10848","10849","10.1021/ja9049433","","","0.71073","MoKα","","0.1364","0.0528","","","0.0939","0.117","","","","","","1.067","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104862","6.2107","0.0012","16.315","0.003","17.969","0.004","99.637","0.003","93.661","0.003","96.032","0.003","1779","0.6","125","2","125","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H28 O5 -","- C20 H28 O5 -","- C80 H112 O20 -","4","2","","Zhang Wang; Sun-Joon Min; Samuel J. Danishefsky","Total Synthesis and Structural Revision of (\±)-Tricholomalides A and B","Journal of the American Chemical Society","2009","131","","10848","10849","10.1021/ja9049433","","","0.71073","MoKα","","0.1737","0.0867","","","0.2247","0.2755","","","","","","1.062","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104863","7.8612","0.0017","11.015","0.002","16.196","0.004","90","","90","","90","","1402.4","0.5","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,2-Bis(dimethylamino)[3,2-c:2?,3?-e] dithieno-1,2-dihydro-1,2-Diborin","","- C12 H16 B2 N2 S2 -","- C12 H16 B2 N2 S2 -","- C48 H64 B8 N8 S8 -","4","1","","Atsushi Wakamiya; Kenji Mori; Takafumi Araki; Shigehiro Yamaguchi","A B-B Bond-Containing Polycyclic π-Electron System: Dithieno-1,2-dihydro-1,2-diborin and Its Dianion","Journal of the American Chemical Society","2009","131","","10850","10851","10.1021/ja905007s","","","0.7107","MoKa","","0.045","0.0368","","","0.073","0.0759","","","","","","0.964","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104864","13.835","0.004","24.235","0.007","38.188","0.011","90","","99.229","0.004","90","","12638","6","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[potassium[2.2.2]cryptand]salt of 1,2-bis(dimethylamino)[3,2-c:2',3'-e] dithieno-1,2-dihydro-1,2-diborin","","- C54 H96 B2 K2 N6 O13.5 S2 -","- C54 H96 B2 K2 N6 O13.5 S2 -","- C432 H768 B16 K16 N48 O108 S16 -","8","1","","Atsushi Wakamiya; Kenji Mori; Takafumi Araki; Shigehiro Yamaguchi","A B-B Bond-Containing Polycyclic π-Electron System: Dithieno-1,2-dihydro-1,2-diborin and Its Dianion","Journal of the American Chemical Society","2009","131","","10850","10851","10.1021/ja905007s","","","0.7107","MoKa","","0.0871","0.074","","","0.183","0.1945","","","","","","1.115","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104865","29.375","0.0019","15.1467","0.0013","7.5187","0.0007","90","","91.578","0.007","90","","3344.1","0.5","568","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","eric01","eric01","","- C19 H17 N3 O -","- C19 H17 N3 O -","- C152 H136 N24 O8 -","8","1","","Antonio Barbon; Eric D. Bott; Marina Brustolon; Marianna Fabris; Bart Kahr; Werner Kaminsky; Philip J. Reid; Susanna M. Wong; Kristin L. Wustholz; Roberto Zanré","Triplet States of the Nonlinear Optical Chromophore DCM in Single Crystals of Potassium Hydrogen Phthalate and Their Relationship to Single-Molecule Dark States","Journal of the American Chemical Society","2009","131","","11548","11557","10.1021/ja903284y","","","0.71073","MoKα","","0.2459","0.0774","","","0.1326","0.1834","","","","","","0.978","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104866","9.6071","0.0011","9.8809","0.0012","10.5968","0.0013","113.932","0.002","96.489","0.002","98.884","0.002","891.06","0.19","105","2","105","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H42 F4 Li2 O4 -","- C38 H42 F4 Li2 O4 -","- C38 H42 F4 Li2 O4 -","1","0.5","","Kristopher J. Kolonko; Margaret M. Biddle; Ilia A. Guzei; Hans J. Reich","Solution Structures of Lithium Enolates of Cyclopentanone, Cyclohexanone, Acetophenones, and Benzyl Ketones. Triple Ions and Higher Lithiate Complexes","Journal of the American Chemical Society","2009","131","","11525","11534","10.1021/ja903479p","","","0.71073","Mo-Kα","","0.0669","0.0575","","","0.1545","0.1606","","","","","","0.988","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104867","17.9816","0.0013","14.5976","0.0011","18.1807","0.0013","90","","104.052","0.001","90","","4629.4","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H36 Li N3 O -","- C24 H36 Li N3 O -","- C192 H288 Li8 N24 O8 -","8","2","","Kristopher J. Kolonko; Margaret M. Biddle; Ilia A. Guzei; Hans J. Reich","Solution Structures of Lithium Enolates of Cyclopentanone, Cyclohexanone, Acetophenones, and Benzyl Ketones. Triple Ions and Higher Lithiate Complexes","Journal of the American Chemical Society","2009","131","","11525","11534","10.1021/ja903479p","","","0.71073","Cu-Kα","","0.0625","0.0411","","","0.0963","0.1111","","","","","","0.998","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104868","6.5841","0.00012","11.814","0.0002","18.4736","0.0003","90","","90","","90","","1436.96","0.04","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 N3 O3 S -","- C13 H19 N3 O3 S -","- C52 H76 N12 O12 S4 -","4","1","","Takuya Hashimoto; Hisashi Miyamoto; Yuki Naganawa; Keiji Maruoka","Stereoselective Synthesis of α-Alkyl-β-keto Imides via Asymmetric Redox C-C Bond Formation between α-Alkyl-α-diazocarbonyl Compounds and Aldehydes","Journal of the American Chemical Society","2009","131","","11280","11281","10.1021/ja903500w","","","1.54187","CuKα","","","0.0308","","","","0.0813","","","","","","1.16","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104869","7.8202","0.0002","10.7146","0.0003","23.3533","0.0006","90","","91.2291","0.0016","90","","1956.33","0.09","123.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H27 N O4 S -","- C21 H27 N O4 S -","- C84 H108 N4 O16 S4 -","4","2","","Takuya Hashimoto; Hisashi Miyamoto; Yuki Naganawa; Keiji Maruoka","Stereoselective Synthesis of α-Alkyl-β-keto Imides via Asymmetric Redox C-C Bond Formation between α-Alkyl-α-diazocarbonyl Compounds and Aldehydes","Journal of the American Chemical Society","2009","131","","11280","11281","10.1021/ja903500w","","","1.54187","CuKα","","","0.0462","","","","0.1081","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104870","11.581","0.0002","15.0562","0.0003","24.723","0.0005","90","","90","","90","","4310.85","0.14","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H35 N O4 S -","- C21 H35 N O4 S -","- C168 H280 N8 O32 S8 -","8","2","","Takuya Hashimoto; Hisashi Miyamoto; Yuki Naganawa; Keiji Maruoka","Stereoselective Synthesis of α-Alkyl-β-keto Imides via Asymmetric Redox C-C Bond Formation between α-Alkyl-α-diazocarbonyl Compounds and Aldehydes","Journal of the American Chemical Society","2009","131","","11280","11281","10.1021/ja903500w","","","1.54187","CuKα","","","0.038","","","","0.0956","","","","","","1.159","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104871","24.9897","0.0006","15.0876","0.0004","39.2517","0.001","90","","94.208","0.001","90","","14759.4","0.6","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Gd3N@C8.NiOEP.1.5benzene","","","- C123 H53 Gd3 N5 Ni -","- C122.922 H53 Gd2.99 N5 Ni -","- C983.376 H424 Gd23.92 N40 Ni8 -","8","1","","Christine M. Beavers; Manuel N. Chaur; Marilyn M. Olmstead; Luis Echegoyen; Alan L. Balch","Large Metal Ions in a Relatively Small Fullerene Cage: The Structure of Gd3N@C2(22010)-C78 Departs from the Isolated Pentagon Rule","Journal of the American Chemical Society","2009","131","","11519","11524","10.1021/ja903741r","","","0.7749","synchrotron","","0.1203","0.096","","","0.2762","0.3026","","","","","","1.017","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104872","14.0138","0.0004","14.0734","0.0002","25.1493","0.0005","98.207","0.001","105.1","0.001","91.949","0.001","4726.52","0.18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C79.5 H93 F24 N12.5 O8 P4 S4 -","- C79.5 H93 F24 N12.5 O8 P4 S4 -","- C159 H186 F48 N25 O16 P8 S8 -","2","1","","Jason M. Spruell; Walter F. Paxton; John-Carl Olsen; Diego Benítez; Ekaterina Tkatchouk; Charlotte L. Stern; Ali Trabolsi; Douglas C. Friedman; William A. Goddard; J. Fraser Stoddart","A Push-Button Molecular Switch","Journal of the American Chemical Society","2009","131","","11571","11580","10.1021/ja904104c","","","1.54178","CuKα","","0.1078","0.0979","","","0.2589","0.2687","","","","","","1.044","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104873","4.8806","0.0004","18.8242","0.0014","11.1298","0.0008","90","","99.26","0.005","90","","1009.21","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","firefly oxylcuiferin","","","- C10 H6 N2 O2 S2 -","- C10 H6 N2 O2 S2 -","- C40 H24 N8 O8 S8 -","4","1","","Panče Naumov; Yutaka Ozawa; Kei Ohkubo; Shunichi Fukuzumi","Structure and Spectroscopy of Oxyluciferin, the Light Emitter of the Firefly Bioluminescence","Journal of the American Chemical Society","2009","131","","11590","11605","10.1021/ja904309q","","","0.71073","MoKα","","0.0913","0.0524","","","0.1239","0.1412","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104874","6.3027","0.0004","14.8046","0.001","11.6515","0.0007","90","","91.419","0.004","90","","1086.86","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","5-methyloxyluciferin","","","- C11 H8 N2 O2 S2 -","- C11 H8 N2 O2 S2 -","- C44 H32 N8 O8 S8 -","4","1","","Panče Naumov; Yutaka Ozawa; Kei Ohkubo; Shunichi Fukuzumi","Structure and Spectroscopy of Oxyluciferin, the Light Emitter of the Firefly Bioluminescence","Journal of the American Chemical Society","2009","131","","11590","11605","10.1021/ja904309q","","","0.71073","MoKα","","0.0546","0.0337","","","0.0875","0.0984","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104875","14.1478","0.0012","21.5812","0.0019","10.934","0.001","90","","90","","90","","3338.4","0.5","193","2","193","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C36 H40 N2 O4 S Zn -","- C36 H40 N2 O4 S Zn -","- C144 H160 N8 O16 S4 Zn4 -","4","1","","Yunmi Lee; Bo Li; Amir H. Hoveyda","Stereogenic-at-Metal Zn- and Al-Based N-Heterocyclic Carbene (NHC) Complexes as Bifunctional Catalysts in Cu-Free Enantioselective Allylic Alkylations","Journal of the American Chemical Society","2009","131","","11625","11633","10.1021/ja904654j","","","0.71073","MoKα","","0.0952","0.0584","","","0.0996","0.1118","","","","","","1.001","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104876","9.4495","0.0007","15.3667","0.0011","20.6704","0.0015","90","","90","","90","","3001.5","0.4","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H33 Al N2 O3 S -","- C32 H33 Al N2 O3 S -","- C128 H132 Al4 N8 O12 S4 -","4","1","","Yunmi Lee; Bo Li; Amir H. Hoveyda","Stereogenic-at-Metal Zn- and Al-Based N-Heterocyclic Carbene (NHC) Complexes as Bifunctional Catalysts in Cu-Free Enantioselective Allylic Alkylations","Journal of the American Chemical Society","2009","131","","11625","11633","10.1021/ja904654j","","","0.71073","MoKα","","0.071","0.0481","","","0.1027","0.1139","","","","","","1.027","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104877","12.423","0.003","12.716","0.002","12.478","0.002","90","","114.238","0.019","90","","1797.4","0.7","110","","110","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C44 H20 F8 Fe N5 O3 -","- C44 H20 F8 Fe N5 O3 -","- C88 H40 F16 Fe2 N10 O6 -","2","1","","Mark P. Schopfer; Biplab Mondal; Dong-Heon Lee; Amy A. N. Sarjeant; Kenneth D. Karlin","Heme/O2/.NO Nitric Oxide Dioxygenase (NOD) Reactivity: Phenolic Nitration via a Putative Heme-Peroxynitrite Intermediate","Journal of the American Chemical Society","2009","131","","11304","11305","10.1021/ja904832j","","","0.71073","MoKα","","0.0614","0.0473","","","0.1264","0.1331","","","","","","1.064","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104878","8.182","0.004","15.809","0.009","8.773","0.005","90","","94.5764","0.0018","90","","1131.2","1.1","103","2","103","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C15 H10 Cl N -","- C15 H10 Cl N -","- C60 H40 Cl4 N4 -","4","1","","Fumitoshi Kakiuchi; Takuya Kochi; Hitoshi Mutsutani; Noboru Kobayashi; Seiya Urano; Mitsuo Sato; Shigeru Nishiyama; Takamasa Tanabe","Palladium-Catalyzed Aromatic C-H Halogenation with Hydrogen Halides by Means of Electrochemical Oxidation","Journal of the American Chemical Society","2009","131","","11310","11311","10.1021/ja9049228","","","0.7107","MoKα","","0.034","0.0307","","","0.084","0.0865","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104879","8.1561","0.0011","11.9398","0.0009","11.813","0.001","90","","101.498","0.0013","90","","1127.3","0.2","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 Cl N2 -","- C14 H9 Cl N2 -","- C56 H36 Cl4 N8 -","4","1","","Fumitoshi Kakiuchi; Takuya Kochi; Hitoshi Mutsutani; Noboru Kobayashi; Seiya Urano; Mitsuo Sato; Shigeru Nishiyama; Takamasa Tanabe","Palladium-Catalyzed Aromatic C-H Halogenation with Hydrogen Halides by Means of Electrochemical Oxidation","Journal of the American Chemical Society","2009","131","","11310","11311","10.1021/ja9049228","","","0.7107","MoKα","","0.0334","0.029","","","0.0768","0.0798","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104880","9.6015","0.0016","12.896","0.002","16.782","0.003","90","","92.29","0.003","90","","2076.3","0.6","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H29 N O2 -","- C23 H29 N O2 -","- C92 H116 N4 O8 -","4","1","","Anoklase Jean-Luc Ayitou; Josepha L. Jesuraj; Nilotpal Barooah; Angel Ugrinov; J. Sivaguru","Enantiospecific Photochemical Norrish/Yang Type II Reaction of Nonbiaryl Atropchiral α-Oxoamides in Solution-Axial to Point Chirality Transfer","Journal of the American Chemical Society","2009","131","","11314","11315","10.1021/ja9050586","","","0.71073","MoKα","","0.0786","0.0551","","","0.1636","0.1817","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104881","9.857","0.01","15.906","0.016","10.917","0.011","90","","104.238","0.019","90","","1659","3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N O2 -","- C19 H21 N O2 -","- C76 H84 N4 O8 -","4","1","","Anoklase Jean-Luc Ayitou; Josepha L. Jesuraj; Nilotpal Barooah; Angel Ugrinov; J. Sivaguru","Enantiospecific Photochemical Norrish/Yang Type II Reaction of Nonbiaryl Atropchiral α-Oxoamides in Solution-Axial to Point Chirality Transfer","Journal of the American Chemical Society","2009","131","","11314","11315","10.1021/ja9050586","","","0.71073","MoKα","","0.0979","0.069","","","0.1913","0.2252","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104882","8.747","0.005","21.195","0.013","9.869","0.006","90","","114.92","0.012","90","","1659.3","1.7","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N O2 -","- C19 H21 N O2 -","- C76 H84 N4 O8 -","4","1","","Anoklase Jean-Luc Ayitou; Josepha L. Jesuraj; Nilotpal Barooah; Angel Ugrinov; J. Sivaguru","Enantiospecific Photochemical Norrish/Yang Type II Reaction of Nonbiaryl Atropchiral α-Oxoamides in Solution-Axial to Point Chirality Transfer","Journal of the American Chemical Society","2009","131","","11314","11315","10.1021/ja9050586","","","0.71073","MoKα","","0.1079","0.068","","","0.2137","0.2481","","","","","","1.07","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104883","23.583","0.007","23.72","0.007","21.193","0.006","90","","108.667","0.004","90","","11231","6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PdCl2(CNArDipp2)2","","","- C62 H74 Cl2 N2 Pd -","- C62 H74 Cl2 N2 Pd -","- C496 H592 Cl16 N16 Pd8 -","8","2","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","0.71073","MoKα","","0.0688","0.044","","","0.1087","0.1249","","","","","","1.029","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104884","16.388","0.004","16.778","0.004","21.88","0.006","90","","96.164","0.012","90","","5981","3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Pd(CNArDipp2)2","","","- C66 H82 N2 O Pd -","- C66 H82 N2 O Pd -","- C264 H328 N8 O4 Pd4 -","4","1","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","0.71073","MoKα","","0.0903","0.0459","","","0.1064","0.1244","","","","","","1.037","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104885","17.334","0.003","18.742","0.004","19.677","0.004","90","","90","","90","","6393","2","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Pd(Cl)(CH2Ph)(CNArDipp2)2","","","- C73 H89 Cl N2 O Pd -","- C73 H89 Cl N2 O Pd -","- C292 H356 Cl4 N8 O4 Pd4 -","4","1","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","0.71073","MoKα","","0.0486","0.0407","","","0.0784","0.0837","","","","","","1.099","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104886","12.2424","0.001","14.6791","0.0011","18.6713","0.0015","90","","90.998","0.004","90","","3354.9","0.5","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","Pd(Br)(Mes)(CNArDipp2)2","","","- C75 H95 Br N2 O Pd -","- C75 H95 Br N2 O Pd -","- C150 H190 Br2 N4 O2 Pd2 -","2","1","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","1.54178","CuKα","","0.0305","0.0273","","","0.059","0.0603","","","","","","0.995","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104887","13.964","0.003","16.224","0.003","17.605","0.004","67.2","0.03","70.62","0.03","71.18","0.03","3381.1","1.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","[TlPd(CNArDipp2)2]OTf","","","- C63 H74 F3 N2 O3 Pd S Tl -","- C63 H74 F3 N2 O3 Pd S Tl -","- C126 H148 F6 N4 O6 Pd2 S2 Tl2 -","2","1","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","0.71073","MoKα","","0.0628","0.045","","","0.0956","0.1053","","","","","","1.049","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104888","12.285","0.0004","16.4373","0.0006","13.7484","0.0005","90","","95.637","0.002","90","","2762.82","0.17","102","2","102","2","","","","","","","","5","P 1 21 1","P 2yb","4","(O2)Pd(CNArDipp2)2","","","- C62 H74 N2 O2 Pd -","- C62 H74 N2 O2 Pd -","- C124 H148 N4 O4 Pd2 -","2","1","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","1.54178","CuKα","","0.0311","0.0268","","","0.0622","0.0786","","","","","","1.035","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104889","28.359","0.015","17.767","0.009","16.697","0.009","90","","114.925","0.007","90","","7629","7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Pd(ONPh)2(CNArDipp2)2","","","- C78 H94 N4 O3 Pd -","- C78 H94 N4 O3 Pd -","- C312 H376 N16 O12 Pd4 -","4","0.5","","Liezel A. Labios; Matthew D. Millard; Arnold L. Rheingold; Joshua S. Figueroa","Bond Activation, Substrate Addition and Catalysis by an Isolable Two-Coordinate Pd(0) Bis-Isocyanide Monomer","Journal of the American Chemical Society","2009","131","","11318","11319","10.1021/ja905338x","","","0.71073","MoKα","","0.045","0.0373","","","0.129","0.1353","","","","","","1.084","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104890","7.0684","0.0007","23.052","0.0015","18.1015","0.0015","90","0.005","90.643","0.004","90","0.005","2949.3","0.4","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H14 Br N3 O3 -","- C13 H14 Br N3 O3 -","- C104 H112 Br8 N24 O24 -","8","4","","Christopher F. Bender; Francis K. Yoshimoto; Christopher L. Paradise; Jef K. De Brabander","A Concise Synthesis of Berkelic Acid Inspired by Combining the Natural Products Spicifernin and Pulvilloric Acid","Journal of the American Chemical Society","2009","131","","11350","11352","10.1021/ja905387r","","","0.71069","MoKα","","0.1396","0.0636","","","0.11","0.138","","","","","","1.002","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104891","15.817","0.003","17.21","0.003","15.875","0.003","90","","94.079","0.003","90","","4310.4","1.4","293","2","293","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 B Cl6 F4 N P2 Pd S2 -","- C34 H38 B Cl6 F4 N P2 Pd S2 -","- C136 H152 B4 Cl24 F16 N4 P8 Pd4 S8 -","4","1","","Jerzy W. Wiench; Christophe Michon; Arkady Ellern; Paul Hazendonk; Adriana Iuga; Robert J. Angelici; Marek Pruski","Solid-State NMR Investigations of the Immobilization of a BF4- Salt of a Palladium(II) Complex on Silica","Journal of the American Chemical Society","2009","131","","11801","11810","10.1021/ja902982u","","","0.71073","MoKα","","0.0579","0.0442","","","0.1173","0.1305","","","","","","1.044","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104892","9.6443","0.0004","16.8924","0.0008","12.6854","0.0006","90","","107.826","0.002","90","","1967.43","0.16","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H23 B F4 N4 -","- C19 H23 B F4 N4 -","- C76 H92 B4 F16 N16 -","4","1","","Israel Fernández; C. Adam Dyker; Alan DeHope; Bruno Donnadieu; Gernot Frenking; Guy Bertrand","Exocyclic Delocalization at the Expense of Aromaticity in 3,5-bis(π-Donor) Substituted Pyrazolium Ions and Corresponding Cyclic Bent Allenes","Journal of the American Chemical Society","2009","131","","11875","11881","10.1021/ja903396e","","","0.71073","MoKα","","0.0528","0.0417","","","0.122","0.1288","","","","","","1.067","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104893","9.1713","0.0002","10.9023","0.0003","11.3064","0.0003","90","","100.156","0.001","90","","1112.79","0.05","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H24 B2 F8 N4 -","- C19 H24 B2 F8 N4 -","- C38 H48 B4 F16 N8 -","2","1","","Israel Fernández; C. Adam Dyker; Alan DeHope; Bruno Donnadieu; Gernot Frenking; Guy Bertrand","Exocyclic Delocalization at the Expense of Aromaticity in 3,5-bis(π-Donor) Substituted Pyrazolium Ions and Corresponding Cyclic Bent Allenes","Journal of the American Chemical Society","2009","131","","11875","11881","10.1021/ja903396e","","","0.71073","MoKα","","0.0362","0.0344","","","0.0927","0.0943","","","","","","1.043","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104894","7.5453","0.0004","9.7332","0.0006","27.3553","0.0016","90","","90","","90","","2009","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 N3 O6 S2 -","- C20 H19 N3 O6 S2 -","- C80 H76 N12 O24 S8 -","4","1","","Le Li; Madhu Ganesh; Daniel Seidel","Catalytic Enantioselective Synthesis of α,β-Diamino Acid Derivatives","Journal of the American Chemical Society","2009","131","","11648","11649","10.1021/ja9034494","","","0.71073","MoKα","","0.0494","0.0449","","","0.0968","0.0991","","","","","","1","","","","has coordinates","178794","2020-10-21","18:00:00",""
"4104895","11.5766","0.0005","7.3289","0.0003","14.242","0.0007","90","","100.941","0.001","90","","1186.38","0.09","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21.75 H20.5 Cl1.5 N3 O5 S2 -","- C21.74 H20.48 Cl1.48 N3 O5 S2 -","- C43.48 H40.96 Cl2.96 N6 O10 S4 -","2","1","","Le Li; Madhu Ganesh; Daniel Seidel","Catalytic Enantioselective Synthesis of α,β-Diamino Acid Derivatives","Journal of the American Chemical Society","2009","131","","11648","11649","10.1021/ja9034494","","","0.71073","MoKα","","0.0525","0.0461","","","0.1083","0.1121","","","","","","1.009","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104896","8.2055","0.0005","18.3154","0.0011","20.732","0.0012","90","","90","","90","","3115.8","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H36 N4 O7 S3 -","- C28 H36 N4 O7 S3 -","- C112 H144 N16 O28 S12 -","4","1","","Le Li; Madhu Ganesh; Daniel Seidel","Catalytic Enantioselective Synthesis of α,β-Diamino Acid Derivatives","Journal of the American Chemical Society","2009","131","","11648","11649","10.1021/ja9034494","","","0.71073","MoKα","","0.0678","0.0495","","","0.1049","0.113","","","","","","1.005","","","","has coordinates,has disorder","178794","2020-10-21","18:00:00",""
"4104897","27.0173","0.0004","27.0173","0.0004","29.017","0.0005","90","","90","","90","","21180.5","0.6","150","2","150","2","","","","","","","","6","I 4/m m m","-I 4 2","139","[Co32(C40H44S4O4)6(u3-O)24(H2O)24](CHCl3)12(H2O)110","","","- C252 H544 Cl36 Co32 O182 S24 -","- C240 H264 Co32 O72 S24 -","- C480 H528 Co64 O144 S48 -","2","0.0625","","Yanfeng Bi; Xiu-Teng Wang; Wuping Liao; Xiaofei Wang; Xinwu Wang; Hongjie Zhang; Song Gao","A {Co32} Nanosphere Supported by p-tert-Butylthiacalix[4]arene","Journal of the American Chemical Society","2009","131","","11650","11651","10.1021/ja9034939","","","0.71073","MoKα","","0.1007","0.0962","","","0.2726","0.2793","","","","","","1.087","","","","has coordinates","201370","2020-10-21","18:00:00",""
"4104898","25.1839","0.0018","25.1839","0.0018","35.168","0.003","90","","90","","90","","22305","3","150","2","150","2","","","","","","","","6","I 4/m","-I 4","87","[Co32(C40H44S4O4)6(u3-O)24(H2O)24](CHCl3)12(H2O)69","","","- C252 H462 Cl36 Co32 O141 S24 -","- C240 H264 Co32 O72 S24 -","- C480 H528 Co64 O144 S48 -","2","0.125","","Yanfeng Bi; Xiu-Teng Wang; Wuping Liao; Xiaofei Wang; Xinwu Wang; Hongjie Zhang; Song Gao","A {Co32} Nanosphere Supported by p-tert-Butylthiacalix[4]arene","Journal of the American Chemical Society","2009","131","","11650","11651","10.1021/ja9034939","","","0.71073","MoKα","","0.0969","0.0847","","","0.261","0.2731","","","","","","1.067","","","","has coordinates","201370","2020-10-21","18:00:00",""
"4104899","24.567","0.002","24.567","0.002","61.843","0.006","90","","90","","120","","32324","5","153","2","153","2","","","","","","","","5","R -3 :H","-R 3","148","[Co32(C40H44S4O4)6(u3-O)24(H2O)24](C7H8)16(H2O)73","","","- C352 H586 Co32 O145 S24 -","- C240 H264 Co32 O72 S24 -","- C720 H792 Co96 O216 S72 -","3","0.166667","","Yanfeng Bi; Xiu-Teng Wang; Wuping Liao; Xiaofei Wang; Xinwu Wang; Hongjie Zhang; Song Gao","A {Co32} Nanosphere Supported by p-tert-Butylthiacalix[4]arene","Journal of the American Chemical Society","2009","131","","11650","11651","10.1021/ja9034939","","","0.71073","MoKα","","0.21","0.0814","","","0.2128","0.2469","","","","","","0.887","","","","has coordinates","201370","2020-10-21","18:00:00",""
"4104900","7.115","0.001","20.084","0.004","20.49","0.004","90","","90","","90","","2928","0.9","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C12 H36 Cl8 N8 O2 Rh2 Zn -","- C12 H36 Cl8 N8 O2 Rh2 Zn -","- C48 H144 Cl32 N32 O8 Rh8 Zn4 -","4","1","","Marja Hyvärinen; Juha Vaara; Anna Goldammer; Barbara Kutzky; Kaspar Hegetschweiler; Martin Kaupp; Michal Straka","Characteristic Spin-Orbit Induced 1H(CH2) Chemical Shifts upon Deprotonation of Group 9 Polyamine Aqua and Alcohol Complexes","Journal of the American Chemical Society","2009","131","","11909","11918","10.1021/ja903637m","","","0.71073","MoKα","","0.0309","0.0291","","","0.0694","0.0699","","","","","","0.996","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104901","6.539","0.002","13.164","0.004","14.645","0.004","65.821","0.003","79.428","0.004","85.202","0.004","1130.5","0.6","143","2","143","2","","","","","","","","4","P -1","-P 1","2","12-060B","toste02","","- C28 H27 N2 O3 -","- C28 H27 N2 O3 -","- C56 H54 N4 O6 -","2","1","","Nathan D. Shapiro; Yun Shi; F. Dean Toste","Gold-Catalyzed [3+3]-Annulation of Azomethine Imines with Propargyl Esters","Journal of the American Chemical Society","2009","131","","11654","11655","10.1021/ja903863b","","","0.71073","MoKα","","0.1928","0.0822","","","0.1485","0.1907","","","","","","1.009","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4104902","10.4286","0.0017","11.2717","0.0019","11.714","0.002","79.044","0.003","86.108","0.002","88.648","0.003","1348.7","0.4","152","2","152","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H36 N2 O4 -","- C29 H36 N2 O4 -","- C58 H72 N4 O8 -","2","1","","Nathan D. Shapiro; Yun Shi; F. Dean Toste","Gold-Catalyzed [3+3]-Annulation of Azomethine Imines with Propargyl Esters","Journal of the American Chemical Society","2009","131","","11654","11655","10.1021/ja903863b","","","0.71073","MoKα","","0.0794","0.041","","","0.119","0.1484","","","","","","0.964","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104903","7.2741","0.0007","11.956","0.001","13.775","0.002","93.247","0.002","97.858","0.002","104.157","0.003","1145.6","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H30 N6 O3 -","- C23 H30 N6 O3 -","- C46 H60 N12 O6 -","2","1","","Bo Jiang; Shu-Jiang Tu; Parminder Kaur; Walter Wever; Guigen Li","Four-Component Domino Reaction Leading to Multifunctionalized Quinazolines","Journal of the American Chemical Society","2009","131","","11660","11661","10.1021/ja904011s","","","0.71073","MoKα","","0.0874","0.0476","","","0.1083","0.1342","","","","","","1.012","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104904","9.9003","0.0012","14.2621","0.0015","15.4218","0.0019","78.214","0.001","74.135","0.001","89.33","0.002","2048.2","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H51 N9 O5 -","- C43 H51 N9 O5 -","- C86 H102 N18 O10 -","2","1","","Bo Jiang; Shu-Jiang Tu; Parminder Kaur; Walter Wever; Guigen Li","Four-Component Domino Reaction Leading to Multifunctionalized Quinazolines","Journal of the American Chemical Society","2009","131","","11660","11661","10.1021/ja904011s","","","0.71073","MoKα","","0.3341","0.092","","","0.1002","0.1364","","","","","","0.922","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104905","5.58542","0.0001","9.57633","0.00017","18.7881","0.0003","90","","90","","90","","1004.93","0.03","103.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 O2 -","- C12 H14 O2 -","- C48 H56 O8 -","4","1","","I-Hon Chen; Liang Yin; Wataru Itano; Motomu Kanai; Masakatsu Shibasaki","Catalytic Asymmetric Synthesis of Chiral Tertiary Organoboronic Esters through Conjugate Boration of β-Substituted Cyclic Enones","Journal of the American Chemical Society","2009","131","","11664","11665","10.1021/ja9045839","","","1.54187","CuKα","","","0.0327","","","","0.0843","","","","","","1.116","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104906","8.40672","0.00019","10.169","0.0002","17.6972","0.0004","90","","90","","90","","1512.9","0.06","296.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H20 O3 -","- C19 H20 O3 -","- C76 H80 O12 -","4","1","","I-Hon Chen; Liang Yin; Wataru Itano; Motomu Kanai; Masakatsu Shibasaki","Catalytic Asymmetric Synthesis of Chiral Tertiary Organoboronic Esters through Conjugate Boration of β-Substituted Cyclic Enones","Journal of the American Chemical Society","2009","131","","11664","11665","10.1021/ja9045839","","","1.54187","CuKα","","","0.0345","","","","0.0857","","","","","","0.835","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104907","9.0638","0.0007","24.795","0.0018","12.9383","0.0009","90","","94.374","0.001","90","","2899.2","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H26 N6 O6 -","- C32 H26 N6 O6 -","- C128 H104 N24 O24 -","4","1","","Neng-Fang She; Meng Gao; Xiang-Gao Meng; Guang-Fu Yang; Johannes A. A. W. Elemans; An-Xin Wu; Lyle Isaacs","Supramolecular Rhombic Grids Formed from Bimolecular Building Blocks","Journal of the American Chemical Society","2009","131","","11695","11697","10.1021/ja904920r","","","0.71073","MoKα","","0.079","0.0524","","","0.1302","0.1415","","","","","","0.929","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104908","9.1972","0.0008","24.688","0.002","13.7801","0.0012","90","","93.996","0.002","90","","3121.3","0.5","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C68 H48 N12 O12 -","- C68 H48 N12 O12 -","- C136 H96 N24 O24 -","2","0.5","","Neng-Fang She; Meng Gao; Xiang-Gao Meng; Guang-Fu Yang; Johannes A. A. W. Elemans; An-Xin Wu; Lyle Isaacs","Supramolecular Rhombic Grids Formed from Bimolecular Building Blocks","Journal of the American Chemical Society","2009","131","","11695","11697","10.1021/ja904920r","","","0.71073","MoKα","","0.1064","0.054","","","0.1453","0.1659","","","","","","1.027","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104909","13.0506","0.0013","15.4094","0.0015","16.2829","0.0016","90","","97.462","0.002","90","","3246.8","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H26 N6 O5 -","- C38 H26 N6 O5 -","- C152 H104 N24 O20 -","4","1","","Neng-Fang She; Meng Gao; Xiang-Gao Meng; Guang-Fu Yang; Johannes A. A. W. Elemans; An-Xin Wu; Lyle Isaacs","Supramolecular Rhombic Grids Formed from Bimolecular Building Blocks","Journal of the American Chemical Society","2009","131","","11695","11697","10.1021/ja904920r","","","0.71073","MoKα","","0.1644","0.0794","","","0.1935","0.2283","","","","","","0.996","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104910","23.4302","0.0011","16.0237","0.0007","18.8649","0.0009","90","","114.012","0.001","90","","6469.7","0.5","297","2","297","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H30 N6 O6 -","- C32 H30 N6 O6 -","- C256 H240 N48 O48 -","8","1","","Neng-Fang She; Meng Gao; Xiang-Gao Meng; Guang-Fu Yang; Johannes A. A. W. Elemans; An-Xin Wu; Lyle Isaacs","Supramolecular Rhombic Grids Formed from Bimolecular Building Blocks","Journal of the American Chemical Society","2009","131","","11695","11697","10.1021/ja904920r","","","0.71073","MoKα","","0.1169","0.0655","","","0.174","0.1963","","","","","","0.932","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104911","15.154","0.004","8.887","0.002","15.525","0.003","90","","93.895","0.005","90","","2086","0.8","203","2","203","2","","","","","","","","5","P 1 21 1","P 2yb","4","Potassium (R)-1,1'-binaphthyl-2,2'-disulfonate","","","- C20 H12 K2 O7.5 S2 -","- C20 H12 K2 O7.5 S2 -","- C80 H48 K8 O30 S8 -","4","2","","Manabu Hatano; Toshikatsu Maki; Katsuhiko Moriyama; Manabu Arinobe; Kazuaki Ishihara","Pyridinium 1,1'-Binaphthyl-2,2'-disulfonates as Highly Effective Chiral Brønsted Acid-Base Combined Salt Catalysts for Enantioselective Mannich-Type Reaction","Journal of the American Chemical Society","2009","131","","12015","12015","","","","0.71073","MoKα","","0.06","0.0455","","","0.1003","0.1073","","","","","","1.012","","","","has coordinates","187017","2020-10-21","18:00:00",""
"4104912","11.116","0.002","12.684","0.003","17.491","0.003","75.86","0.02","86.89","0.02","73.76","0.02","2295.7","0.8","240","1","240","1","","","","","","","","3","P -1","-P 1","2","Dimitry-71","","","- C36 H85 Si6 -","- C36 H85 Si6 -","- C72 H170 Si12 -","2","1","","Gregory Molev; Boris Tumanskii; Dennis Sheberla; Mark Botoshansky; Dmitry Bravo-Zhivotovskii; Yitzhak Apeloig","Isolable Photoreactive Polysilyl Radicals","Journal of the American Chemical Society","2009","131","","11698","11700","10.1021/ja905097b","","","0.71073","MoKα","","0.3028","0.1523","","","0.3579","0.4056","","","","","","0.937","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104913","12.182","0.002","21.657","0.004","24.212","0.005","90","","90","","90","","6388","2","240","1","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Dimitry-75","","","- C52 H117 Li O4 Si6 -","- C52 H117 Li O4 Si6 -","- C208 H468 Li4 O16 Si24 -","4","1","","Gregory Molev; Boris Tumanskii; Dennis Sheberla; Mark Botoshansky; Dmitry Bravo-Zhivotovskii; Yitzhak Apeloig","Isolable Photoreactive Polysilyl Radicals","Journal of the American Chemical Society","2009","131","","11698","11700","10.1021/ja905097b","","","0.71073","MoKα","","0.2239","0.0725","","","0.1362","0.1785","","","","","","0.867","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104914","13.1","0.004","12.199","0.004","10.354","0.003","90","","93.802","0.004","90","","1651","0.9","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O6 S -","- C16 H18 N2 O6 S -","- C64 H72 N8 O24 S4 -","4","1","","Grant T. Rice; M. Christina White","Allylic C-H Amination for the Preparation of syn-1,3-Amino Alcohol Motifs","Journal of the American Chemical Society","2009","131","","11707","11711","10.1021/ja9054959","","","0.71073","MoKα","","0.0564","0.0355","","","0.091","0.0993","","","","","","1.005","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104915","11.1197","0.0003","5.5098","0.0002","13.7464","0.0004","90","","103.168","0.002","90","","820.06","0.04","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H16 N2 O8 S -","- C14 H16 N2 O8 S -","- C28 H32 N4 O16 S2 -","2","1","","Grant T. Rice; M. Christina White","Allylic C-H Amination for the Preparation of syn-1,3-Amino Alcohol Motifs","Journal of the American Chemical Society","2009","131","","11707","11711","10.1021/ja9054959","","","0.71073","MoKα","","0.0483","0.0355","","","0.0708","0.075","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104916","10.4476","0.0007","10.4476","","10.4476","","90","","90","","90","","1140.38","0.08","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","","- K O7 Ta2 Y -","- K O7 Ta2 Y -","- K8 O56 Ta16 Y8 -","8","0.0416667","","May Nyman; Mark A. Rodriguez; Lauren E. Shea-Rohwer; James E. Martin; Paula P. Provencio","Highly Versatile Rare Earth Tantalate Pyrochlore Nanophosphors","Journal of the American Chemical Society","2009","131","","11652","11653","10.1021/ja903823w","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.05981","","2.61","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4104917","5.43088","","5.43088","","5.43088","","90","","90","","90","","160.181","","","","","","","","","","","","","1","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Si -","- Si -","- Si8 -","8","0.0416667","","May Nyman; Mark A. Rodriguez; Lauren E. Shea-Rohwer; James E. Martin; Paula P. Provencio","Highly Versatile Rare Earth Tantalate Pyrochlore Nanophosphors","Journal of the American Chemical Society","2009","131","","11652","11653","10.1021/ja903823w","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.05981","","2.61","","","","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104918","10.3847","0.0007","10.3847","","10.3847","","90","","90","","90","","1119.91","0.08","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","","- K Lu O7 Ta2 -","- K Lu O7 Ta2 -","- K8 Lu8 O56 Ta16 -","8","0.0416667","","May Nyman; Mark A. Rodriguez; Lauren E. Shea-Rohwer; James E. Martin; Paula P. Provencio","Highly Versatile Rare Earth Tantalate Pyrochlore Nanophosphors","Journal of the American Chemical Society","2009","131","","11652","11653","10.1021/ja903823w","powder diffraction","x-ray","1.5405","Kα~1~","","","","","","","","0.07058","","2.72","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4104919","10.53833","0.00011","10.53833","","10.53833","","90","","90","","90","","1170.35","0.012","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Gd0.5 K0.33 O3.42 Ta -","- Gd0.5 K0.3334 O3.41665 Ta -","- Gd8 K5.3344 O54.6664 Ta16 -","16","0.0833333","","May Nyman; Mark A. Rodriguez; Lauren E. Shea-Rohwer; James E. Martin; Paula P. Provencio","Highly Versatile Rare Earth Tantalate Pyrochlore Nanophosphors","Journal of the American Chemical Society","2009","131","","11652","11653","10.1021/ja903823w","powder diffraction","x-ray","1.54059","Kα~1~","","","","","","","","0.08787","","2.03","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4104920","3.2599","0.0007","3.2599","0.0007","30.116","0.009","90","","90","","120","","277.16","0.12","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C Al O Sc -","- C2 Al2 O2 Sc2 -","- C6 Al6 O6 Sc6 -","3","0.0833333","","Melanie Schroeder; Harald Hillebrecht","Synthesis, Structure, Bonding, and Properties of the Oxide Carbide ScAlOC, a New Type of Compound","Journal of the American Chemical Society","2009","131","","12172","12179","10.1021/ja900206h","","","0.71073","MoKα","","0.0312","0.0212","","","0.039","0.0397","","","","","","0.853","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104921","11.535","0.003","10.241","0.003","23.567","0.007","90","","101.126","0.0011","90","","2731.6","1.3","273","2","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H17 F6 Fe N O6 S2 -","- C28 H17 F6 Fe N O6 S2 -","- C112 H68 F24 Fe4 N4 O24 S8 -","4","1","","Mio Kondo; Maai Uchikawa; Kosuke Namiki; Wen-Wei Zhang; Shoko Kume; Eiji Nishibori; Hiroyuki Suwa; Shinobu Aoyagi; Makoto Sakata; Masaki Murata; Yoshio Kobayashi; Hiroshi Nishihara","Counterion-Dependent Valence Tautomerization of Ferrocenyl-Conjugated Pyrylium Salts","Journal of the American Chemical Society","2009","131","","12112","12124","10.1021/ja900393e","","","0.7107","MoKα","","","0.0609","","","","0.1498","","","","","","1.087","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104922","20.936","0.004","11.511","0.002","8.5179","0.0015","90","","90","","90","","2052.8","0.6","113","2","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H17 B F4 Fe O2 -","- C26 H17 B F4 Fe O2 -","- C104 H68 B4 F16 Fe4 O8 -","4","1","","Mio Kondo; Maai Uchikawa; Kosuke Namiki; Wen-Wei Zhang; Shoko Kume; Eiji Nishibori; Hiroyuki Suwa; Shinobu Aoyagi; Makoto Sakata; Masaki Murata; Yoshio Kobayashi; Hiroshi Nishihara","Counterion-Dependent Valence Tautomerization of Ferrocenyl-Conjugated Pyrylium Salts","Journal of the American Chemical Society","2009","131","","12112","12124","10.1021/ja900393e","","","0.7107","MoKα","","","0.0463","","","","0.0924","","","","","","1.127","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104923","21.098","0.003","11.6557","0.0018","8.5243","0.0013","90","","90","","90","","2096.2","0.5","113","2","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H17 B F4 Fe O2 -","- C26 H17 B F4 Fe O2 -","- C104 H68 B4 F16 Fe4 O8 -","4","1","","Mio Kondo; Maai Uchikawa; Kosuke Namiki; Wen-Wei Zhang; Shoko Kume; Eiji Nishibori; Hiroyuki Suwa; Shinobu Aoyagi; Makoto Sakata; Masaki Murata; Yoshio Kobayashi; Hiroshi Nishihara","Counterion-Dependent Valence Tautomerization of Ferrocenyl-Conjugated Pyrylium Salts","Journal of the American Chemical Society","2009","131","","12112","12124","10.1021/ja900393e","","","0.7107","MoKα","","","0.0438","","","","0.1136","","","","","","1.096","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104924","21.3928","0.0011","11.7972","0.0008","8.7432","0.0005","90","","90","","90","","2206.6","0.2","113","2","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H17 F6 Fe O2 P -","- C26 H17 F6 Fe O2 P -","- C104 H68 F24 Fe4 O8 P4 -","4","1","","Mio Kondo; Maai Uchikawa; Kosuke Namiki; Wen-Wei Zhang; Shoko Kume; Eiji Nishibori; Hiroyuki Suwa; Shinobu Aoyagi; Makoto Sakata; Masaki Murata; Yoshio Kobayashi; Hiroshi Nishihara","Counterion-Dependent Valence Tautomerization of Ferrocenyl-Conjugated Pyrylium Salts","Journal of the American Chemical Society","2009","131","","12112","12124","10.1021/ja900393e","","","0.7107","MoKα","","","0.0387","","","","0.0854","","","","","","1.057","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104925","21.4729","0.0011","11.9441","0.0008","8.7948","0.0005","90","","90","","90","","2255.6","0.2","273","2","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H17 F6 Fe O2 P -","- C26 H17 F6 Fe O2 P -","- C104 H68 F24 Fe4 O8 P4 -","4","1","","Mio Kondo; Maai Uchikawa; Kosuke Namiki; Wen-Wei Zhang; Shoko Kume; Eiji Nishibori; Hiroyuki Suwa; Shinobu Aoyagi; Makoto Sakata; Masaki Murata; Yoshio Kobayashi; Hiroshi Nishihara","Counterion-Dependent Valence Tautomerization of Ferrocenyl-Conjugated Pyrylium Salts","Journal of the American Chemical Society","2009","131","","12112","12124","10.1021/ja900393e","","","0.7107","MoKα","","","0.0414","","","","0.0994","","","","","","1.053","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104926","10.2217","0.0007","14.3059","0.001","16.3729","0.0011","84.928","0.001","85.776","0.001","73.792","0.001","2287.1","0.3","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","(2-dicyclohexylphosphino)-2'-(N,N-dimethylamino)-1,1'-biphenyl)","","- C26 H36 N P -","- C26 H36 N P -","- C104 H144 N4 P4 -","4","2","","Ramendra Pratap; Damon Parrish; Padmaja Gunda; D. Venkataraman; Mahesh K. Lakshman","Influence of Biaryl Phosphine Structure on C-N and C-C Bond Formation","Journal of the American Chemical Society","2009","131","","12240","12249","10.1021/ja902679b","","","0.71073","MoKα","","0.0443","0.0377","","","0.095","0.0998","","","","","","1.035","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104927","10.278","0.002","10.311","0.002","12.886","0.003","74.533","0.003","78.947","0.004","62.497","0.003","1163.7","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(2-dicyclohexylphosphino-4'-(N,N-dimethylamino)-1,1'-biphenyl)","","- C26 H36 N P -","- C26 H36 N P -","- C52 H72 N2 P2 -","2","1","","Ramendra Pratap; Damon Parrish; Padmaja Gunda; D. Venkataraman; Mahesh K. Lakshman","Influence of Biaryl Phosphine Structure on C-N and C-C Bond Formation","Journal of the American Chemical Society","2009","131","","12240","12249","10.1021/ja902679b","","","0.71073","MoKα","","0.0496","0.0412","","","0.1095","0.1153","","","","","","1.051","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4104928","41.026","0.0007","13.029","0.0003","20.375","0.0005","90","","99.81","0.0007","90","","10731.8","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","MKL01","","","- C52 H66 O4 P2 Pd2 -","- C52 H66 O4 P2 Pd2 -","- C416 H528 O32 P16 Pd16 -","8","1","","Ramendra Pratap; Damon Parrish; Padmaja Gunda; D. Venkataraman; Mahesh K. Lakshman","Influence of Biaryl Phosphine Structure on C-N and C-C Bond Formation","Journal of the American Chemical Society","2009","131","","12240","12249","10.1021/ja902679b","","","0.71073","MoKα","","0.0946","0.0443","","","0.1084","0.1495","","","","","","1.034","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104929","10.5058","0.0006","14.2215","0.0013","15.2801","0.0014","100.908","0.004","106.131","0.005","98.363","0.005","2105.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","PG06-34","","","- C22 H29 O2 P Pd -","- C22 H29 O2 P Pd -","- C88 H116 O8 P4 Pd4 -","4","2","","Ramendra Pratap; Damon Parrish; Padmaja Gunda; D. Venkataraman; Mahesh K. Lakshman","Influence of Biaryl Phosphine Structure on C-N and C-C Bond Formation","Journal of the American Chemical Society","2009","131","","12240","12249","10.1021/ja902679b","","","0.71073","MoKα","","0.0896","0.0695","","","0.1655","0.1808","","","","","","1.146","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104930","14.4432","0.0004","17.5999","0.0005","21.5142","0.0006","90","","106.756","0.001","90","","5236.7","0.3","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H38 N O2 P Pd -","- C28 H38 N O2 P Pd -","- C224 H304 N8 O16 P8 Pd8 -","8","1","","Ramendra Pratap; Damon Parrish; Padmaja Gunda; D. Venkataraman; Mahesh K. Lakshman","Influence of Biaryl Phosphine Structure on C-N and C-C Bond Formation","Journal of the American Chemical Society","2009","131","","12240","12249","10.1021/ja902679b","","","1.54178","CuKα","","0.0248","0.0238","","","0.0651","0.0659","","","","","","1.057","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104931","12.1477","0.0005","12.2155","0.0005","15.1806","0.0006","74.541","0.002","72.625","0.002","82.11","0.002","2068.01","0.15","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H45 B F10 P -","- C48 H45 B F10 P -","- C96 H90 B2 F20 P2 -","2","1","","Cornelia M. Mömming; Silke Frömel; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Reactions of an Intramolecular Frustrated Lewis Pair with Unsaturated Substrates: Evidence for a Concerted Olefin Addition Reaction","Journal of the American Chemical Society","2009","131","","12280","12289","10.1021/ja903511s","","","1.54178","CuKα","","0.0521","0.0485","","","0.1296","0.1334","","","","","","1.043","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104932","17.2244","0.0004","12.5179","0.0004","21.0243","0.0007","90","","110.039","0.001","90","","4258.7","0.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H43 B F10 P -","- C46 H43 B F10 P -","- C184 H172 B4 F40 P4 -","4","1","","Cornelia M. Mömming; Silke Frömel; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Reactions of an Intramolecular Frustrated Lewis Pair with Unsaturated Substrates: Evidence for a Concerted Olefin Addition Reaction","Journal of the American Chemical Society","2009","131","","12280","12289","10.1021/ja903511s","","","1.54178","CuKα","","0.0707","0.0563","","","0.1416","0.1541","","","","","","1.033","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104933","33.6177","0.001","12.866","0.0004","16.5773","0.0005","90","","111.635","0.002","90","","6665","0.4","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H34 B F10 O P -","- C36 H34 B F10 O P -","- C288 H272 B8 F80 O8 P8 -","8","1","","Cornelia M. Mömming; Silke Frömel; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Reactions of an Intramolecular Frustrated Lewis Pair with Unsaturated Substrates: Evidence for a Concerted Olefin Addition Reaction","Journal of the American Chemical Society","2009","131","","12280","12289","10.1021/ja903511s","","","1.54178","CuKα","","0.0524","0.0484","","","0.1312","0.1349","","","","","","1.061","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104934","9.4496","0.0003","30.8893","0.0011","12.4289","0.0004","90","","98.642","0.002","90","","3586.7","0.2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H34 B F10 O P -","- C41 H34 B F10 O P -","- C164 H136 B4 F40 O4 P4 -","4","1","","Cornelia M. Mömming; Silke Frömel; Gerald Kehr; Roland Fröhlich; Stefan Grimme; Gerhard Erker","Reactions of an Intramolecular Frustrated Lewis Pair with Unsaturated Substrates: Evidence for a Concerted Olefin Addition Reaction","Journal of the American Chemical Society","2009","131","","12280","12289","10.1021/ja903511s","","","1.54178","CuKα","","0.0709","0.0504","","","0.1134","0.127","","","","","","1.041","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104935","15.5665","0.0004","23.5385","0.0005","33.1929","0.0009","90","","90","","90","","12162.3","0.5","100.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C45 H91.249 O43.6245 -","- C45 H49 O43.6245 -","- C360 H392 O348.996 -","8","2","","Naoki Tomimasu; Akira Kanaya; Yoshinori Takashima; Hiroyasu Yamaguchi; Akira Harada","Social Self-Sorting: Alternating Supramolecular Oligomer Consisting of Isomers","Journal of the American Chemical Society","2009","131","","12339","12343","10.1021/ja903988c","","","1.54187","CuKα","","","0.0698","","","","0.2154","","","","","","1.134","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104936","9.3892","0.0006","10.1178","0.0007","22.411","0.0016","90","","94.508","0.001","90","","2122.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 Au N3 P -","- C24 H19 Au N3 P -","- C96 H76 Au4 N12 P4 -","4","1","","Haifeng Duan; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Triazole-Au(I) Complexes: A New Class of Catalysts with Improved Thermal Stability and Reactivity for Intermolecular Alkyne Hydroamination","Journal of the American Chemical Society","2009","131","","12100","12102","10.1021/ja9041093","","","0.71073","MoKα","","0.0356","0.0315","","","0.0812","0.0849","","","","","","1.059","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104937","12.8722","0.0009","13.3804","0.0009","32.718","0.002","90","","90","","90","","5635.2","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H27 Au N3 P -","- C32 H27 Au N3 P -","- C256 H216 Au8 N24 P8 -","8","1","","Haifeng Duan; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Triazole-Au(I) Complexes: A New Class of Catalysts with Improved Thermal Stability and Reactivity for Intermolecular Alkyne Hydroamination","Journal of the American Chemical Society","2009","131","","12100","12102","10.1021/ja9041093","","","0.71073","MoKα","","0.0423","0.0301","","","0.0751","0.0841","","","","","","1.051","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104938","9.28","0.0006","13.2256","0.0008","14.1159","0.0009","110.107","0.001","104.804","0.001","100.656","0.001","1500.24","0.16","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C28 H27 Au F3 N3 O3 P S -","- C25 H20 Au F3 N3 O3 P S -","- C50 H40 Au2 F6 N6 O6 P2 S2 -","2","1","","Haifeng Duan; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Triazole-Au(I) Complexes: A New Class of Catalysts with Improved Thermal Stability and Reactivity for Intermolecular Alkyne Hydroamination","Journal of the American Chemical Society","2009","131","","12100","12102","10.1021/ja9041093","","","0.71073","MoKα","","0.0418","0.0378","","","0.0998","0.1022","","","","","","1.024","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104939","10.256","0.0012","41.907","0.005","18.538","0.002","90","","97.396","0.003","90","","7901.3","1.6","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C81 H80 B F24 Ir N O4 P -","- C81 H80 B F24 Ir N O4 P -","- C324 H320 B4 F96 Ir4 N4 O16 P4 -","4","2","","Javier Mazuela; J. Johan Verendel; Mercedes Coll; Benjamín Schäffner; Armin Börner; Pher G. Andersson; Oscar Pàmies; Montserrat Diéguez","Iridium Phosphite-Oxazoline Catalysts for the Highly Enantioselective Hydrogenation of Terminal Alkenes","Journal of the American Chemical Society","2009","131","","12344","12353","10.1021/ja904152r","","","0.71073","MoKα","","0.0648","0.0525","","","0.1289","0.1342","","","","","","1.017","","","","has coordinates,has disorder","288243","2023-12-12","09:57:14",""
"4104940","13.5426","0.0013","7.7407","0.0007","14.5124","0.0014","90","","114.739","0.002","90","","1381.7","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C68 H60 N4 O16 -","4","1","","Yagang Zhang; Judith M. Lavin; Ken D. Shimizu","Solvent Programmable Polymers Based on Restricted Rotation","Journal of the American Chemical Society","2009","131","","12062","12063","10.1021/ja904234w","","","0.71073","MoKα","","0.0461","0.0408","","","0.109","0.1128","","","","","","1.072","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104941","6.7979","0.0005","8.0996","0.0007","26.069","0.002","90","","96.837","0.004","90","","1425.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C3 H5 Cl N O2 Rh -","- C3 H5 Cl N O2 Rh -","- C24 H40 Cl8 N8 O16 Rh8 -","8","2","","Kwonho Jang; Il Gu Jung; Hye Jin Nam; Duk-Young Jung; Seung Uk Son","One-Dimensional Organometallic Molecular Wires via Assembly of Rh(CO)2Cl(amine): Chemical Control of Interchain Distances and Optical Properties","Journal of the American Chemical Society","2009","131","","12046","12047","10.1021/ja904247e","","","0.71073","MoKα","","0.1147","0.0724","","","0.1635","0.1824","","","","","","1.065","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104942","7.966","0.002","8.544","0.002","31.115","0.008","90","","90","","90","","2117.7","0.9","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","09082a","","","- C20 H23 Br4 N -","- C20 H23 Br4 N -","- C80 H92 Br16 N4 -","4","1","","Barry M. Trost; David A. Thaisrivongs","Palladium-Catalyzed Regio-, Diastereo-, and Enantioselective Benzylic Allylation of 2-Substituted Pyridines","Journal of the American Chemical Society","2009","131","","12056","12057","10.1021/ja904441a","","","0.71073","MoKα","","0.0331","0.0265","","","0.0552","0.0573","","","","","","1.077","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104943","12.628","0.004","12.917","0.005","14.498","0.006","82.04","0.03","73.07","0.02","65.24","0.02","2054","1.4","93","","","","","","","","","","","6","P 1","P 1","1","","","","- C38 H56 Cl6 Mn N2 O2 -","- C38 H56 Cl6 Mn N2 O2 -","- C76 H112 Cl12 Mn2 N4 O4 -","2","2","","Takuya Kurahashi; Masahiko Hada; Hiroshi Fujii","Critical Role of External Axial Ligands in Chirality Amplification of trans-Cyclohexane-1,2-diamine in Salen Complexes","Journal of the American Chemical Society","2009","131","","12394","12405","10.1021/ja904635n","","","0.7107","MoKα","","","0.0842","","","","0.2474","","","","","","1.093","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104944","8.5312","0.0004","13.4133","0.0007","19.9001","0.001","90","","90","","90","","2277.2","0.2","93.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H24 Mn N8 O2 -","- C22 H24 Mn N8 O2 -","- C88 H96 Mn4 N32 O8 -","4","1","","Takuya Kurahashi; Masahiko Hada; Hiroshi Fujii","Critical Role of External Axial Ligands in Chirality Amplification of trans-Cyclohexane-1,2-diamine in Salen Complexes","Journal of the American Chemical Society","2009","131","","12394","12405","10.1021/ja904635n","","","0.7107","MoKα","","","0.0381","","","","0.0946","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104945","9.671","0.002","23.135","0.005","10.267","0.002","90","0.0014","95.5892","0.0015","90","0.0014","2286.2","0.8","93.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C44 H62 F6 Mn N4 O4 -","- C44 H62 F6 Mn N4 O4 -","- C88 H124 F12 Mn2 N8 O8 -","2","1","","Takuya Kurahashi; Masahiko Hada; Hiroshi Fujii","Critical Role of External Axial Ligands in Chirality Amplification of trans-Cyclohexane-1,2-diamine in Salen Complexes","Journal of the American Chemical Society","2009","131","","12394","12405","10.1021/ja904635n","","","0.7107","MoKα","","","0.0499","","","","0.1418","","","","","","0.897","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104946","11.3472","0.0003","21.915","0.0005","20.9629","0.0005","90","","101.536","0.001","90","","5107.6","0.2","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Y@C82Ad-A","Y@C82Ad-A","","- C94.5 H14 S5 Y -","- C94.58 H14 S5 Y -","- C378.32 H56 S20 Y4 -","4","1","","Xing Lu; Hidefumi Nikawa; Lai Feng; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Naomi Mizorogi; Zdenek Slanina; Shigeru Nagase","Location of the Yttrium Atom in Y@C82 and Its Influence on the Reactivity of Cage Carbons","Journal of the American Chemical Society","2009","131","","12066","12067","10.1021/ja905001w","","x-ray","0.71075","MoKα","","0.0772","0.0647","","","0.1611","0.1732","","","","","","1.057","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104947","10.914","0.002","7.502","0.002","11.151","0.003","90","","112.923","0.007","90","","840.9","0.4","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl 4-O-acetyl-2-azido-3-O-benzyl-2-deoxy-1-lactone‒ D-mannopyranosyluronate","","- C16 H17 N3 O7 -","- C16 H17 N3 O7 -","- C32 H34 N6 O14 -","2","1","","Marthe T. C. Walvoort; Gerrit Lodder; Jaroslaw Mazurek; Herman S. Overkleeft; Jeroen D. C. Codée; Gijsbert A. van der Marel","Equatorial Anomeric Triflates from Mannuronic Acid Esters","Journal of the American Chemical Society","2009","131","","12080","12081","10.1021/ja905008p","","","0.71073","MoKα","","0.0561","0.043","","","0.0926","0.0999","","","","","","1.039","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104948","10.989","0.002","7.718","0.002","11.376","0.003","90","","115.766","0.007","90","","868.9","0.4","300","2","300","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl 4-O-acetyl-2-azido-3-O-benzyl-2-deoxy‒ 1-lactone-D-mannopyranosyluronate","","- C16 H17 N3 O7 -","- C16 H17 N3 O7 -","- C32 H34 N6 O14 -","2","1","","Marthe T. C. Walvoort; Gerrit Lodder; Jaroslaw Mazurek; Herman S. Overkleeft; Jeroen D. C. Codée; Gijsbert A. van der Marel","Equatorial Anomeric Triflates from Mannuronic Acid Esters","Journal of the American Chemical Society","2009","131","","12080","12081","10.1021/ja905008p","","","0.71073","MoKα","","0.0419","0.0338","","","0.0861","0.0909","","","","","","1.042","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104949","10.5972","0.0011","13.1485","0.0013","16.0477","0.0016","90","","90","","90","","2236","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H33 Br O6 -","- C21 H33 Br O6 -","- C84 H132 Br4 O24 -","4","1","","Jessica Tanuwidjaja; Sze-Sze Ng; Timothy F. Jamison","Total Synthesis of ent-Dioxepandehydrothyrsiferol via a Bromonium-Initiated Epoxide-Opening Cascade","Journal of the American Chemical Society","2009","131","","12084","12085","10.1021/ja9052366","","","0.71073","MoKα","","0.039","0.0326","","","0.0817","0.0844","","","","","","1.043","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104950","14.4934","0.0006","14.5117","0.0005","17.8874","0.0006","90","","90","","90","","3762.1","0.2","100","","100","","","","","","","","","6","P c c n","-P 2ab 2ac","56","SCOF-2rs.Et 100K","","","- C36 H32 Fe N6 O7 S2 -","- C36 H32 Fe N6 O7 S2 -","- C144 H128 Fe4 N24 O28 S8 -","4","0.5","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Guest Tunable Structure and Spin Crossover Properties in a Nanoporous Coordination Framework Material","Journal of the American Chemical Society","2009","131","","12106","12108","10.1021/ja905360g","","","0.71073","MoKα","","0.1209","0.1088","","","0.2166","0.226","","","","","","1.103","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104951","14.6829","0.001","14.6829","0.001","17.92","0.003","90","","90","","90","","3863.3","0.7","200","2","200","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","SCOF-2(Acn)as","","","- C34 H32 Fe N8 O4 S2 -","- C34 H32 Fe N8 O4 S2 -","- C136 H128 Fe4 N32 O16 S8 -","4","0.25","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Guest Tunable Structure and Spin Crossover Properties in a Nanoporous Coordination Framework Material","Journal of the American Chemical Society","2009","131","","12106","12108","10.1021/ja905360g","","","0.71073","MoKα","","0.1699","0.0779","","","0.204","0.3215","","","","","","1.092","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104952","14.639","0.005","14.639","0.005","17.851","0.012","90","","90","","90","","3825","3","200","2","200","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","SCOF-2(Et)as","","","- C36 H32 Fe N6 O7 S2 -","- C36 H32 Fe N6 O7 S2 -","- C144 H128 Fe4 N24 O28 S8 -","4","0.25","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Guest Tunable Structure and Spin Crossover Properties in a Nanoporous Coordination Framework Material","Journal of the American Chemical Society","2009","131","","12106","12108","10.1021/ja905360g","","","0.71073","MoKα","","0.1918","0.088","","","0.2308","0.3644","","","","","","1.133","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104953","14.675","0.003","14.675","0.003","17.984","0.007","90","","90","","90","","3873","1.9","200","2","200","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","SCOF-2(Me)as","","","- C33 H32 Fe N6 O7 S2 -","- C33 H32 Fe N6 O7 S2 -","- C132 H128 Fe4 N24 O28 S8 -","4","0.25","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Guest Tunable Structure and Spin Crossover Properties in a Nanoporous Coordination Framework Material","Journal of the American Chemical Society","2009","131","","12106","12108","10.1021/ja905360g","","","0.71073","MoKα","","0.1852","0.079","","","0.191","0.3054","","","","","","1.11","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104954","14.726","0.001","14.726","0.001","17.899","0.003","90","","90","","90","","3881.5","0.7","220","2","220","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","SCOF-2(Pr)as","","","- C33 H32 Fe N6 O5 S2 -","- C33 H32 Fe N6 O5 S2 -","- C132 H128 Fe4 N24 O20 S8 -","4","0.25","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Guest Tunable Structure and Spin Crossover Properties in a Nanoporous Coordination Framework Material","Journal of the American Chemical Society","2009","131","","12106","12108","10.1021/ja905360g","","","0.71073","MoKα","","0.1516","0.0806","","","0.2323","0.3396","","","","","","1.138","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104955","14.3578","0.0006","14.3904","0.0005","17.8813","0.0007","90","","90","","90","","3694.5","0.2","100","","100","","","","","","","","","6","P c c n","-P 2ab 2ac","56","SCOF-2rs.Me 100K","","","- C33 H32 Fe N6 O7 S2 -","- C33 H32 Fe N6 O7 S2 -","- C132 H128 Fe4 N24 O28 S8 -","4","0.5","","Suzanne M. Neville; Gregory J. Halder; Karena W. Chapman; Martin B. Duriska; Boujemaa Moubaraki; Keith S. Murray; Cameron J. Kepert","Guest Tunable Structure and Spin Crossover Properties in a Nanoporous Coordination Framework Material","Journal of the American Chemical Society","2009","131","","12106","12108","10.1021/ja905360g","","","0.71073","MoKα","","0.104","0.0631","","","0.172","0.1988","","","","","","1.051","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104956","8.817","0.003","17.774","0.006","22.892","0.008","90","","90","","90","","3587","2","173.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C38 H40 Cl N O11 -","- C38 H40 Cl N O11 -","- C152 H160 Cl4 N4 O44 -","4","1","","Kazuo Komano; Satoshi Shimamura; Yutaro Norizuki; Donglin Zhao; Chizuko Kabuto; Itaru Sato; Masahiro Hirama","Total Synthesis and Structure Revision of the (-)-Maduropeptin Chromophore","Journal of the American Chemical Society","2009","131","","12072","12073","10.1021/ja905397p","","","0.7107","MoKα","","","0.0564","","","","0.0762","","","","","","0.901","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104957","26.28791","0.00029","26.28791","","26.28791","","90","","90","","90","","18166.4","0.2","4","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C6 H2 Cu O4 -","- C6 H2 Cu O4 -","- C288 H96 Cu48 O192 -","48","0.25","","Shengchang Xiang; Wei Zhou; Jose M. Gallegos; Yun Liu; Banglin Chen","Exceptionally High Acetylene Uptake in a Microporous Metal-Organic Framework with Open Metal Sites","Journal of the American Chemical Society","2009","131","","12415","12419","10.1021/ja904782h","powder diffraction","neutron","2.0782","","","","","","","","","0.06467","","0.91","","","","","","","has coordinates,has Fobs","178795","2020-10-21","18:00:00",""
"4104958","26.3256","0.00023","26.3256","","26.3256","","90","","90","","90","","18244.6","0.16","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C7.12 H2 Cu D1.12 O4 -","- C7.12184 H2 Cu D1.12184 O4 -","- C341.848 H96 Cu48 D53.8483 O192 -","48","0.25","","Shengchang Xiang; Wei Zhou; Jose M. Gallegos; Yun Liu; Banglin Chen","Exceptionally High Acetylene Uptake in a Microporous Metal-Organic Framework with Open Metal Sites","Journal of the American Chemical Society","2009","131","","12415","12419","10.1021/ja904782h","powder diffraction","neutron","2.0782","","","","","","","","","0.05933","","0.92","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4104959","26.33858","0.00031","26.33858","","26.33858","","90","","90","","90","","18271.6","0.2","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C8.31 H2 Cu D2.3 O4 -","- C8.305 H2 Cu D2.30464 O4 -","- C398.64 H96 Cu48 D110.623 O192 -","48","0.25","","Shengchang Xiang; Wei Zhou; Jose M. Gallegos; Yun Liu; Banglin Chen","Exceptionally High Acetylene Uptake in a Microporous Metal-Organic Framework with Open Metal Sites","Journal of the American Chemical Society","2009","131","","12415","12419","10.1021/ja904782h","powder diffraction","neutron","2.0782","","","","","","","","","0.09464","","1.18","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4104960","12.86","0.0009","14.4333","0.0006","19.2986","0.0013","90","","101.673","0.005","90","","3508","0.4","293","2","293","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C32 H21 Cl F12 I2 N Ni O P -","- C32 H21 Cl F12 I2 N Ni O P -","- C128 H84 Cl4 F48 I8 N4 Ni4 O4 P4 -","4","1","","Andreas Berkefeld; Matthias Drexler; Heiko M. Möller; Stefan Mecking","Mechanistic Insights on the Copolymerization of Polar Vinyl Monomers with Neutral Ni(II) Catalysts","Journal of the American Chemical Society","2009","131","","12613","12622","10.1021/ja901360b","","","0.71073","MoKα","","0.0692","0.0434","","","0.1213","0.141","","","","","","0.958","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104961","15.2527","0.0004","17.7608","0.0006","17.9335","0.0007","70.384","0.001","68.897","0.001","81.386","0.001","4267","0.2","153","2","153","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","CoC60C6H4tBu5COCO","","- C127 H77 Cl2.5 Co O2 -","- C127 H77 Cl2.5 Co O2 -","- C254 H154 Cl5 Co2 O4 -","2","1","","Yutaka Matsuo; Masashi Maruyama; S. Shankara Gayathri; Tomoya Uchida; Dirk M. Guldi; Hideo Kishida; Arao Nakamura; Eiichi Nakamura","π-Conjugated Multidonor/Acceptor Arrays of Fullerene-Cobaltadithiolene-Tetrathiafulvalene: From Synthesis and Structure to Electronic Interactions","Journal of the American Chemical Society","2009","131","","12643","12649","10.1021/ja902312q","","x-ray","0.71073","MoKα","","0.0869","0.0673","","","0.1971","0.2176","","","","","","1.093","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104962","40.931","0.003","18.8015","0.0014","23.723","0.0016","90","","108.671","0.002","90","","17296","2","153","2","153","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","Ar5C60CoS2C2S2C2S2C2S2CoC60Ar5_CS2_C6H6","","- C240 H142 Co2 S12 -","- C240 H142 Co2 S12 -","- C960 H568 Co8 S48 -","4","0.5","","Yutaka Matsuo; Masashi Maruyama; S. Shankara Gayathri; Tomoya Uchida; Dirk M. Guldi; Hideo Kishida; Arao Nakamura; Eiichi Nakamura","π-Conjugated Multidonor/Acceptor Arrays of Fullerene-Cobaltadithiolene-Tetrathiafulvalene: From Synthesis and Structure to Electronic Interactions","Journal of the American Chemical Society","2009","131","","12643","12649","10.1021/ja902312q","","x-ray","0.71075","MoKα","","0.2557","0.1699","","","0.4263","0.4839","","","","","","1.485","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104963","9.297","0.002","12.066","0.003","18.576","0.005","103.632","0.004","103.712","0.004","95.549","0.004","1941.5","0.8","190","2","190","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H52 Fe N2 -","- C48 H52 Fe N2 -","- C96 H104 Fe2 N4 -","2","1","","W. Alexander Merrill; Troy A. Stich; Marcin Brynda; Gregory J. Yeagle; James C. Fettinger; Raymond De Hont; William M. Reiff; Charles E. Schulz; R. David Britt; Philip P. Power","Direct Spectroscopic Observation of Large Quenching of First-Order Orbital Angular Momentum with Bending in Monomeric, Two-Coordinate Fe(II) Primary Amido Complexes and the Profound Magnetic Effects of the Absence of Jahn- and Renner-Teller Distortions in Rigorously Linear Coordination","Journal of the American Chemical Society","2009","131","","12693","12702","10.1021/ja903439t","","","0.71073","MoKα","","0.0845","0.0695","","","0.1805","0.1868","","","","","","1.099","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104964","12.9432","0.0009","17.715","0.0012","14.6698","0.001","90","","113.157","0.001","90","","3092.6","0.4","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72 H100 Fe N2 -","- C72 H100 Fe N2 -","- C144 H200 Fe2 N4 -","2","0.5","","W. Alexander Merrill; Troy A. Stich; Marcin Brynda; Gregory J. Yeagle; James C. Fettinger; Raymond De Hont; William M. Reiff; Charles E. Schulz; R. David Britt; Philip P. Power","Direct Spectroscopic Observation of Large Quenching of First-Order Orbital Angular Momentum with Bending in Monomeric, Two-Coordinate Fe(II) Primary Amido Complexes and the Profound Magnetic Effects of the Absence of Jahn- and Renner-Teller Distortions in Rigorously Linear Coordination","Journal of the American Chemical Society","2009","131","","12693","12702","10.1021/ja903439t","","","0.71073","MoKα","","0.0637","0.0442","","","0.1107","0.1234","","","","","","1.077","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104965","17.218","0.004","14.076","0.003","18.067","0.004","90","","92.848","0.004","90","","4373.3","1.7","151","2","151","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H27 N2 Rh -","- C29 H27 N2 Rh -","- C232 H216 N16 Rh8 -","8","1","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.71073","MoKα","","0.1224","0.0614","","","0.1322","0.1682","","","","","","0.958","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104966","17.3745","0.0015","14.1163","0.0012","17.9468","0.0016","90","","93.433","0.002","90","","4393.8","0.7","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H27 Ir N2 -","- C29 H27 Ir N2 -","- C232 H216 Ir8 N16 -","8","1","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.71073","MoKα","","0.0454","0.0347","","","0.0899","0.0947","","","","","","1.033","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104967","11.817","0.001","15.419","0.002","25.088","0.003","90","","93.571","0.002","90","","4562.3","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H45 N2 Rh Si2 -","- C57 H45 N2 Rh Si2 -","- C228 H180 N8 Rh4 Si8 -","4","1","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.7107","MoKα","","0.1003","0.0497","","","0.0966","0.1127","","","","","","0.958","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104968","15.0745","0.0007","13.881","0.0007","22.165","0.001","90","","95.978","0.001","90","","4612.8","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C53 H53 N2 Rh Si2 -","- C53 H53 N2 Rh Si2 -","- C212 H212 N8 Rh4 Si8 -","4","1","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.7107","MoKα","","0.054","0.0377","","","0.0937","0.105","","","","","","1.019","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104969","11.9089","0.0011","15.3952","0.0014","25.034","0.002","90","","93.419","0.001","90","","4581.6","0.7","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H47 Ir N2 Si2 -","- C57 H47 Ir N2 Si2 -","- C228 H188 Ir4 N8 Si8 -","4","1","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.71073","MoKα","","0.0437","0.0318","","","0.081","0.101","","","","","","1.008","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104970","17.0919","0.0015","12.7726","0.0011","20.3881","0.0018","90","","107.434","0.001","90","","4246.4","0.6","157","2","157","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H50 N4 Rh2 Si -","- C50 H50 N4 Rh2 Si -","- C200 H200 N16 Rh8 Si4 -","4","0.5","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.71073","MoKα","","0.0549","0.0391","","","0.0955","0.103","","","","","","1.024","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104971","11.7915","0.001","13.4246","0.0011","13.5335","0.0011","61.518","0.001","68.25","0.001","75.752","0.002","1742.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H70 N4 Rh2 Si2 -","- C88 H70 N4 Rh2 Si2 -","- C88 H70 N4 Rh2 Si2 -","1","0.5","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.71073","MoKα","","0.0587","0.046","","","0.1182","0.1234","","","","","","1.038","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104972","35.521","0.006","12.568","0.002","25.217","0.004","90","","99.028","0.002","90","","11118","3","149","2","149","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C61.8 H49.8 N2 P Rh Si -","- C61.8 H49.8 N2 P Rh Si -","- C494.4 H398.4 N16 P8 Rh8 Si8 -","8","1","","Jennifer L. McBee; Jose Escalada; T. Don Tilley","High Oxidation State Rhodium and Iridium Bis(silyl)dihydride Complexes Supported by a Chelating Pyridyl-Pyrrolide Ligand","Journal of the American Chemical Society","2009","131","","12703","12713","10.1021/ja9035169","","","0.71073","MoKα","","0.0844","0.0778","","","0.2301","0.2413","","","","","","1.152","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104973","4.9495","0.0004","11.5335","0.0008","12.6368","0.0009","105.023","0.003","100.037","0.003","92.006","0.004","683.61","0.09","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H34 O4 -","- C36 H34 O4 -","- C36 H34 O4 -","1","0.5","","Chih-Ming Chou; Shern-Long Lee; Chih-Hsien Chen; Akkattu Thankappan Biju; Hsian-Wen Wang; Yi-Lin Wu; Guo-Fu Zhang; Kuang-Wei Yang; Tsong-Shin Lim; Min-Jie Huang; Po-Yu Tsai; Kin-Chuan Lin; Shou-Ling Huang; Chun-hsien Chen; Tien-Yau Luh","Polymeric Ladderphanes","Journal of the American Chemical Society","2009","131","","12579","12585","10.1021/ja9035362","","","0.71073","MoKα","","0.1226","0.0752","","","0.1834","0.2216","","","","","","1.088","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104974","29.8146","0.0005","29.8146","0.0005","6.9588","0.0001","90","","90","","90","","6185.75","0.17","150","","150","","","","","","","","?","5","I 41/a :2","-I 4ad","88","","caesium copper(I) silver(I) cyanide Cs3Ag2Cu3(CN)8","","- C24 Ag6 Cs9 Cu9 N24 -","- C24 Ag6 Cs9 Cu9 N24 -","- C96 Ag24 Cs36 Cu36 N96 -","4","0.25","","Ann M. Chippindale; Simon J. Hibble","Helices, Chirality and Interpenetration: the Versatility and Remarkable Interconversion of Silver-Copper Cyanide Frameworks","Journal of the American Chemical Society","2009","131","","12736","12744","10.1021/ja903841e","","","0.71073","MoKα","","0.0474","0.0379","","0.0505","0.0466","0.0466","","","","","","0.9729","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104975","6.976","0.0001","10.8809","0.0002","15.4101","0.0003","80.1383","0.0008","85.2979","0.0008","86.04","0.001","1146.74","0.03","150","2","150","","","","","","","","?","7","P -1","-P 1","2","","caesium copper(I) silver(I) cyanide hydrate, CsAgCu(CN)3.1/3H2O","","- C9 H2 Ag3 Cs3 Cu3 N9 O -","- C9 H2 Ag3 Cs3 Cu3 N9 O -","- C18 H4 Ag6 Cs6 Cu6 N18 O2 -","2","1","","Ann M. Chippindale; Simon J. Hibble","Helices, Chirality and Interpenetration: the Versatility and Remarkable Interconversion of Silver-Copper Cyanide Frameworks","Journal of the American Chemical Society","2009","131","","12736","12744","10.1021/ja903841e","","","0.71073","MoKα","","0.0386","0.0336","","0.0452","0.0416","0.0416","","","","","","1.0285","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4104976","7.2298","0.0003","7.2298","0.0003","24.6254","0.0008","90","","90","","120","","1114.72","0.07","150","2","150","2","","","","","","","?","5","P 61 2 2","P 61 2 (0 0 5)","178","","caesium copper(I) silver(I) cyanide, CsAgCu(CN)3","","- C9 Ag3 Cs3 Cu3 N9 -","- C9 Ag3 Cs3 Cu3 N9 -","- C18 Ag6 Cs6 Cu6 N18 -","2","0.166667","","Ann M. Chippindale; Simon J. Hibble","Helices, Chirality and Interpenetration: the Versatility and Remarkable Interconversion of Silver-Copper Cyanide Frameworks","Journal of the American Chemical Society","2009","131","","12736","12744","10.1021/ja903841e","","","0.71073","MoKα","","0.0259","0.0215","","0.0273","0.0248","0.0248","","","","","","1.0165","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4104977","9.642","0.001","12.0145","0.0013","15.1903","0.0016","86.042","0.002","83.851","0.002","74.685","0.002","1685.9","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H41 Cl4 Co2 N6 O18 P -","- C19 H39 Cl4 Co2 N6 O18 P -","- C38 H78 Cl8 Co4 N12 O36 P2 -","2","1","","Guoqiang Feng; Eric A. Tanifum; Harry Adams; Alvan C. Hengge; Nicholas H. Williams","Mechanism and Transition State Structure of Aryl Methylphosphonate Esters Doubly Coordinated to a Dinuclear Cobalt(III) Center","Journal of the American Chemical Society","2009","131","","12771","12779","10.1021/ja904134n","","","0.71073","MoKα","","0.0726","0.0509","","","0.1406","0.1515","","","","","","1.101","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104978","10.3104","0.0008","18.2269","0.0016","19.6351","0.0017","69.55","0.003","76.632","0.003","73.969","0.002","3285.6","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H41 Cl3 Co2 N6 O17.5 P -","- C19 H40 Cl3 Co2 N6 O17.5 P -","- C76 H160 Cl12 Co8 N24 O70 P4 -","4","2","","Guoqiang Feng; Eric A. Tanifum; Harry Adams; Alvan C. Hengge; Nicholas H. Williams","Mechanism and Transition State Structure of Aryl Methylphosphonate Esters Doubly Coordinated to a Dinuclear Cobalt(III) Center","Journal of the American Chemical Society","2009","131","","12771","12779","10.1021/ja904134n","","","0.71073","MoKα","","0.1062","0.0503","","","0.117","0.137","","","","","","0.842","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104979","10.615","0.0011","14.5889","0.0015","29.856","0.003","90","","90.395","0.017","90","","4623.4","0.8","93.15","","93.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H42 Cd2 N6 O19 -","- C34 H24 Cd2 N6 O19 -","- C136 H96 Cd8 N24 O76 -","4","1","","Joobeom Seo; Ryotaro Matsuda; Hirotoshi Sakamoto; Charlotte Bonneau; Susumu Kitagawa","A Pillared-Layer Coordination Polymer with a Rotatable Pillar Acting as a Molecular Gate for Guest Molecules","Journal of the American Chemical Society","2009","131","","12792","12800","10.1021/ja904363b","","","0.710747","MoKα","","0.0735","0.0692","","","0.1829","0.1874","","","","","","1.056","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104980","10.236","0.002","14.827","0.003","25.877","0.005","90","","95.45","0.03","90","","3909.6","1.3","293","2","93.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H34 Cd2 N5 O18 -","- C34 H24 Cd2 N6 O17 -","- C136 H96 Cd8 N24 O68 -","4","1","","Joobeom Seo; Ryotaro Matsuda; Hirotoshi Sakamoto; Charlotte Bonneau; Susumu Kitagawa","A Pillared-Layer Coordination Polymer with a Rotatable Pillar Acting as a Molecular Gate for Guest Molecules","Journal of the American Chemical Society","2009","131","","12792","12800","10.1021/ja904363b","","","0.710747","MoKα","","0.0849","0.0663","","","0.1766","0.1954","","","","","","1.074","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104981","10.701","0.008","14.17","0.011","22.205","0.017","90","","98.117","0.013","90","","3333","4","293","2","378.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 Cd2 N6 O12 -","- C32 H24 Cd2 N6 O12 -","- C128 H96 Cd8 N24 O48 -","4","1","","Joobeom Seo; Ryotaro Matsuda; Hirotoshi Sakamoto; Charlotte Bonneau; Susumu Kitagawa","A Pillared-Layer Coordination Polymer with a Rotatable Pillar Acting as a Molecular Gate for Guest Molecules","Journal of the American Chemical Society","2009","131","","12792","12800","10.1021/ja904363b","","","0.710747","MoKα","","0.1288","0.1006","","","0.2613","0.2911","","","","","","1.099","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104982","10.261","0.002","14.825","0.003","25.931","0.005","90","","95.4","0.03","90","","3927.1","1.4","293","2","93.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Cd2 N6 O17 -","- C32 H25 Cd2 N6 O17 -","- C128 H100 Cd8 N24 O68 -","4","1","","Joobeom Seo; Ryotaro Matsuda; Hirotoshi Sakamoto; Charlotte Bonneau; Susumu Kitagawa","A Pillared-Layer Coordination Polymer with a Rotatable Pillar Acting as a Molecular Gate for Guest Molecules","Journal of the American Chemical Society","2009","131","","12792","12800","10.1021/ja904363b","","","0.710747","MoKα","","0.1597","0.1202","","","0.2961","0.34","","","","","","1.073","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104983","19.4191","0.0002","19.4191","0.0002","16.2612","0.0002","90","","90","","90","","6132.12","0.12","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","3","P 41 21 2","P 4abw 2nw","92","","","","- C14 H26 O4 -","- C14 H26 O4 -","- C224 H416 O64 -","16","2","","Timothy J. Donohoe; Robert M. Harris; Oliver Williams; Gráinne C. Hargaden; Jeremy Burrows; Jeremy Parker","Concise Syntheses of the Natural Products (+)-Sylvaticin and (+)-cis-Sylvaticin","Journal of the American Chemical Society","2009","131","","12854","12861","10.1021/ja9049959","","","0.71073","MoKα","","0.0551","0.0365","","0.0605","0.0468","0.0468","","","","","","1.095","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4104984","24.1131","0.0008","15.1598","0.0006","20.9379","0.0007","90","","111.258","0.002","90","","7133.1","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C78 H102 Mo2 N4 -","- C78 H102 Mo2 N4 -","- C312 H408 Mo8 N16 -","4","0.5","","Yi-Chou Tsai; Hong-Zhang Chen; Chie-Chieh Chang; Jen-Shiang K. Yu; Gene-Hsiang Lee; Yu Wang; Ting-Shen Kuo","Journey from Mo-Mo Quadruple Bonds to Quintuple Bonds","Journal of the American Chemical Society","2009","131","","12534","12535","10.1021/ja905035f","","","0.71073","MoKα","","0.0971","0.0639","","","0.1712","0.195","","","","","","1.014","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104985","22.5252","0.0003","10.3225","0.0001","27.1465","0.0004","90","","111.849","0.0005","90","","5858.62","0.13","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C62 H78 Mo2 N4 -","- C62 H78 Mo2 N4 -","- C248 H312 Mo8 N16 -","4","1","","Yi-Chou Tsai; Hong-Zhang Chen; Chie-Chieh Chang; Jen-Shiang K. Yu; Gene-Hsiang Lee; Yu Wang; Ting-Shen Kuo","Journey from Mo-Mo Quadruple Bonds to Quintuple Bonds","Journal of the American Chemical Society","2009","131","","12534","12535","10.1021/ja905035f","","","0.71073","MoKα","","0.0483","0.0321","","","0.0868","0.0969","","","","","","1.081","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104986","16.7531","0.0002","16.9193","0.0002","23.5981","0.0003","90","","100.869","0.0006","90","","6568.91","0.14","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H104 Cl3 Li Mo2 N4 O2 -","- C64 H104 Cl3 Li Mo2 N4 O2 -","- C256 H416 Cl12 Li4 Mo8 N16 O8 -","4","1","","Yi-Chou Tsai; Hong-Zhang Chen; Chie-Chieh Chang; Jen-Shiang K. Yu; Gene-Hsiang Lee; Yu Wang; Ting-Shen Kuo","Journey from Mo-Mo Quadruple Bonds to Quintuple Bonds","Journal of the American Chemical Society","2009","131","","12534","12535","10.1021/ja905035f","","","0.71073","MoKα","","0.083","0.0546","","","0.1501","0.1656","","","","","","1.091","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104987","13.0147","0.0015","14.9375","0.0017","19.169","0.002","70.483","0.003","83.999","0.003","88.553","0.002","3493","0.7","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H98 Cl3 Li Mo2 N4 O2 -","- C70 H98 Cl3 Li Mo2 N4 O2 -","- C140 H196 Cl6 Li2 Mo4 N8 O4 -","2","1","","Yi-Chou Tsai; Hong-Zhang Chen; Chie-Chieh Chang; Jen-Shiang K. Yu; Gene-Hsiang Lee; Yu Wang; Ting-Shen Kuo","Journey from Mo-Mo Quadruple Bonds to Quintuple Bonds","Journal of the American Chemical Society","2009","131","","12534","12535","10.1021/ja905035f","","","0.71073","MoKα","","0.1244","0.0633","","","0.134","0.1573","","","","","","1.077","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104988","19.4691","0.0005","19.7241","0.0005","23.412","0.0009","110.754","0.002","93.66","0.002","116.557","0.001","7249.7","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H133 B8 N68 O37 Pd6 -","- C96 H133 B8 N68 O37 Pd6 -","- C192 H266 B16 N136 O74 Pd12 -","2","1","","Zheng Lu; Carolyn B. Knobler; Hiroyasu Furukawa; Bo Wang; Guannan Liu; Omar M. Yaghi","Synthesis and Structure of Chemically Stable Metal-Organic Polyhedra","Journal of the American Chemical Society","2009","131","","12532","12533","10.1021/ja905101s","","","1.54178","CuKα","","0.1135","0.0872","","","0.2326","0.2558","","","","","","1.067","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104989","19.4691","0.0005","19.7241","0.0005","23.412","0.0009","110.754","0.002","93.66","0.002","116.557","0.001","7249.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H96 B8 N64 Pd6 -","- C96 H96 B8 N64 Pd6 -","- C192 H192 B16 N128 Pd12 -","2","1","","Zheng Lu; Carolyn B. Knobler; Hiroyasu Furukawa; Bo Wang; Guannan Liu; Omar M. Yaghi","Synthesis and Structure of Chemically Stable Metal-Organic Polyhedra","Journal of the American Chemical Society","2009","131","","12532","12533","10.1021/ja905101s","","","1.54178","CuKα","","0.0837","0.0654","","","0.1845","0.2026","","","","","","1.148","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104990","16.9134","0.0003","16.9134","0.0003","34.344","0.001","90","","90","","90","","9824.6","0.4","100","2","100","2","","","","","","","","6","P 4/m n c","-P 4 2n","128","","","","- C128 H179 B8 N68 O26 Pd6 -","- C128 H183.04 B8 N68 O26.04 Pd6 -","- C256 H366.08 B16 N136 O52.08 Pd12 -","2","0.125","","Zheng Lu; Carolyn B. Knobler; Hiroyasu Furukawa; Bo Wang; Guannan Liu; Omar M. Yaghi","Synthesis and Structure of Chemically Stable Metal-Organic Polyhedra","Journal of the American Chemical Society","2009","131","","12532","12533","10.1021/ja905101s","","","1.54178","CuKα","","0.0879","0.0824","","","0.1945","0.1986","","","","","","1.106","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104991","16.9134","0.0003","16.9134","0.0003","34.344","0.001","90","","90","","90","","9824.6","0.4","100","2","100","2","","","","","","","","5","P 4/m n c","-P 4 2n","128","","","","- C128 H160 B8 N64 Pd6 -","- C128 H160 B8 N64 Pd6 -","- C256 H320 B16 N128 Pd12 -","2","0.125","","Zheng Lu; Carolyn B. Knobler; Hiroyasu Furukawa; Bo Wang; Guannan Liu; Omar M. Yaghi","Synthesis and Structure of Chemically Stable Metal-Organic Polyhedra","Journal of the American Chemical Society","2009","131","","12532","12533","10.1021/ja905101s","","","1.54178","CuKα","","0.0655","0.0618","","","0.1558","0.1587","","","","","","1.069","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104992","9.858","0.002","12.9873","0.0014","13.198","0.003","90","","102.346","0.004","90","","1650.6","0.5","80.1","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H19 N O -","- C22.98 H19 N0.97 O -","- C91.92 H76 N3.88 O4 -","4","1","","Yi-Feng Wang; Shunsuke Chiba","Mn(III)-Mediated Reactions of Cyclopropanols with Vinyl Azides: Synthesis of Pyridine and 2-Azabicyclo[3.3.1]non-2-en-1-ol Derivatives","Journal of the American Chemical Society","2009","131","","12570","12572","10.1021/ja905110c","","x-ray","0.71075","MoKα","","","0.0658","","","","0.1059","","","","","","8.582","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104993","6.8395","","9.1094","0.0001","10.5243","0.0001","68.143","0.006","70.861","0.006","77.939","0.008","572.1","0.03","80.1","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H17 N O -","- C10.63 H15.63 N0.77 O0.74 -","- C21.26 H31.26 N1.54 O1.48 -","2","1","","Yi-Feng Wang; Shunsuke Chiba","Mn(III)-Mediated Reactions of Cyclopropanols with Vinyl Azides: Synthesis of Pyridine and 2-Azabicyclo[3.3.1]non-2-en-1-ol Derivatives","Journal of the American Chemical Society","2009","131","","12570","12572","10.1021/ja905110c","","x-ray","0.71075","MoKα","","","0.0956","","","","0.0961","","","","","","10.024","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104994","10.4412","0.0009","7.8614","0.0007","15.9788","0.0013","90","","93.057","0.004","90","","1309.71","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 N O -","- C16 H19 N O -","- C64 H76 N4 O4 -","4","1","","Yi-Feng Wang; Shunsuke Chiba","Mn(III)-Mediated Reactions of Cyclopropanols with Vinyl Azides: Synthesis of Pyridine and 2-Azabicyclo[3.3.1]non-2-en-1-ol Derivatives","Journal of the American Chemical Society","2009","131","","12570","12572","10.1021/ja905110c","","","0.71073","MoKα","","0.0768","0.0443","","","0.1131","0.1358","","","","","","1.002","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104995","10.0059","0.0004","8.9092","0.0004","17.2816","0.0008","90","","94.226","0.002","90","","1536.37","0.12","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 N O -","- C20 H21 N O -","- C80 H84 N4 O4 -","4","1","","Yi-Feng Wang; Shunsuke Chiba","Mn(III)-Mediated Reactions of Cyclopropanols with Vinyl Azides: Synthesis of Pyridine and 2-Azabicyclo[3.3.1]non-2-en-1-ol Derivatives","Journal of the American Chemical Society","2009","131","","12570","12572","10.1021/ja905110c","","","0.71073","MoKα","","0.0537","0.0337","","","0.0753","0.0842","","","","","","1.038","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4104996","20.9491","0.0008","11.4791","0.0004","12.8044","0.0005","90","","124.361","0.002","90","","2541.84","0.18","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H19 N O -","- C15 H19 N O -","- C120 H152 N8 O8 -","8","1","","Yi-Feng Wang; Shunsuke Chiba","Mn(III)-Mediated Reactions of Cyclopropanols with Vinyl Azides: Synthesis of Pyridine and 2-Azabicyclo[3.3.1]non-2-en-1-ol Derivatives","Journal of the American Chemical Society","2009","131","","12570","12572","10.1021/ja905110c","","","0.71073","MoKα","","0.0828","0.047","","","0.1086","0.1263","","","","","","1.038","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104997","5.9335","0.0003","9.0893","0.0004","10.6193","0.0005","85.05","0.002","81.807","0.002","79.992","0.002","557.13","0.05","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H19 N -","- C14 H19 N -","- C28 H38 N2 -","2","1","","Yi-Feng Wang; Shunsuke Chiba","Mn(III)-Mediated Reactions of Cyclopropanols with Vinyl Azides: Synthesis of Pyridine and 2-Azabicyclo[3.3.1]non-2-en-1-ol Derivatives","Journal of the American Chemical Society","2009","131","","12570","12572","10.1021/ja905110c","","","0.71073","MoKα","","0.053","0.0419","","","0.1214","0.1467","","","","","","1.156","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104998","7.1471","0.0005","12.6152","0.0008","9.9519","0.0007","90","","91.73","0.003","90","","896.88","0.11","103","2","103","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C6 H26 Cu N2 O14 Se2 -","- C6 H26 Cu N2 O14 Se2 -","- C12 H52 Cu2 N4 O28 Se4 -","2","1","","Wen Zhang; Li-Zhuang Chen; Ren-Gen Xiong; Takayoshi Nakamura; Songping D. Huang","New Ferroelectrics Based on Divalent Metal Ion Alum","Journal of the American Chemical Society","2009","131","","12544","12545","10.1021/ja905399x","","","0.71075","MoKα","","0.0289","0.0281","","","0.0642","0.0648","","","","","","1.063","","","","has coordinates","178795","2020-10-21","18:00:00",""
"4104999","7.1294","0.0014","12.629","0.003","12.142","0.004","90","","124.84","0.02","90","","897.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H26 Cu N2 O14 Se2 -","- C6 H26 Cu N2 O14 Se2 -","- C12 H52 Cu2 N4 O28 Se4 -","2","0.5","","Wen Zhang; Li-Zhuang Chen; Ren-Gen Xiong; Takayoshi Nakamura; Songping D. Huang","New Ferroelectrics Based on Divalent Metal Ion Alum","Journal of the American Chemical Society","2009","131","","12544","12545","10.1021/ja905399x","","","0.71073","MoKα","","0.0437","0.0345","","","0.0753","0.0786","","","","","","1.106","","","","has coordinates,has disorder","178795","2020-10-21","18:00:00",""
"4105000","7.1403","0.0005","12.6022","0.0009","9.9441","0.0006","90","","91.936","0.002","90","","894.29","0.1","93","2","93","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C6 H12 Cu D14 N2 O14 Se2 -","- C6 H12 Cu D14 N2 O14 Se2 -","- C12 H24 Cu2 D28 N4 O28 Se4 -","2","1","","Wen Zhang; Li-Zhuang Chen; Ren-Gen Xiong; Takayoshi Nakamura; Songping D. Huang","New Ferroelectrics Based on Divalent Metal Ion Alum","Journal of the American Chemical Society","2009","131","","12544","12545","10.1021/ja905399x","","","0.71075","MoKα","","0.0276","0.0266","","","0.0697","0.0703","","","","","","1.047","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105001","7.124","0.006","12.634","0.009","12.164","0.007","90","","125.16","0.04","90","","895.1","1.2","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C6 H12 Cu D14 N2 O14 Se2 -","- C6 H12 Cu D14 N2 O14 Se2 -","- C12 H24 Cu2 D28 N4 O28 Se4 -","2","0.5","","Wen Zhang; Li-Zhuang Chen; Ren-Gen Xiong; Takayoshi Nakamura; Songping D. Huang","New Ferroelectrics Based on Divalent Metal Ion Alum","Journal of the American Chemical Society","2009","131","","12544","12545","10.1021/ja905399x","","","0.71073","MoKα","","0.1065","0.0934","","","0.2147","0.2199","","","","","","1.185","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105002","10.541","0.0007","10.6705","0.0007","10.8608","0.0007","88.484","0.001","84.284","0.001","75.633","0.001","1177.51","0.13","85","2","85","2","","","","","","","","3","P 1","P 1","1","","","","- C28 H30 O4 -","- C28 H30 O4 -","- C56 H60 O8 -","2","2","","Natalie C. Giampietro; Jeff W. Kampf; John P. Wolfe","Asymmetric Tandem Wittig Rearrangement/Aldol Reactions","Journal of the American Chemical Society","2009","131","","12556","12557","10.1021/ja905930s","","","0.71073","MoKα","","0.0317","0.0305","","","0.078","0.079","","","","","","1.068","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105003","9.9225","0.0003","16.8851","0.0006","17.1254","0.0006","90","","90","","90","","2869.23","0.17","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H22 B N2 O6 -","- C37 H34 B N O2 -","- C148 H136 B4 N4 O8 -","4","1","","Shagufta H. Shabbir; Leo A. Joyce; Gabriella M. da Cruz; Vincent M. Lynch; Steven Sorey; Eric V. Anslyn","Pattern-Based Recognition for the Rapid Determination of Identity, Concentration, and Enantiomeric Excess of Subtly Different Threo Diols","Journal of the American Chemical Society","2009","131","","13125","13131","10.1021/ja904545d","","","0.7107","MoKα","","0.0787","0.0493","","","0.0732","0.0776","","","","","","1.399","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105004","11.1922","0.0006","7.8529","0.0004","19.6551","0.001","90","","103.138","0.003","90","","1682.29","0.15","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H24 Cl2 I N -","- C13 H24 Cl2 I N -","- C52 H96 Cl8 I4 N4 -","4","1","","Timothy J. Clark; Nicholas J. Robertson; Henry A. Kostalik IV; Emil B. Lobkovsky; Paul F. Mutolo; Héctor D. Abruña; Geoffrey W. Coates","A Ring-Opening Metathesis Polymerization Route to Alkaline Anion Exchange Membranes: Development of Hydroxide-Conducting Thin Films from an Ammonium-Functionalized Monomer","Journal of the American Chemical Society","2009","131","","12888","12889","10.1021/ja905242r","","","0.71073","MoKα","","0.0429","0.0322","","","0.0822","0.0893","","","","","","0.999","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105005","38.3466","0.0019","10.7833","0.0005","8.6147","0.0004","90","","100.953","0.001","90","","3497.3","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H50 N2 O4 S2 -","- C40 H50 N2 O4 S2 -","- C160 H200 N8 O16 S8 -","4","0.5","","Isaac Alonso; Beatriz Trillo; Fernando López; Sergi Montserrat; Gregori Ujaque; Luis Castedo; Agustí Lledós; Jose L. Mascareñas","Gold-Catalyzed [4C+2C] Cycloadditions of Allenedienes, including an Enantioselective Version with New Phosphoramidite-Based Catalysts: Mechanistic Aspects of the Divergence between [4C+3C] and [4C+2C] Pathways","Journal of the American Chemical Society","2009","131","","13020","13030","10.1021/ja905415r","","","0.71073","MoKα","","0.0469","0.0377","","","0.0957","0.1017","","","","","","0.827","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105006","10.1791","0.0002","21.9773","0.0005","8.8795","0.0002","90","","112.76","0.001","90","","1831.75","0.07","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 N O2 S -","- C21 H27 N O2 S -","- C84 H108 N4 O8 S4 -","4","1","","Isaac Alonso; Beatriz Trillo; Fernando López; Sergi Montserrat; Gregori Ujaque; Luis Castedo; Agustí Lledós; Jose L. Mascareñas","Gold-Catalyzed [4C+2C] Cycloadditions of Allenedienes, including an Enantioselective Version with New Phosphoramidite-Based Catalysts: Mechanistic Aspects of the Divergence between [4C+3C] and [4C+2C] Pathways","Journal of the American Chemical Society","2009","131","","13020","13030","10.1021/ja905415r","","x-ray","0.7107","MoKα","","0.0489","0.0386","","","0.0937","0.0992","","","","","","1.031","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105007","13.2005","0.0006","16.7409","0.0009","5.9633","0.0003","90","","90","","90","","1317.82","0.11","100","2","100","2","","","","","","","synthesis as described","3","P n a 21","P 2c -2n","33","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","","Isaac Alonso; Beatriz Trillo; Fernando López; Sergi Montserrat; Gregori Ujaque; Luis Castedo; Agustí Lledós; Jose L. Mascareñas","Gold-Catalyzed [4C+2C] Cycloadditions of Allenedienes, including an Enantioselective Version with New Phosphoramidite-Based Catalysts: Mechanistic Aspects of the Divergence between [4C+3C] and [4C+2C] Pathways","Journal of the American Chemical Society","2009","131","","13020","13030","10.1021/ja905415r","","x-ray","0.71073","MoKα","","0.051","0.0432","","","0.1107","0.115","","","","","","1.07","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105008","8.2327","0.0003","10.0262","0.0003","20.8923","0.0006","90","","90","","90","","1724.51","0.1","446","2","120","2","","","","","","","synthesis as described","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 O5 -","- C18 H24 O5 -","- C72 H96 O20 -","4","1","","Isaac Alonso; Beatriz Trillo; Fernando López; Sergi Montserrat; Gregori Ujaque; Luis Castedo; Agustí Lledós; Jose L. Mascareñas","Gold-Catalyzed [4C+2C] Cycloadditions of Allenedienes, including an Enantioselective Version with New Phosphoramidite-Based Catalysts: Mechanistic Aspects of the Divergence between [4C+3C] and [4C+2C] Pathways","Journal of the American Chemical Society","2009","131","","13020","13030","10.1021/ja905415r","","x-ray","0.7107","MoKα","","0.0532","0.0468","","","0.1161","0.1196","","","","","","1.024","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105009","11.5779","0.0006","12.8146","0.0008","21.809","0.0014","90","","90","","90","","3235.7","0.3","100","2","100","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N O2 S -","- C18 H23 N O2 S -","- C144 H184 N8 O16 S8 -","8","2","","Isaac Alonso; Beatriz Trillo; Fernando López; Sergi Montserrat; Gregori Ujaque; Luis Castedo; Agustí Lledós; Jose L. Mascareñas","Gold-Catalyzed [4C+2C] Cycloadditions of Allenedienes, including an Enantioselective Version with New Phosphoramidite-Based Catalysts: Mechanistic Aspects of the Divergence between [4C+3C] and [4C+2C] Pathways","Journal of the American Chemical Society","2009","131","","13020","13030","10.1021/ja905415r","","x-ray","0.71073","MoKα","","0.0653","0.0444","","","0.0934","0.1028","","","","","","1.031","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105010","14.8299","0.0013","10.5763","0.0008","24.935","0.002","90","","100.616","0.002","90","","3844","0.5","173.1","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C41 H104 Fe8 N8 S9 Si8 -","- C41 H104 Fe8 N8 S9 Si8 -","- C82 H208 Fe16 N16 S18 Si16 -","2","0.5","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0478","","","","0.1179","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105011","26.522","0.009","28.749","0.01","26.062","0.009","90","","90","","90","","19872","12","143.1","","","","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C66 H150 Fe8 N6 O3 S9 Si8 -","- C66 H131 Fe8 N6 O3 S9 Si8 -","- C528 H1048 Fe64 N48 O24 S72 Si64 -","8","","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0577","","","","0.1594","","","","","","0.987","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105012","36.712","0.013","19.659","0.006","16.907","0.006","90","","112.008","0.006","90","","11313","7","143.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C76 H170 Fe8 N6 O4 S9 Si8 -","- C76 H136 Fe8 N6 O4 S9 Si8 -","- C304 H544 Fe32 N24 O16 S36 Si32 -","4","0.5","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0987","","","","0.2315","","","","","","0.952","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105013","26.503","0.012","29.012","0.014","26.224","0.012","90","","90","","90","","20164","16","173.1","","","","","","","","","","","8","A b a 2","A 2 -2ab","41","","","","- C62 H140 Cl2 Fe8 N6 O2.5 S9 Si8 -","- C62 H98 Cl2 Fe8 N6 O2.5 S9 Si8 -","- C496 H784 Cl16 Fe64 N48 O20 S72 Si64 -","8","","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0595","","","","0.1338","","","","","","1.274","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105014","26.201","0.002","28.989","0.002","26.46","0.002","90","","90","","90","","20097","3","173.1","","","","","","","","","","","8","A b a 2","A 2 -2ab","41","","","","- C64 H144 Br2 Fe8 N6 O3 S9 Si8 -","- C64 H80 Br2 Fe8 N6 O3 S9 Si8 -","- C512 H640 Br16 Fe64 N48 O24 S72 Si64 -","8","","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0649","","","","0.162","","","","","","2.217","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105015","17.948","0.005","21.637","0.005","27.944","0.007","90","","90","","90","","10852","5","143.1","","","","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C70 H162 Fe8 N6 O3 S9 Si10 -","- C70 H122 Fe8 N6 O3 S9 Si10 -","- C280 H488 Fe32 N24 O12 S36 Si40 -","4","0.5","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0749","","","","0.2267","","","","","","1.182","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105016","14.1787","0.0014","21.225","0.002","24.581","0.002","90","","90","","90","","7397.5","1.2","173.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H92 Fe10 N4 S9 Si8 -","- C46 H92 Fe10 N4 S9 Si8 -","- C184 H368 Fe40 N16 S36 Si32 -","4","1","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0321","","","","0.0728","","","","","","0.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105017","19.453","0.01","21.971","0.007","20.098","0.008","90","","93.707","0.015","90","","8572","6","173.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H116 Fe8 N6 S11 Si8 -","- C52 H116 Fe8 N6 S11 Si8 -","- C208 H464 Fe32 N24 S44 Si32 -","4","1","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0494","","","","0.1573","","","","","","0.92","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105018","19.752","0.003","26.317","0.004","21.924","0.003","90","","115.575","0.0019","90","","10280","3","143.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C61 H131 Fe8 N5 S11 Si10 -","- C61 H90 Fe8 N5 S11 Si10 -","- C244 H360 Fe32 N20 S44 Si40 -","4","1","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0962","","","","0.2282","","","","","","0.807","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105019","24.966","0.003","23.633","0.002","26.912","0.003","90","","98.348","0.0016","90","","15710","3","173.1","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C100 H147 Fe10 N2 S11 Si16 -","- C100 H147 Fe10 N2 S11 Si16 -","- C400 H588 Fe40 N8 S44 Si64 -","4","1","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.1175","","","","0.2945","","","","","","1.715","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105020","24.951","0.003","37.46","0.005","10.6579","0.0015","90","","90","","90","","9962","2","173.1","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C72 H60 Fe4 P2 S8 -","- C72 H60 Fe4 P2 S8 -","- C432 H360 Fe24 P12 S48 -","6","1.5","","Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi","Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster","Journal of the American Chemical Society","2009","131","","13168","13178","10.1021/ja9055036","","","0.7107","MoKα","","","0.0343","","","","0.0607","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105021","8.6381","0.0003","15.3135","0.0005","18.1475","0.0006","90","","98.067","0.002","90","","2376.79","0.14","293","","293","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C20 H31 F6 N2 O2 P Ru S -","- C20 H31 F6 N2 O2 P Ru S -","- C80 H124 F24 N8 O8 P4 Ru4 S4 -","4","1","","Thamayanthy Sriskandakumar; Holm Petzold; Pieter C. A. Bruijnincx; Abraha Habtemariam; Peter J. Sadler; Pierre Kennepohl","Influence of Oxygenation on the Reactivity of Ruthenium-Thiolato Bonds in Arene Anticancer Complexes: Insights from XAS and DFT","Journal of the American Chemical Society","2009","131","","13355","13361","10.1021/ja903405z","","","0.71073","MoKα","","0.0495","0.0382","","0.0976","0.092","0.0976","","","","","","0.9501","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105022","9.9232","0.0005","10.3821","0.0005","18.0076","0.0008","95.565","0.001","96.44","0.001","110.951","0.001","1702.73","0.14","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H50 B F4 Ir N3 P -","- C33 H50 B F4 Ir N3 P -","- C66 H100 B2 F8 Ir2 N6 P2 -","2","1","","Kevin D. Atkinson; Michael J. Cowley; Paul I. P. Elliott; Simon B. Duckett; Gary G. R. Green; Joaquín López-Serrano; Adrian C. Whitwood","Spontaneous Transfer of Parahydrogen Derived Spin Order to Pyridine at Low Magnetic Field","Journal of the American Chemical Society","2009","131","","13362","13368","10.1021/ja903601p","","","0.71073","MoKα","","0.0237","0.0211","","","0.0478","0.0488","","","","","","1.011","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105023","8.289","0.0003","21.1559","0.0007","10.7607","0.0004","90","","100.36","0.002","90","","1856.25","0.11","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H30 O4 -","- C21 H30 O4 -","- C84 H120 O16 -","4","1","","Catherine Hulot; Shadi Amiri; Gaëlle Blond; Peter R. Schreiner; Jean Suffert","Understanding the Torquoselectivity in 8π-Electrocyclic Cascade Reactions: Synthesis of Fenestradienes versus Cyclooctatrienes","Journal of the American Chemical Society","2009","131","","13387","13398","10.1021/ja903914r","","","0.71073","MoKα","","0.0687","0.0444","","","0.0995","0.1097","","","","","","1.023","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105024","8.1351","0.0002","21.0319","0.001","10.6795","0.0005","90","","98.594","0.002","90","","1806.71","0.13","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 O4 -","- C20 H28 O4 -","- C80 H112 O16 -","4","1","","Catherine Hulot; Shadi Amiri; Gaëlle Blond; Peter R. Schreiner; Jean Suffert","Understanding the Torquoselectivity in 8π-Electrocyclic Cascade Reactions: Synthesis of Fenestradienes versus Cyclooctatrienes","Journal of the American Chemical Society","2009","131","","13387","13398","10.1021/ja903914r","","","0.71073","MoKα","","0.0959","0.0523","","","0.1314","0.1645","","","","","","1.015","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105025","8.7956","0.0014","20.014","0.003","23.863","0.004","90","","90","","90","","4200.7","1.2","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Sublimed clarithromycin","","","- C38 H69 N O13 -","- C38 H69 N O13 -","- C152 H276 N4 O52 -","4","1","","Jian Tian; Praveen K. Thallapally; Scott J. Dalgarno; Jerry L. Atwood","Free Transport of Water and CO2 in Nonporous Hydrophobic Clarithromycin Form II Crystals","Journal of the American Chemical Society","2009","131","","13216","13217","10.1021/ja904658p","","","0.71073","MoKα","","0.1031","0.0616","","","0.11","0.1226","","","","","","1.043","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105026","8.7891","0.0011","20.012","0.003","23.857","0.003","90","","90","","90","","4196.1","1","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Clarithromycin hemihydrate","","","- C38 H69 N O13.5 -","- C38 H69 N O13.5 -","- C152 H276 N4 O54 -","4","1","","Jian Tian; Praveen K. Thallapally; Scott J. Dalgarno; Jerry L. Atwood","Free Transport of Water and CO2 in Nonporous Hydrophobic Clarithromycin Form II Crystals","Journal of the American Chemical Society","2009","131","","13216","13217","10.1021/ja904658p","","","0.71073","MoKα","","0.0968","0.0505","","","0.093","0.1071","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105027","11.8029","0.0001","16.4042","0.0001","20.8175","0.0002","90","","96.7501","0.0003","90","","4002.69","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H58 Ir N2 P -","- C44 H58 Ir N2 P -","- C176 H232 Ir4 N8 P4 -","4","1","","Halil Aktas; Jos Mulder; Frans J. J. de Kanter; J. Chris Slootweg; Marius Schakel; Andreas W. Ehlers; Martin Lutz; Anthony L. Spek; Koop Lammertsma","Iridium Phosphinidene Complexes: A Comparison with Iridium Imido Complexes in Their Reaction with Isocyanides","Journal of the American Chemical Society","2009","131","","13531","13537","10.1021/ja9048509","","","0.71073","MoKα","","0.0334","0.0222","","","0.0426","0.0455","","","","","","1.043","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105028","14.3239","0.0004","16.0921","0.0004","21.5079","0.0007","90","","122.067","0.001","90","","4201.2","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H62 Ir N2 P -","- C46 H62 Ir N2 P -","- C184 H248 Ir4 N8 P4 -","4","1","","Halil Aktas; Jos Mulder; Frans J. J. de Kanter; J. Chris Slootweg; Marius Schakel; Andreas W. Ehlers; Martin Lutz; Anthony L. Spek; Koop Lammertsma","Iridium Phosphinidene Complexes: A Comparison with Iridium Imido Complexes in Their Reaction with Isocyanides","Journal of the American Chemical Society","2009","131","","13531","13537","10.1021/ja9048509","","","0.71073","MoKα","","0.0313","0.0187","","","0.0358","0.0391","","","","","","1.043","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105029","11.8147","0.0002","14.3753","0.0004","20.8906","0.0004","90","","113.837","0.002","90","","3245.4","0.13","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H44 Ir N2 P -","- C37 H44 Ir N2 P -","- C148 H176 Ir4 N8 P4 -","4","1","","Halil Aktas; Jos Mulder; Frans J. J. de Kanter; J. Chris Slootweg; Marius Schakel; Andreas W. Ehlers; Martin Lutz; Anthony L. Spek; Koop Lammertsma","Iridium Phosphinidene Complexes: A Comparison with Iridium Imido Complexes in Their Reaction with Isocyanides","Journal of the American Chemical Society","2009","131","","13531","13537","10.1021/ja9048509","","","0.71073","MoKα","","0.0277","0.0193","","","0.0389","0.0412","","","","","","1.053","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105030","8.0818","0.0007","17.0067","0.0014","21.3708","0.0018","90","","98.717","0.002","90","","2903.4","0.4","100","0.1","100","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","jonme05, 2-Cl","Tp'Rh(CNR)(C6F5)Cl","","- C27 H33 B Cl F5 N7 Rh -","- C27 H33 B Cl F5 N7 Rh -","- C108 H132 B4 Cl4 F20 N28 Rh4 -","4","1","","Meagan E. Evans; Catherine L. Burke; Sornanong Yaibuathes; Eric Clot; Odile Eisenstein; William D. Jones","Energetics of C-H Bond Activation of Fluorinated Aromatic Hydrocarbons Using a [Tp'Rh(CNneopentyl)] Complex","Journal of the American Chemical Society","2009","131","","13464","13473","10.1021/ja905057w","","","0.71073","MoKα","","0.1127","0.0601","","","0.1388","0.1649","","","","","","1.06","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105031","6.7107","0.0017","9.115","0.002","8.674","0.002","90","0.008","96.851","0.003","90","0.006","526.8","0.2","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- As F9 O Xe3 -","- As F9 O Xe3 -","- As2 F18 O2 Xe6 -","2","1","","Michael Gerken; Matthew D. Moran; Hélène P. A. Mercier; Bernard E. Pointner; Gary J. Schrobilgen; Berthold Hoge; Karl O. Christe; Jerry A. Boatz","On the XeF+/H2O System: Synthesis and Characterization of the Xenon(II) Oxide Fluoride Cation, FXeOXeFXeF+","Journal of the American Chemical Society","2009","131","","13474","13489","10.1021/ja905060v","","","0.71073","MoKα","","0.0501","0.046","","","0.1272","0.1311","","","","","","1.03","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105032","6.6872","0.001","9.3056","0.0017","8.8219","0.0016","90","","96.784","0.005","90","","545.13","0.16","148","2","148","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- F9 O Sb Xe3 -","- F9 O Sb Xe3 -","- F18 O2 Sb2 Xe6 -","2","0.5","","Michael Gerken; Matthew D. Moran; Hélène P. A. Mercier; Bernard E. Pointner; Gary J. Schrobilgen; Berthold Hoge; Karl O. Christe; Jerry A. Boatz","On the XeF+/H2O System: Synthesis and Characterization of the Xenon(II) Oxide Fluoride Cation, FXeOXeFXeF+","Journal of the American Chemical Society","2009","131","","13474","13489","10.1021/ja905060v","","","0.71073","MoKα","","0.0639","0.0419","","","0.0836","0.0896","","","","","","1.129","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105033","8.715","0.004","8.715","0.004","12.989","0.009","90","","90","","90","","986.5","0.9","100","2","100","2","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","","- As F10 H3 O Xe2 -","- As F10 O Xe2 -","- As4 F40 O4 Xe8 -","4","0.125","","Michael Gerken; Matthew D. Moran; Hélène P. A. Mercier; Bernard E. Pointner; Gary J. Schrobilgen; Berthold Hoge; Karl O. Christe; Jerry A. Boatz","On the XeF+/H2O System: Synthesis and Characterization of the Xenon(II) Oxide Fluoride Cation, FXeOXeFXeF+","Journal of the American Chemical Society","2009","131","","13474","13489","10.1021/ja905060v","","","0.71073","MoKα","","0.0673","0.021","","","0.0523","0.0587","","","","","","0.885","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105034","12.3099","0.0019","13.943","0.002","16.083","0.003","89.444","0.004","88.652","0.005","89.4746","0.001","2759.4","0.8","120","","120","","","","","","","","","4","P -1","-P 1","2","","(E)-1,2-bis(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl)- 2-phenyl-phosphasilene","","- C62 H95 P Si -","- C62 H95 P Si -","- C124 H190 P2 Si2 -","2","1","","Baolin Li; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","π-Conjugated Phosphasilenes Stabilized by Fused-Ring Bulky Groups","Journal of the American Chemical Society","2009","131","","13222","13223","10.1021/ja9051153","","","0.71073","MoKα","","0.068","0.0521","","","0.1249","0.1363","","","","","","1.112","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105035","11.762","0.004","16.793","0.006","17.517","0.006","114.21","0.007","90.569","0.004","94.77","0.003","3141","1.9","100","","100","","","","","","","","","4","P -1","-P 1","2","","(E)-1,2-bis(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl)-2- (2-naphtyl)phosphasilene toluene solvate","","- C73 H105 P Si -","- C73 H105 P Si -","- C146 H210 P2 Si2 -","2","1","","Baolin Li; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","π-Conjugated Phosphasilenes Stabilized by Fused-Ring Bulky Groups","Journal of the American Chemical Society","2009","131","","13222","13223","10.1021/ja9051153","","","0.71073","MoKα","","0.1354","0.0784","","","0.1888","0.2391","","","","","","1.037","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105036","13.7835","0.0003","14.4694","0.0004","16.12","0.0005","92.9717","0.0015","94.968","0.0011","101.214","0.0011","3133.96","0.15","90","","90","","","","","","","","","5","P -1","-P 1","2","","(E)-1,2-bis(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl)- 2-(2- anthryl)phosphasilene tetrahydrofuran solvate","","- C74 H107 O P Si -","- C74 H107 O P Si -","- C148 H214 O2 P2 Si2 -","2","1","","Baolin Li; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","π-Conjugated Phosphasilenes Stabilized by Fused-Ring Bulky Groups","Journal of the American Chemical Society","2009","131","","13222","13223","10.1021/ja9051153","","","0.71073","MoKα","","0.0918","0.0671","","","0.1868","0.2117","","","","","","1.046","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105037","11.7071","0.0002","15.0538","0.0003","16.0803","0.0003","86.597","0.001","84.328","0.001","68.35","0.001","2620.31","0.09","140","","140","","","","","","","","","4","P -1","-P 1","2","","1,4-bis{(E)-1,2-bis(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl)- phosphasileneyl}benzene","","- C118 H184 P2 Si2 -","- C118.128 H184.256 P2 Si2 -","- C118.128 H184.256 P2 Si2 -","1","0.5","","Baolin Li; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao","π-Conjugated Phosphasilenes Stabilized by Fused-Ring Bulky Groups","Journal of the American Chemical Society","2009","131","","13222","13223","10.1021/ja9051153","","","1.54184","CuKα","","0.0822","0.0556","","","0.1292","0.1518","","","","","","1.107","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105038","5.5391","0.0008","10.8776","0.0015","29.488","0.004","90","","90","","90","","1776.7","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H19 Br N2 O3 -","- C21 H19 Br N2 O3 -","- C84 H76 Br4 N8 O12 -","4","1","","Sandip Murarka; Indubhusan Deb; Chen Zhang; Daniel Seidel","Catalytic Enantioselective Intramolecular Redox Reactions: Ring-Fused Tetrahydroquinolines","Journal of the American Chemical Society","2009","131","","13226","13227","10.1021/ja905213f","","","0.71073","MoKα","","0.0436","0.0365","","","0.08","0.0825","","","","","","1.005","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105039","8.1447","0.0001","10.1427","0.0002","21.4366","0.0003","90","","90","","90","","1770.86","0.05","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H22 N2 O4 -","- C22 H22 N2 O4 -","- C88 H88 N8 O16 -","4","1","","Sandip Murarka; Indubhusan Deb; Chen Zhang; Daniel Seidel","Catalytic Enantioselective Intramolecular Redox Reactions: Ring-Fused Tetrahydroquinolines","Journal of the American Chemical Society","2009","131","","13226","13227","10.1021/ja905213f","","","1.54178","CuKα","","0.0359","0.0346","","","0.0803","0.0812","","","","","","1.006","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105040","3.58191","0.00023","3.58191","","3.58191","","90","","90","","90","","45.956","0.003","180","","","","","","","","","","Part of sample environment","1","F m -3 m","-F 4 2 3","225","copper","","","- Cu -","- Cu -","- Cu4 -","4","0.0208333","","Fortes, A. Dominic; Suard, Emmanuelle; Lemée-Cailleau, Marie-Hélène; Pickard, Christopher J.; Needs, Richard J.","Crystal Structure of Ammonia Monohydrate Phase II","Journal of the American Chemical Society","2009","131","37","13508","13515","10.1021/ja9052569","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates,has Fobs","181961","2020-10-21","18:00:00",""
"4105041","18.8285","0.0004","6.94145","0.00016","6.84492","0.00016","90","","90","","90","","894.61","0.03","180","","","","","","","","","","Aldrich Chemical Co. ND3 + D2O","3","P b c a","-P 2ac 2ab","61","ammonia monohydrate","","","- D5 N O -","- D5 N O -","- D80 N16 O16 -","16","2","","Fortes, A. Dominic; Suard, Emmanuelle; Lemée-Cailleau, Marie-Hélène; Pickard, Christopher J.; Needs, Richard J.","Crystal Structure of Ammonia Monohydrate Phase II","Journal of the American Chemical Society","2009","131","37","13508","13515","10.1021/ja9052569","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates,has Fobs","181961","2020-10-21","18:00:00",""
"4105042","10.2466","0.0007","12.5796","0.001","17.5498","0.0015","73.99","0.003","77.861","0.003","82.878","0.003","2120.5","0.3","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C43 H53 Cl2 Cu F6 N4 P Ru -","- C43 H51 Cl2 Cu F6 N4 P Ru -","- C86 H102 Cl4 Cu2 F12 N8 P2 Ru2 -","2","1","","Luciano Cuesta; Elizabeth Karnas; Vincent M. Lynch; Ping Chen; Jing Shen; Karl M. Kadish; Kei Ohkubo; Shunichi Fukuzumi; Jonathan L. Sessler","Metalloporphycenes: Synthesis and Characterization of (Pentamethylcyclopentadienyl)ruthenium Sitting-Atop and π-Complexes","Journal of the American Chemical Society","2009","131","","13538","13547","10.1021/ja905284d","","","0.71069","MoKα","","0.1099","0.0565","","","0.0987","0.1178","","","","","","1.029","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105043","10.214","0.0002","12.587","0.0003","17.542","0.0004","73.766","0.001","78.165","0.001","82.81","0.001","2113.78","0.08","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C43 H53 Cl2 F6 N4 Ni P Ru -","- C43 H53 Cl2 F6 N4 Ni P Ru -","- C86 H106 Cl4 F12 N8 Ni2 P2 Ru2 -","2","1","","Luciano Cuesta; Elizabeth Karnas; Vincent M. Lynch; Ping Chen; Jing Shen; Karl M. Kadish; Kei Ohkubo; Shunichi Fukuzumi; Jonathan L. Sessler","Metalloporphycenes: Synthesis and Characterization of (Pentamethylcyclopentadienyl)ruthenium Sitting-Atop and π-Complexes","Journal of the American Chemical Society","2009","131","","13538","13547","10.1021/ja905284d","","","0.7107","MoKα","","0.0929","0.0545","","","0.0988","0.1103","","","","","","1.087","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105044","21.737","0.002","25.642","0.002","13.8213","0.0012","90","","90.525","0.005","90","","7703.4","1.1","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H51 F6 N4 P Ru -","- C42 H51 F6 N4 P Ru -","- C336 H408 F48 N32 P8 Ru8 -","8","2","","Luciano Cuesta; Elizabeth Karnas; Vincent M. Lynch; Ping Chen; Jing Shen; Karl M. Kadish; Kei Ohkubo; Shunichi Fukuzumi; Jonathan L. Sessler","Metalloporphycenes: Synthesis and Characterization of (Pentamethylcyclopentadienyl)ruthenium Sitting-Atop and π-Complexes","Journal of the American Chemical Society","2009","131","","13538","13547","10.1021/ja905284d","","","0.7107","MoKα","","0.2232","0.102","","","0.1658","0.2088","","","","","","1.232","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105045","12.3036","0.0006","29.362","0.002","11.8233","0.0007","90","","93.983","0.002","90","","4260.9","0.4","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H59 F6 N4 P Ru -","- C46 H59 F6 N4 P Ru -","- C184 H236 F24 N16 P4 Ru4 -","4","1","","Luciano Cuesta; Elizabeth Karnas; Vincent M. Lynch; Ping Chen; Jing Shen; Karl M. Kadish; Kei Ohkubo; Shunichi Fukuzumi; Jonathan L. Sessler","Metalloporphycenes: Synthesis and Characterization of (Pentamethylcyclopentadienyl)ruthenium Sitting-Atop and π-Complexes","Journal of the American Chemical Society","2009","131","","13538","13547","10.1021/ja905284d","","","0.7107","MoKα","","0.1102","0.0619","","","0.1085","0.1267","","","","","","1.121","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105046","9.3808","0.0014","9.3808","0.0014","15.8006","0.0014","90","","90","","120","","1204.2","0.3","100","2","100","2","","","","","","","","6","P 63","P 6c","173","{NH(prol)3}[MnCr(ox)3](H2O)2","{NH(prol)3}[MnCr(ox)3](H2O)2","","- C15 H26 Cr Mn N O17 -","- C15 Cr Mn N O16.99 -","- C30 Cr2 Mn2 N2 O33.98 -","2","0.333333","","Hisashi Ōkawa; Akihito Shigematsu; Masaaki Sadakiyo; Takuya Miyagawa; Ko Yoneda; Masaaki Ohba; Hiroshi Kitagawa","Oxalate-Bridged Bimetallic Complexes {NH(prol)3}[MCr(ox)3] (M = MnII, FeII, CoII; NH(prol)3+= Tri(3-hydroxypropyl)ammonium) Exhibiting Coexistent Ferromagnetism and Proton Conduction","Journal of the American Chemical Society","2009","131","","13516","13522","10.1021/ja905368d","","","0.71069","MoKα","","0.0841","0.0805","","","0.219","0.2283","","","","","","1.215","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105047","19.615","0.002","16.4013","0.0016","17.4466","0.0018","90","","99.925","0.002","90","","5528.8","1","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H51 N O5 -","- C24 H51 N O5 -","- C192 H408 N8 O40 -","8","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","2009","131","","13548","13554","10.1021/ja905806h","","","0.71073","MoKα","","0.1256","0.0649","","","0.1627","0.1958","","","","","","1.034","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105048","13.095","0.001","13.9148","0.001","16.7377","0.0012","90","","96.29","0.001","90","","3031.5","0.4","100","2","100","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C28 H57 N O4 -","- C28 H57 N O4 -","- C112 H228 N4 O16 -","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","2009","131","","13548","13554","10.1021/ja905806h","","","0.71073","MoKα","","0.082","0.0678","","","0.1718","0.1852","","","","","","1.027","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105049","13.0862","0.0011","15.4546","0.0013","15.2946","0.0013","90","","96.136","0.001","90","","3075.5","0.4","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H57 O4 P -","- C28 H57 O4 P -","- C112 H228 O16 P4 -","4","1","","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","2009","131","","13548","13554","10.1021/ja905806h","","","0.71073","MoKα","","0.1566","0.1038","","","0.2888","0.339","","","","","","1.051","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105050","6.3954","0.0007","31.99","0.003","16.2225","0.0017","90","","97.99","0.004","90","","3286.7","0.6","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C24 H56 Mg O15 -","- C24 H56 Mg O15 -","- C96 H224 Mg4 O60 -","4","1","","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","2009","131","","13548","13554","10.1021/ja905806h","","","1.54178","CuKα","","0.0447","0.0437","","","0.1064","0.1074","","","","","","1.057","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105051","6.4772","0.0006","14.4843","0.0013","17.5838","0.0015","90","","92.39","0.002","90","","1648.2","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H54 Ca O14 -","- C24 H54 Ca O14 -","- C48 H108 Ca2 O28 -","2","0.5","","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","2009","131","","13548","13554","10.1021/ja905806h","","","0.71073","MoKα","","0.0496","0.0429","","","0.0949","0.0979","","","","","","1.038","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105052","12.6808","0.0007","16.7088","0.0008","15.3231","0.0007","90","","103.387","0.003","90","","3158.5","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H48 Cs2 O11 -","- C24 H48 Cs2 O11 -","- C96 H192 Cs8 O44 -","4","1","","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","2009","131","","13548","13554","10.1021/ja905806h","","","1.54184","CuKα","","0.0516","0.0433","","","0.1059","0.1108","","","","","","1.051","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105053","35.5649","0.0015","7.5143","0.0003","10.3977","0.0004","90","","106.706","0.003","90","","2661.45","0.19","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 O4 -","- C12 H22 O4 -","- C96 H176 O32 -","8","1","","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","2009","131","","13548","13554","10.1021/ja905806h","","","1.54178","CuKα","","0.0771","0.0705","","","0.1699","0.1729","","","","","","1.092","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105054","10.083","0.001","7.536","0.001","24.344","0.003","90","","91.43","0.002","90","","1849.2","0.4","146.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 Br N O3 -","- C20 H24 Br N O3 -","- C80 H96 Br4 N4 O12 -","4","1","","Kimberly K. Larson; Richmond Sarpong","Total Synthesis of Alkaloid (\±)-G. B. 13 Using a Rh(I)-Catalyzed Ketone Hydroarylation and Late-Stage Pyridine Reduction","Journal of the American Chemical Society","2009","131","","13244","13245","10.1021/ja9063487","","","0.7107","MoKα","","0.0537","0.0308","","0.0414","","0.0366","","","","","","1.404","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105055","9.382","0.004","10.224","0.004","13.076","0.005","93.713","0.006","93.174","0.006","90.627","0.006","1249.6","0.9","156","2","293","2","","","","","","","","5","P 1","P 1","1","KLVII-033B","","","- C27 H29 Br N2 O6 -","- C27 H29 Br N2 O6 -","- C54 H58 Br2 N4 O12 -","2","2","","Kimberly K. Larson; Richmond Sarpong","Total Synthesis of Alkaloid (\±)-G. B. 13 Using a Rh(I)-Catalyzed Ketone Hydroarylation and Late-Stage Pyridine Reduction","Journal of the American Chemical Society","2009","131","","13244","13245","10.1021/ja9063487","","","0.71073","MoKα","","0.0495","0.0366","","","0.0884","0.0946","","","","","","1.055","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105056","9.6866","0.0005","10.8284","0.0005","35.0668","0.0018","90","","93.727","0.001","90","","3670.4","0.3","103","2","103","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","C8H14[OSSO]H2","C8H14[OSSO]H2","","- C38 H60 O2 S2 -","- C38 H60 O2 S2 -","- C152 H240 O8 S8 -","4","1","","Akihiko Ishii; Tomoyuki Toda; Norio Nakata; Tsukasa Matsuo","Zirconium Complex of an [OSSO]-Type Diphenolate Ligand Bearing trans-1,2-Cyclooctanediylbis(thio) Core: Synthesis, Structure, and Isospecific 1-Hexene Polymerization","Journal of the American Chemical Society","2009","131","","13566","13567","10.1021/ja903369q","","","0.71073","MoKα","","0.0946","0.0605","","","0.1299","0.1475","","","","","","1.031","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105057","43.41","0.002","10.5617","0.0005","22.0673","0.0011","90","","109.356","0.001","90","","9545.6","0.8","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","C8H14[OSSO]Zr(CH2Ph)2","C8H14[OSSO]Zr(CH2Ph)2","","- C52 H72 O2 S2 Zr -","- C52 H72 O2 S2 Zr -","- C416 H576 O16 S16 Zr8 -","8","1","","Akihiko Ishii; Tomoyuki Toda; Norio Nakata; Tsukasa Matsuo","Zirconium Complex of an [OSSO]-Type Diphenolate Ligand Bearing trans-1,2-Cyclooctanediylbis(thio) Core: Synthesis, Structure, and Isospecific 1-Hexene Polymerization","Journal of the American Chemical Society","2009","131","","13566","13567","10.1021/ja903369q","","","0.71073","MoKα","","0.0607","0.0447","","","0.1025","0.111","","","","","","1.018","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105058","9.7254","0.0009","11.3862","0.0011","22.736","0.002","92.369","0.002","96.916","0.002","97.929","0.002","2471.2","0.4","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H47 B2 Cl P2 -","- C20 H47 B2 Cl P2 -","- C80 H188 B8 Cl4 P8 -","4","2","","Gad Fuks; Nathalie Saffon; Laurent Maron; Guy Bertrand; Didier Bourissou","Ionic-Type Reactivity of 1,3-Dibora-2,4-diphosphoniocyclobutane-1,3-diyls: Regio- and Stereoselective Addition of Hydracids","Journal of the American Chemical Society","2009","131","","13681","13689","10.1021/ja903746p","","","0.71073","MoKα","","0.1035","0.0589","","","0.1283","0.1462","","","","","","1.008","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4105059","13.1771","0.001","14.2465","0.0011","14.621","0.0011","67.428","0.001","88.668","0.001","87.489","0.001","2532","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H86 B4 Cl2 P4 -","- C44 H86 B4 Cl2 P4 -","- C88 H172 B8 Cl4 P8 -","2","1","","Gad Fuks; Nathalie Saffon; Laurent Maron; Guy Bertrand; Didier Bourissou","Ionic-Type Reactivity of 1,3-Dibora-2,4-diphosphoniocyclobutane-1,3-diyls: Regio- and Stereoselective Addition of Hydracids","Journal of the American Chemical Society","2009","131","","13681","13689","10.1021/ja903746p","","","0.71073","MoKα","","0.0552","0.037","","","0.0864","0.0963","","","","","","1.01","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4105060","32.3223","0.001","11.0928","0.0004","19.4956","0.0006","90","","114.759","0.002","90","","6347.5","0.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C25.5 H49 B2 F3 O3 P2 S -","- C25.5 H49 B2 F3 O3 P2 S -","- C204 H392 B16 F24 O24 P16 S8 -","8","1","","Gad Fuks; Nathalie Saffon; Laurent Maron; Guy Bertrand; Didier Bourissou","Ionic-Type Reactivity of 1,3-Dibora-2,4-diphosphoniocyclobutane-1,3-diyls: Regio- and Stereoselective Addition of Hydracids","Journal of the American Chemical Society","2009","131","","13681","13689","10.1021/ja903746p","","","0.71073","MoKα","","0.1118","0.0483","","","0.106","0.1314","","","","","","0.943","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4105061","11.5692","0.0007","16.1596","0.001","15.8662","0.001","90","","108.836","0.001","90","","2807.4","0.3","173","2","173","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C21 H47 B2 F3 O3 P2 S -","- C21 H47 B2 F3 O3 P2 S -","- C84 H188 B8 F12 O12 P8 S4 -","4","1","","Gad Fuks; Nathalie Saffon; Laurent Maron; Guy Bertrand; Didier Bourissou","Ionic-Type Reactivity of 1,3-Dibora-2,4-diphosphoniocyclobutane-1,3-diyls: Regio- and Stereoselective Addition of Hydracids","Journal of the American Chemical Society","2009","131","","13681","13689","10.1021/ja903746p","","","0.71073","MoKα","","0.0344","0.0313","","","0.0777","0.0798","","","","","","1.039","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4105062","3.7268","0.0004","11.8446","0.0011","19.9373","0.0017","90","","93.941","0.004","90","","878","0.15","293","2","293","2","","","","","","","synthesised by authors, see text","5","P 1 21/c 1","-P 2ybc","14","","catena-{(μ3-cyanobenzoate-1κN:2κO:3κO) silver(I)} hydrate","","- C8 H6 Ag N O3 -","- C8 H4 Ag N O3 -","- C32 H16 Ag4 N4 O12 -","4","1","","Ming-Sheng Wang; Sheng-Ping Guo; Yan Li; Li-Zhen Cai; Jian-Ping Zou; Gang Xu; Wei-Wei Zhou; Fa-Kun Zheng; Guo-Cong Guo","A Direct White-Light-Emitting Metal-Organic Framework with Tunable Yellow-to-White Photoluminescence by Variation of Excitation Light","Journal of the American Chemical Society","2009","131","","13572","13573","10.1021/ja903947b","","","0.71073","MoKα","","0.0525","0.0441","","","0.1146","0.1222","","","","","","1.135","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105063","8.241","0.002","8.241","","22.545","0.006","90","","90","","120","","1326","0.5","273","2","273","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","Dimethylammoniumironformate","","","- C15 H27 Fe3 N2.97 O18 -","- C15 H27 Fe3 N2.97 O18 -","- C30 H54 Fe6 N5.94 O36 -","2","0.0555556","","Prashant Jain; Vasanth Ramachandran; Ronald J. Clark; Hai Dong Zhou; Brian H. Toby; Naresh S. Dalal; Harold W. Kroto; Anthony K. Cheetham","Multiferroic Behavior Associated with an Order-Disorder Hydrogen Bonding Transition in Metal-Organic Frameworks (MOFs) with the Perovskite ABX3 Architecture","Journal of the American Chemical Society","2009","131","","13625","13627","10.1021/ja904156s","","","0.71073","MoKα","","0.0561","0.0403","","","0.0883","0.093","","","","","","1.074","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105064","11.8137","0.0008","15.5303","0.0011","16.3912","0.0015","90","","90","","90","","3007.3","0.4","190","0.3","190","0.3","","","","","","","","6","P 1","P 1","1","","","","- C51 H36 N2 O8 Si Zn2 -","- C51 H36 N2 O8 Si Zn2 -","- C51 H36 N2 O8 Si Zn2 -","1","1","","Tendai Gadzikwa; Omar K. Farha; Christos D. Malliakas; Mercouri G. Kanatzidis; Joseph T. Hupp; SonBinh T. Nguyen","Selective Bifunctional Modification of a Non-catenated Metal-Organic Framework Material via ""Click"" Chemistry","Journal of the American Chemical Society","2009","131","","13613","13615","10.1021/ja904189d","","","0.71073","MoKα","","0.0894","0.0696","","","0.166","0.1767","","","","","","0.935","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105065","16.4174","0.001","12.8384","0.0008","17.5249","0.0011","90","","90.174","0.001","90","","3693.8","0.4","153","2","153","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C34 H54 Ga Si3 U -","- C34 H54 Ga Si3 U -","- C136 H216 Ga4 Si12 U4 -","4","2","","Stefan G. Minasian; Jamin L. Krinsky; Jeffrey D. Rinehart; Roy Copping; Tolek Tyliszczak; Markus Janousch; David K. Shuh; John Arnold","A Comparison of 4f vs 5f Metal-Metal Bonds in (CpSiMe3)3M-ECp* (M = Nd, U; E = Al, Ga; Cp* = C5Me5): Synthesis, Thermodynamics, Magnetism, and Electronic Structure","Journal of the American Chemical Society","2009","131","","13767","13783","10.1021/ja904565j","","","0.71073","MoKα","","0.0516","0.0419","","","0.0774","0.082","","","","","","0.997","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105066","8.3245","0.0005","22.2396","0.0012","28.9822","0.0016","90","","90","","90","","5365.6","0.5","130","2","130","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H39 Nd Si3 -","- C24 H39 Nd Si3 -","- C192 H312 Nd8 Si24 -","8","1","","Stefan G. Minasian; Jamin L. Krinsky; Jeffrey D. Rinehart; Roy Copping; Tolek Tyliszczak; Markus Janousch; David K. Shuh; John Arnold","A Comparison of 4f vs 5f Metal-Metal Bonds in (CpSiMe3)3M-ECp* (M = Nd, U; E = Al, Ga; Cp* = C5Me5): Synthesis, Thermodynamics, Magnetism, and Electronic Structure","Journal of the American Chemical Society","2009","131","","13767","13783","10.1021/ja904565j","","","0.71073","MoKα","","0.0573","0.0349","","","0.0691","0.0765","","","","","","1.006","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105067","13.1352","0.001","13.1883","0.001","17.824","0.0013","90.58","0.001","103.009","0.001","109.119","0.001","2830.7","0.4","131","2","131","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H162 Ga2 Nd4 O2 Si10 -","- C100 H162 Ga2 Nd4 O2 Si10 -","- C100 H162 Ga2 Nd4 O2 Si10 -","1","0.5","","Stefan G. Minasian; Jamin L. Krinsky; Jeffrey D. Rinehart; Roy Copping; Tolek Tyliszczak; Markus Janousch; David K. Shuh; John Arnold","A Comparison of 4f vs 5f Metal-Metal Bonds in (CpSiMe3)3M-ECp* (M = Nd, U; E = Al, Ga; Cp* = C5Me5): Synthesis, Thermodynamics, Magnetism, and Electronic Structure","Journal of the American Chemical Society","2009","131","","13767","13783","10.1021/ja904565j","","","0.71073","MoKα","","0.0529","0.0396","","","0.0893","0.0979","","","","","","1.037","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105068","31.3199","0.0001","66.5281","0.0006","31.002","0.0001","90","","120.28","0.001","90","","55784.5","0.8","123","2","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- Co10 H600 Mo88 Na10 O400 -","- Mo87.966 O353.69 -","- Mo351.864 O1414.76 -","4","1","","Hiroyuki Imai; Tomoyuki Akutagawa; Fumito Kudo; Mitsuhiro Ito; Kazuhiro Toyoda; Shin-ichiro Noro; Leroy Cronin; Takayoshi Nakamura","Structure, Magnetism, and Ionic Conductivity of the Gigantic {Mo176}-Wheel Assembly: Na15Fe3Co16[Mo176O528H3(H2O)80]Cl27.450H2O","Journal of the American Chemical Society","2009","131","","13578","13579","10.1021/ja9048042","","x-ray","0.689","","","","0.0752","","","","0.2627","","","","","","1.014","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105069","22.211","0.002","7.9924","0.0008","16.8189","0.0016","90","","110.412","0.001","90","","2798.2","0.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H20 N2 O2 S -","- C13 H20 N2 O2 S -","- C104 H160 N16 O16 S8 -","8","1","","Richard S. Glass; Gordon L. Hug; Christian Schöneich; George S. Wilson; Larisa Kuznetsova; Tang-man Lee; Malika Ammam; Edward Lorance; Thomas Nauser; Gary S. Nichol; Takuhei Yamamoto","Neighboring Amide Participation in Thioether Oxidation: Relevance to Biological Oxidation","Journal of the American Chemical Society","2009","131","","13791","13805","10.1021/ja904895u","","","0.71073","MoKα","","0.0574","0.0465","","","0.114","0.124","","","","","","1.033","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105070","9.0746","0.0003","17.4596","0.0005","36.6618","0.001","90","","90","","90","","5808.7","0.3","295","2","295","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C29 H33 Br N2 O6 -","- C29 H33 Br N2 O6 -","- C232 H264 Br8 N16 O48 -","8","1","","Xiao-Hua Chen; Qiang Wei; Shi-Wei Luo; Han Xiao; Liu-Zhu Gong","Organocatalytic Synthesis of Spiro[pyrrolidin-3,3'-oxindoles] with High Enantiopurity and Structural Diversity","Journal of the American Chemical Society","2009","131","","13819","13825","10.1021/ja905302f","","","1.54184","CuKα","","0.1454","0.074","","","0.1609","0.1772","","","","","","1.056","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105071","11.8387","0.0006","4.987","0.0003","12.2899","0.0006","90","","107.049","0.003","90","","693.7","0.07","120","","120","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H18 O4 -","- C15 H18 O4 -","- C30 H36 O8 -","2","1","","Stephen P. Lathrop; Tomislav Rovis","Asymmetric Synthesis of Functionalized Cyclopentanones via a Multicatalytic Secondary Amine/N-Heterocyclic Carbene Catalyzed Cascade Sequence","Journal of the American Chemical Society","2009","131","","13628","13630","10.1021/ja905342e","","","0.71073","MoKα","","0.0526","0.0434","","","0.1091","0.1158","","","","","","1.035","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105072","5.7342","0.0005","15.4013","0.0012","13.9378","0.001","90","","93.861","0.003","90","","1228.11","0.17","120","","120","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C14 H16 O3 -","- C14 H16 O3 -","- C56 H64 O12 -","4","2","","Stephen P. Lathrop; Tomislav Rovis","Asymmetric Synthesis of Functionalized Cyclopentanones via a Multicatalytic Secondary Amine/N-Heterocyclic Carbene Catalyzed Cascade Sequence","Journal of the American Chemical Society","2009","131","","13628","13630","10.1021/ja905342e","","","0.71073","MoKα","","0.0481","0.0385","","","0.0867","0.0911","","","","","","1.075","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105073","10.3296","0.0007","19.3034","0.0012","21.659","0.0014","90","","90","","90","","4318.7","0.5","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","CpSc(CH2SiMe3)2(thf)","","","- C17 H35 O Sc Si2 -","- C17 H35 O Sc Si2 -","- C136 H280 O8 Sc8 Si16 -","8","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0586","0.0433","","","0.1172","0.1241","","","","","","1.011","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105074","9.6699","0.0008","10.88","0.0009","21.3864","0.0017","90","","94.657","0.001","90","","2242.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(MeC5H4)Sc(CH2SiMe3)2(thf)","","","- C18 H37 O Sc Si2 -","- C18 H37 O Sc Si2 -","- C72 H148 O4 Sc4 Si8 -","4","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0488","0.0375","","","0.097","0.1012","","","","","","1.003","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105075","10.6883","0.0019","10.871","0.002","11.368","0.002","87.149","0.002","75.32","0.002","89.132","0.002","1276.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","(C5Me4H)Sc(CH2SiMe3)(thf)","","","- C21 H43 O Sc Si2 -","- C21 H43 O Sc Si2 -","- C42 H86 O2 Sc2 Si4 -","2","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0689","0.0597","","","0.1671","0.1761","","","","","","1.046","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105076","11.4414","0.0005","14.9248","0.0007","17.1487","0.0008","105.954","0.001","90.514","0.001","105.852","0.001","2697.3","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Cp*Sc(CH2SiMe3)2(thf)","","","- C22 H45 O Sc Si2 -","- C22 H45 O Sc Si2 -","- C88 H180 O4 Sc4 Si8 -","4","2","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0678","0.042","","","0.0994","0.1094","","","","","","1.025","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105077","10.627","0.003","11.68","0.003","13.541","0.004","83.223","0.004","85.051","0.004","80.193","0.004","1640.9","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","(CpPPh2)Sc(CH2SiMe3)2(thf)","","","- C31 H45 P Sc Si2 -","- C31 H42 P Sc Si2 -","- C62 H84 P2 Sc2 Si4 -","2","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0998","0.0537","","","0.116","0.1253","","","","","","1.001","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105078","10.8504","0.0016","11.2243","0.0016","12.3328","0.0018","66.873","0.002","76.458","0.002","80.993","0.002","1339.4","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","(CpC6H4OMe)Sc(CH2SiMe3)2(thf)","","","- C24 H41 O Sc Si2 -","- C24 H41 O Sc Si2 -","- C48 H82 O2 Sc2 Si4 -","2","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.043","0.0366","","","0.1025","0.1065","","","","","","1.058","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105079","13.306","0.002","11.573","0.002","15.934","0.003","90","","95.471","0.003","90","","2442.5","0.7","173","2","173","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","(CpC6H4NMeCCH2)Sc(CH2SiMe3)","","","- C48 H78 N2 Sc2 Si2 -","- C48 H78 N2 Sc2 Si2 -","- C96 H156 N4 Sc4 Si4 -","2","0.5","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0663","0.0403","","","0.0764","0.0807","","","","","","1.034","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105080","12.472","0.003","13.767","0.003","16.813","0.004","93.771","0.003","107.989","0.003","106.375","0.003","2597.1","1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","Cp'Sc(CH2SiMe3)(thf)2","","","- C48 H48 B F20 O2 Sc Si2 -","- C48 H48 B F20 O2 Sc Si2 -","- C96 H96 B2 F40 O4 Sc2 Si4 -","2","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.0904","0.0517","","","0.1188","0.1307","","","","","","1.024","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105081","11.874","0.002","12.482","0.002","18.539","0.004","102.29","0.003","102.105","0.003","92.921","0.003","2611.8","0.8","173","2","173","2","","","","","","","","7","P -1","-P 1","2","(CpC6H4OMe)Sc(CH2SiMe3)(thf)2","","","- C52 H46 B F20 O3 Sc Si -","- C52 H46 B F20 O3 Sc Si -","- C104 H92 B2 F40 O6 Sc2 Si2 -","2","1","","Xiaofang Li; Masayoshi Nishiura; Lihong Hu; Kyouichi Mori; Zhaomin Hou","Alternating and Random Copolymerization of Isoprene and Ethylene Catalyzed by Cationic Half-Sandwich Scandium Alkyls","Journal of the American Chemical Society","2009","131","","13870","13882","10.1021/ja9056213","","","0.71073","MoKα","","0.1622","0.0924","","","0.1837","0.2152","","","","","","1.045","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105082","12.691","0.005","19.134","0.007","20.044","0.007","68.881","0.005","89.92","0.005","89.596","0.005","4540","3","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C100 H124 N6 O14 Zn -","- C100 H124 N6 O14 Zn -","- C200 H248 N12 O28 Zn2 -","2","1","","Janet E. Lovett; Markus Hoffmann; Arjen Cnossen; Alexander T. J. Shutter; Hannah J. Hogben; Christopher W. M. Kay; Christiane R. Timmel; Harry L. Anderson","Probing Flexibility in Porphyrin-Based Molecular Wires Using Double Electron Electron Resonance","Journal of the American Chemical Society","2009","131","","13852","13859","10.1021/ja905796z","","","0.6939","synchrotron","","0.1262","0.073","","0.1061","0.0868","0.0868","","","","","","1.3046","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105083","32.5892","0.0012","15.3988","0.0006","28.4571","0.001","90","","124.734","0.003","90","","11736","0.9","325","2","325","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C51 H71 N O11 -","- C51 H71 N O11 -","- C408 H568 N8 O88 -","8","1","","Paul G. Clark; Michael W. Day; Robert H. Grubbs","Switching and Extension of a [c2]Daisy-Chain Dimer Polymer","Journal of the American Chemical Society","2009","131","","13631","13633","10.1021/ja905924u","","","1.54178","CuKα","","0.1521","0.1087","","","0.1987","0.2031","","","","","","2.758","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4105084","13.566","0.004","15.65","0.005","29.776","0.009","90","","90","","90","","6322","3","103","2","103","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C28 H28 Cl4 N O5 P Pd S -","- C28 H28 Cl4 N O5 P Pd S -","- C224 H224 Cl32 N8 O40 P8 Pd8 S8 -","8","1","","Shusuke Noda; Akifumi Nakamura; Takuya Kochi; Lung Wa Chung; Keiji Morokuma; Kyoko Nozaki","Mechanistic Studies on the Formation of Linear Polyethylene Chain Catalyzed by Palladium Phosphine-Sulfonate Complexes: Experiment and Theoretical Studies","Journal of the American Chemical Society","2009","131","","14088","14100","10.1021/ja9047398","","","0.7107","MoKα","","0.0396","0.0372","","","0.0914","0.093","","","","","","1.11","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105085","11.595","0.0007","14.7764","0.0009","29.2387","0.0018","90","","90","","90","","5009.5","0.5","143","1","143","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H44 B2 K N O6 -","- C18 H44 B2 K N O6 -","- C144 H352 B16 K8 N8 O48 -","8","1","","Daniel W. Himmelberger; Chang Won Yoon; Martin E. Bluhm; Patrick J. Carroll; Larry G. Sneddon","Base-Promoted Ammonia Borane Hydrogen-Release","Journal of the American Chemical Society","2009","131","","14101","14110","10.1021/ja905015x","","","0.71073","MoKα","","0.0459","0.0374","","","0.0892","0.0943","","","","","","1.031","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105086","7.5161","0.0005","10.3189","0.0005","10.7196","0.0008","90","","89.877","0.006","90","","831.39","0.09","208","2","208","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H26 B N O2 -","- C17 H26 B N O2 -","- C34 H52 B2 N2 O4 -","2","1","","Kyoung Taek Kim; Jeroen J. L. M. Cornelissen; Roeland J. M. Nolte; Jan C. M. van Hest","Polymeric Monosaccharide Receptors Responsive at Neutral pH","Journal of the American Chemical Society","2009","131","","13908","13909","10.1021/ja905652w","","","0.71073","MoKα","","0.0526","0.042","","0.0891","0.0849","0.0891","","","1.106","","","1.106","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105087","10.604","0.006","12.799","0.007","15.992","0.009","90","","99.688","0.001","90","","2139","2","85","2","85","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Cl N3 O Pd -","- C23 H26 Cl N3 O Pd -","- C92 H104 Cl4 N12 O4 Pd4 -","4","1","","Polly L. Arnold; Melanie S. Sanford; Stephen M. Pearson","Chelating N-Heterocyclic Carbene Alkoxide as a Supporting Ligand for PdII/IV C-H Bond Functionalization Catalysis","Journal of the American Chemical Society","2009","131","","13912","13913","10.1021/ja905713t","","","0.71073","MoKα","","0.0758","0.038","","","0.0692","0.08","","","","","","1.044","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105088","13.5786","0.0007","12.6706","0.0006","15.1481","0.0008","90","","97.18","","90","","2585.8","0.2","85","2","85","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H31 Cl2 N3 O2 Pd -","- C26 H31 Cl2 N3 O2 Pd -","- C104 H124 Cl8 N12 O8 Pd4 -","4","1","","Polly L. Arnold; Melanie S. Sanford; Stephen M. Pearson","Chelating N-Heterocyclic Carbene Alkoxide as a Supporting Ligand for PdII/IV C-H Bond Functionalization Catalysis","Journal of the American Chemical Society","2009","131","","13912","13913","10.1021/ja905713t","","","0.71073","MoKα","","0.0307","0.0261","","","0.0658","0.0688","","","","","","1.08","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105089","36.323","0.012","10.166","0.003","34.552","0.01","90","","99.372","0.009","90","","12588","7","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C154 H132 B3 N23 -","- C154 H132 B3 N23 -","- C616 H528 B12 N92 -","4","1","","Barry A. Blight; Amaya Camara-Campos; Smilja Djurdjevic; Martin Kaller; David A. Leigh; Fiona M. McMillan; Hamish McNab; Alexandra M. Z. Slawin","AAA-DDD Triple Hydrogen Bond Complexes","Journal of the American Chemical Society","2009","131","","14116","14122","10.1021/ja906061v","","","1.54178","CuKα","","0.1103","0.0884","","","0.2417","0.2881","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105090","30.938","0.003","12.09","0.002","20.027","0.002","90","","110.221","0.01","90","","7029.2","1.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C74 H68 F8 Fe N8 -","- C74 H68 F8 Fe N8 -","- C296 H272 F32 Fe4 N32 -","4","0.5","","Heather R. Lucas; Gerald J. Meyer; Kenneth D. Karlin","Carbon Monoxide and Nitrogen Monoxide Ligand Dynamics in Synthetic Heme and Heme-Copper Complex Systems","Journal of the American Chemical Society","2009","131","","13924","13925","10.1021/ja906172c","","","0.71073","MoKα","","0.0806","0.0546","","","0.1399","0.1548","","","","","","0.961","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105091","13.669","0.006","14.829","0.007","18.824","0.008","90","","91.964","0.008","90","","3813","3","143","2","143","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C46 H39 Cl N2 O P Rh S -","- C46 H39 Cl N2 O P Rh S -","- C184 H156 Cl4 N8 O4 P4 Rh4 S4 -","4","1","","Yoshihiro Matano; Tooru Miyajima; Noriaki Ochi; Takashi Nakabuchi; Motoo Shiro; Yoshihide Nakao; Shigeyoshi Sakaki; Hiroshi Imahori","Syntheses, Structures, and Coordination Chemistry of Phosphole-Containing Hybrid Calixphyrins: Promising Macrocyclic P,N2,X-Mixed Donor Ligands for Designing Reactive Transition Metal Complexes","Journal of the American Chemical Society","2009","131","","14123","14123","10.1021/ja907161j","","","0.7107","MoKα","","0.1435","0.1127","","","0.2041","0.2285","","","","","","1.264","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105092","46.377","0.009","26.689","0.005","12.107","0.002","90","","92.84","0.03","90","","14967","5","4","","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","JLG-12","","","- C180 H600 Ge139.73 N60 O339.45 -","- Ge139.728 O339.456 -","- Ge139.728 O339.456 -","1","0.125","","Xiaoyan Ren; Yi Li; Qinhe Pan; Jihong Yu; Ruren Xu; Ying Xu","A Crystalline Germanate with Mesoporous 30-Ring Channels","Journal of the American Chemical Society","2009","131","","14128","14129","10.1021/ja902413j","","","0.71073","MoKα","","0.1436","0.0938","","","0.2237","0.2436","","","","","","0.907","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105093","19.698","0.011","9.579","0.005","11.98","0.007","90","0.002","102.414","0.002","90","0.002","2208","2","103.15","","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H38 Ir N P2 -","- C19 H38 Ir N P2 -","- C76 H152 Ir4 N4 P8 -","4","0.5","","Ryo Tanaka; Makoto Yamashita; Kyoko Nozaki","Catalytic Hydrogenation of Carbon Dioxide Using Ir(III)-Pincer Complexes","Journal of the American Chemical Society","2009","131","","14168","14169","10.1021/ja903574e","","","0.7107","MoKα","","0.0503","0.0351","","","0.0727","0.0802","","","","","","1.061","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105094","12.0232","0.0002","15.6642","0.0003","18.963","0.0003","70.65","0.001","87.145","0.001","83.73","0.001","3349.13","0.1","193","2","193","2","","","","","","","chemical synthesis","5","P -1","-P 1","2","(dmpm)Mn(py)2","bis-pyridine (1,9-dimesityl-5,5-dimethyldipyrromethanato)manganese(II)","","- C77.61 H85.19 Mn2 N7.61 O0.4 -","- C77.605 H85.185 Mn2 N7.605 O0.395 -","- C155.21 H170.37 Mn4 N15.21 O0.79 -","2","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.095","0.0484","","","0.0994","0.117","","","","","","0.998","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105095","14.1937","0.0002","10.4697","0.0001","23.1322","0.0003","90","","104.822","0.001","90","","3323.15","0.07","193","2","193","2","","","","","","","chemical synthesis","4","P 1 21/n 1","-P 2yn","14","(dmpm)Fe(py)2","bis-pyridine (1,9-dimesityl-5,5-dimethyldipyrromethanato)iron(II)","","- C39 H42 Fe N4 -","- C39 H42 Fe N4 -","- C156 H168 Fe4 N16 -","4","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.0627","0.0392","","","0.0936","0.1059","","","","","","1.019","","","","has coordinates,has disorder","178796","2020-10-21","18:00:00",""
"4105096","16.09","0.0008","12.823","0.0007","17.9711","0.0009","90","","114.562","0.001","90","","3372.3","0.3","193","2","193","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","(dmpm)Co(py)2","bis-pyridine (1,9-dimesityl-5,5-dimethyldipyrromethanato)cobalt(II)","","- C39 H42 Co N4 -","- C39 H42 Co N4 -","- C156 H168 Co4 N16 -","4","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.0482","0.0382","","","0.0974","0.1057","","","","","","1.038","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105097","9.2319","0.001","27.39","0.003","14.7364","0.0015","90","","96.2208","0.0017","90","","3704.3","0.7","193","2","193","2","","","","","","","chemical synthesis","5","P 1 21/n 1","-P 2yn","14","(dmpm)Ni(py)2","bis-pyridine (1,9-dimesityl-5,5-dimethyldipyrromethanato)nickel(II)","","- C43 H50 N4 Ni O -","- C43 H50 N4 Ni O -","- C172 H200 N16 Ni4 O4 -","4","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.0662","0.0463","","","0.1052","0.1162","","","","","","1.027","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105098","11.9617","0.0016","15.652","0.002","19.66","0.003","67.369","0.002","87.695","0.003","82.901","0.002","3371.3","0.8","193","2","193","2","","","","","","","chemical synthesis","4","P -1","-P 1","2","(dmpm)Zn(py)2","bis-pyridine (1,9-dimesityl-5,5-dimethyldipyrromethanato)zinc(II)","","- C39 H42 N4 Zn -","- C39 H42 N4 Zn -","- C156 H168 N16 Zn4 -","4","2","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","","0.71073","MoKα","","0.083","0.0488","","","0.1164","0.1313","","","","","","1.058","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105099","13.7199","0.0007","12.6669","0.0005","22.8413","0.0012","90","","103.487","0.003","90","","3860.1","0.3","193","2","193","2","","","","","","","chemical synthesis","7","P 1 21/n 1","-P 2yn","14","[(dmpm)CoCl(THF)][Li(THF)2]","(mono-tetrahydrofuran)(1,9-dimesitly-5,5-dimethyldipyrromethanato)cobalt(II) chloride (bis-tetrahydrofuran)lithiate","","- C41 H56 Cl Co Li N2 O3 -","- C41 H56 Cl Co Li N2 O3 -","- C164 H224 Cl4 Co4 Li4 N8 O12 -","4","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.1955","0.0671","","","0.1242","0.1774","","","","","","0.927","","","","has coordinates","178796","2020-10-21","18:00:00",""
"4105100","10.7737","0.0003","23.0411","0.0005","16.5575","0.0004","90","","90.09","0.001","90","","4110.19","0.18","100","2","100","2","","","","","","","chemical synthesis","5","P 1 21/c 1","-P 2ybc","14","(dmpm)Fe(bpy)","bipyridine (1,9-dimesityl-5,5-dimethyldipyrromethanato)nickel(II)","","- C47 H56 Fe N4 O2 -","- C47 H56 Fe N4 O2 -","- C188 H224 Fe4 N16 O8 -","4","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.0618","0.0418","","","0.1013","0.1122","","","","","","1.029","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105101","14.389","0.003","7.4555","0.001","21.93","0.009","90","","103.2","0.03","90","","2290.4","1.1","193","2","193","2","","","","","","","chemical synthesis","3","P 1 21/c 1","-P 2ybc","14","(dmpm)-2H","2,5-Dimesityl-7,7-dimethyl-7H-1,6-diazacyclopenta[a]pentalene","","- C29 H30 N2 -","- C29 H30 N2 -","- C116 H120 N8 -","4","1","","Evan R. King; Theodore A. Betley","Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands","Journal of the American Chemical Society","2009","131","","14374","14380","10.1021/ja903997a","","x-ray","0.71073","MoKα","","0.0683","0.0524","","","0.137","0.1528","","","","","","1.017","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105102","9.188","0.003","18.326","0.005","25.212","0.007","90","","98.618","0.005","90","","4197","2","113.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H39 Cl2 F3 O4 P2 Pt S -","- C44 H39 Cl2 F3 O4 P2 Pt S -","- C176 H156 Cl8 F12 O16 P8 Pt4 S4 -","4","1","","Takashi Ohshima; Yoshiki Miyamoto; Junji Ipposhi; Yasuhito Nakahara; Masaru Utsunomiya; Kazushi Mashima","Platinum-Catalyzed Direct Amination of Allylic Alcohols under Mild Conditions: Ligand and Microwave Effects, Substrate Scope, and Mechanistic Study","Journal of the American Chemical Society","2009","131","","14317","14328","10.1021/ja9046075","","","0.71075","MoKα","","","0.0616","","","","0.1612","","","","","","1.109","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105103","8.9147","0.0003","22.8108","0.0006","6.9905","0.0002","90","","104.193","0.004","90","","1378.14","0.07","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Cl F N Pt -","- C15 H15 Cl F N Pt -","- C60 H60 Cl4 F4 N4 Pt4 -","4","1","","Sarah H. Crosby; Guy J. Clarkson; Jonathan P. Rourke","A Delicate Balance between sp2 and sp3 C-H Bond Activation: A Pt(II) Complex with a Dual Agostic Interaction","Journal of the American Chemical Society","2009","131","","14142","14143","10.1021/ja905046n","","","0.71073","MoKα","","0.0286","0.0216","","","0.0434","0.0444","","","","","","1.003","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105104","10.4454","0.0001","9.1995","0.0002","11.4117","0.0002","90","","112.762","0.001","90","","1011.18","0.03","100","2","100","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C6 H18 B0.5 P2 Rh0.5 -","- C6 H18 B0.5 P2 Rh0.5 -","- C24 H72 B2 P8 Rh2 -","4","1","","Michael T. Mock; Robert G. Potter; Donald M. Camaioni; Jun Li; William G. Dougherty; W. Scott Kassel; Brendan Twamley; Daniel L. DuBois","Thermodynamic Studies and Hydride Transfer Reactions from a Rhodium Complex to BX3 Compounds","Journal of the American Chemical Society","2009","131","","14454","14465","10.1021/ja905287q","","","1.54178","CuKα","","0.0361","0.0308","","","0.0784","0.0824","","","","","","1.047","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105105","30.0678","0.0005","9.3277","0.0001","17.4534","0.0003","90","","100.997","0.001","90","","4805.15","0.13","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H37 P4 Rh S -","- C18 H37 P4 Rh S -","- C144 H296 P32 Rh8 S8 -","8","1","","Michael T. Mock; Robert G. Potter; Donald M. Camaioni; Jun Li; William G. Dougherty; W. Scott Kassel; Brendan Twamley; Daniel L. DuBois","Thermodynamic Studies and Hydride Transfer Reactions from a Rhodium Complex to BX3 Compounds","Journal of the American Chemical Society","2009","131","","14454","14465","10.1021/ja905287q","","","1.54178","CuKα","","0.0242","0.0225","","","0.0588","0.0598","","","","","","1.029","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105106","13.0664","0.0011","13.0868","0.0011","13.553","0.0012","74.795","0.003","83.485","0.003","89.799","0.003","2221.1","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H62 B O P4 Rh S4 -","- C40 H62 B O P4 Rh S4 -","- C80 H124 B2 O2 P8 Rh2 S8 -","2","1","","Michael T. Mock; Robert G. Potter; Donald M. Camaioni; Jun Li; William G. Dougherty; W. Scott Kassel; Brendan Twamley; Daniel L. DuBois","Thermodynamic Studies and Hydride Transfer Reactions from a Rhodium Complex to BX3 Compounds","Journal of the American Chemical Society","2009","131","","14454","14465","10.1021/ja905287q","","","0.71073","MoKα","","0.0324","0.026","","","0.06","0.0627","","","","","","1.024","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105107","9.3217","0.0005","23.7165","0.0012","17.4337","0.0009","90","","94.144","0.001","90","","3844.1","0.3","90","2","90","2","","","","","","","","6","C 1 c 1","C -2yc","9","[DMPE2Ph][(PhO)4B]","","","- C36 H52 B O4 P4 Rh -","- C36 H52 B O4 P4 Rh -","- C144 H208 B4 O16 P16 Rh4 -","4","1","","Michael T. Mock; Robert G. Potter; Donald M. Camaioni; Jun Li; William G. Dougherty; W. Scott Kassel; Brendan Twamley; Daniel L. DuBois","Thermodynamic Studies and Hydride Transfer Reactions from a Rhodium Complex to BX3 Compounds","Journal of the American Chemical Society","2009","131","","14454","14465","10.1021/ja905287q","","","0.71073","MoKα","","0.0404","0.0354","","","0.0781","0.081","","","","","","1.041","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105108","5.8212","0.0008","24.359","0.003","11.9665","0.0016","90","","94.553","0.004","90","","1691.5","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 B S3 -","- C18 H15 B S3 -","- C72 H60 B4 S12 -","4","1","","Michael T. Mock; Robert G. Potter; Donald M. Camaioni; Jun Li; William G. Dougherty; W. Scott Kassel; Brendan Twamley; Daniel L. DuBois","Thermodynamic Studies and Hydride Transfer Reactions from a Rhodium Complex to BX3 Compounds","Journal of the American Chemical Society","2009","131","","14454","14465","10.1021/ja905287q","","","0.71073","MoKα","","0.1187","0.0478","","","0.0796","0.0974","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105109","10.0577","0.0019","10.8143","0.001","13.1328","0.0019","90","","100.152","0.014","90","","1406.1","0.4","200","","200","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C11 H10 B F4 Mn O4 -","- C11 H10 B F4 Mn O4 -","- C44 H40 B4 F16 Mn4 O16 -","4","2","","Antoine Eloi; Françoise Rose-Munch; Eric Rose","Resolution of Planar Chiral Cationic (η6-Arene)tricarbonylmanganese Complexes","Journal of the American Chemical Society","2009","131","","14178","14179","10.1021/ja905712k","","","0.71073","MoKα","","0.096","0.0727","","0.1149","0.0831","0.0797","","","","","","1.0744","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105110","7.3987","0.0011","9.934","0.0012","13.8457","0.0019","90","","91.739","0.011","90","","1017.2","0.2","200","","200","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H25 Mn O5 -","- C21 H25 Mn O5 -","- C42 H50 Mn2 O10 -","2","1","","Antoine Eloi; Françoise Rose-Munch; Eric Rose","Resolution of Planar Chiral Cationic (η6-Arene)tricarbonylmanganese Complexes","Journal of the American Chemical Society","2009","131","","14178","14179","10.1021/ja905712k","","","0.71073","MoKα","","0.0308","0.0258","","0.0338","0.0298","0.0293","","","","","","1.0793","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105111","8.787","0.005","14.455","0.005","28.832","0.005","90","","90","","90","","3662","3","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C37 H41 N7 O4 -","- C37 H45 N7 O6 -","- C148 H180 N28 O24 -","4","1","","Clémence Mocquet; Arnaud Salaün; Paul Claudon; Barbara Le Grel; Michel Potel; Gilles Guichard; Brigitte Jamart-Grégoire; Philippe Le Grel","Aza-β3-cyclopeptides: A New Way of Controlling Nitrogen Chirality","Journal of the American Chemical Society","2009","131","","14521","14525","10.1021/ja9058074","","x-ray","0.71069","MoKα","","0.0471","0.0443","","","0.0869","0.0883","","","","","","1.17","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105112","25.421","0.0017","25.421","","6.6885","0.0005","90","","90","","120","","3743.2","0.4","100","2","100","2","","","","","","","synthesis as described","4","R 3 :H","R 3","146","","","","- C46 H67 N11 O6 -","- C45.99 H66.99 N11.01 O6 -","- C137.97 H200.97 N33.03 O18 -","3","0.333333","","Clémence Mocquet; Arnaud Salaün; Paul Claudon; Barbara Le Grel; Michel Potel; Gilles Guichard; Brigitte Jamart-Grégoire; Philippe Le Grel","Aza-β3-cyclopeptides: A New Way of Controlling Nitrogen Chirality","Journal of the American Chemical Society","2009","131","","14521","14525","10.1021/ja9058074","","x-ray","0.71073","MoKα","","0.0454","0.0427","","","0.0957","0.0973","","","","","","1.069","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105113","11.31","0.003","28.101","0.006","11.975","0.003","90","","101.068","0.0013","90","","3735.1","1.6","120.15","","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H57 B N2 O3 Ti -","- C35 H57 B N2 O3 Ti -","- C140 H228 B4 N8 O12 Ti4 -","4","1","","Tomomi Terabayashi; Takashi Kajiwara; Makoto Yamashita; Kyoko Nozaki","Group-4 Transition-Metal Boryl Complexes: Syntheses, Structures, Boron-Metal Bonding Properties, and Application as a Polymerization Catalyst","Journal of the American Chemical Society","2009","131","","14162","14163","10.1021/ja905950g","","","0.7107","MoKα","","0.0554","0.0489","","","0.1108","0.1142","","","","","","1.11","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105114","18.7","0.003","12.582","0.002","19.211","0.004","90","","104.734","0.0005","90","","4371.4","1.3","121.15","","121","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H65 B Hf N2 -","- C50 H65 B Hf N2 -","- C200 H260 B4 Hf4 N8 -","4","1","","Tomomi Terabayashi; Takashi Kajiwara; Makoto Yamashita; Kyoko Nozaki","Group-4 Transition-Metal Boryl Complexes: Syntheses, Structures, Boron-Metal Bonding Properties, and Application as a Polymerization Catalyst","Journal of the American Chemical Society","2009","131","","14162","14163","10.1021/ja905950g","","","0.7107","MoKα","","0.0343","0.0299","","","0.0706","0.0748","","","","","","1.066","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105115","8.6071","0.0005","17.832","0.0009","14.8374","0.0007","90","","99.225","0.001","90","","2247.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H52 Cl10 Ir2 N6 Pd -","- C32 H52 Cl10 Ir2 N6 Pd -","- C64 H104 Cl20 Ir4 N12 Pd2 -","2","0.5","","Alessandro Zanardi; José A. Mata; Eduardo Peris","Well-Defined Ir/Pd Complexes with a Triazolyl-diylidene Bridge as Catalysts for Multiple Tandem Reactions","Journal of the American Chemical Society","2009","131","","14531","14537","10.1021/ja906028g","","x-ray","0.71073","MoKα","","0.0697","0.0373","","","0.0745","0.0841","","","","","","1.022","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105116","9.1008","0.001","8.805","0.001","14.0629","0.0015","90","","105.996","0.002","90","","1083.3","0.2","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C15 H25 Cl2 F6 Ir N3 P -","- C15 H25 Cl2 F6 Ir N3 P -","- C30 H50 Cl4 F12 Ir2 N6 P2 -","2","1","","Alessandro Zanardi; José A. Mata; Eduardo Peris","Well-Defined Ir/Pd Complexes with a Triazolyl-diylidene Bridge as Catalysts for Multiple Tandem Reactions","Journal of the American Chemical Society","2009","131","","14531","14537","10.1021/ja906028g","","x-ray","0.71073","MoKα","","0.0573","0.0438","","","0.0978","0.1043","","","","","","1.008","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105117","28.963","0.0008","13.9348","0.0004","23.0014","0.0007","90","","126.64","0.001","90","","7448.9","0.4","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H32 Cl12.5 Ir N4 Pd -","- C23 H32 Cl12.5 Ir N4 Pd -","- C184 H256 Cl100 Ir8 N32 Pd8 -","8","1","","Alessandro Zanardi; José A. Mata; Eduardo Peris","Well-Defined Ir/Pd Complexes with a Triazolyl-diylidene Bridge as Catalysts for Multiple Tandem Reactions","Journal of the American Chemical Society","2009","131","","14531","14537","10.1021/ja906028g","","x-ray","0.71073","MoKα","","0.0628","0.0485","","","0.1346","0.1442","","","","","","1.039","","","","has coordinates,has disorder","264764","2021-05-03","08:11:06",""
"4105118","7.328","","6.743","","10.816","","90","","90","","90","","534.448","","120","2","120","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C3 H Ce O6 -","- C3 H Ce O6 -","- C12 H4 Ce4 O24 -","4","1","","Jin Chong Tan; Joshua D. Furman; Anthony K. Cheetham","Relating Mechanical Properties and Chemical Bonding in an Inorganic-Organic Framework Material: A Single-Crystal Nanoindentation Study","Journal of the American Chemical Society","2009","131","","14252","14254","10.1021/ja9060307","","","0.71073","MoKα","","0.0174","0.0171","","","0.0432","0.0444","","","","","","1.079","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105119","16.33","0.003","16.55","0.003","27.623","0.005","90","","105.873","0.003","90","","7181","2","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C84.5 H102 Ge2 O4 -","- C84.5 H102 Ge2 O4 -","- C338 H408 Ge8 O16 -","4","1","","Xinping Wang; Yang Peng; Marilyn M. Olmstead; James C. Fettinger; Philip P. Power","An Unsymmetric Oxo/Imido-Bridged Germanium-Centered Singlet Diradicaloid","Journal of the American Chemical Society","2009","131","","14164","14165","10.1021/ja906053y","","","0.71073","MoKα","","0.1158","0.0924","","","0.2316","0.242","","","","","","1.099","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105120","11.878","0.005","12.684","0.005","20.133","0.008","95.349","0.006","96.099","0.006","95.729","0.006","2984","2","90","2","90","2","","","","","","","","5","P -1","-P 1","2","D*Ge(O)(NPh)GeD*.0.5toluene","","","- C70.5 H85 Ge2 N O -","- C70.5 H85 Ge2 N O -","- C141 H170 Ge4 N2 O2 -","2","1","","Xinping Wang; Yang Peng; Marilyn M. Olmstead; James C. Fettinger; Philip P. Power","An Unsymmetric Oxo/Imido-Bridged Germanium-Centered Singlet Diradicaloid","Journal of the American Chemical Society","2009","131","","14164","14165","10.1021/ja906053y","","","0.71073","MoKα","","0.1777","0.1091","","","0.2718","0.2956","","","","","","1.017","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105121","37.31","0.007","22.077","0.004","13.469","0.003","90","","96.178","0.003","90","","11030","4","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Fe2(O)(H2O)2BPG2DEV](ClO4)2","","","- C41 H44 Cl2 Fe2 N6 O21 -","- C41 H44 Cl2 Fe2 N6 O21.0004 -","- C328 H352 Cl16 Fe16 N48 O168.003 -","8","1","","Simone Friedle; Jeremy J. Kodanko; Anna J. Morys; Takahiro Hayashi; Pierre Moënne-Loccoz; Stephen J. Lippard","Modeling the Syn Disposition of Nitrogen Donors in Non-Heme Diiron Enzymes. Synthesis, Characterization, and Hydrogen Peroxide Reactivity of Diiron(III) Complexes with the Syn N-Donor Ligand H2BPG2DEV","Journal of the American Chemical Society","2009","131","","14508","14520","10.1021/ja906137y","","","0.71073","MoKα","","0.1199","0.0674","","","0.172","0.2031","","","","","","1.028","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105122","33.486","0.011","17.521","0.006","38.95","0.013","90","","90","","90","","22852","13","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","[Fe2(O)(O2CAriPrO)BPG2DEV](ClO4)","","","- C55.5 H59.44 Cl2.56 Fe2 N6 O16.97 -","- C55.5 H59.443 Cl2.557 Fe2 N6 O16.9715 -","- C888 H951.088 Cl40.912 Fe32 N96 O271.544 -","16","2","","Simone Friedle; Jeremy J. Kodanko; Anna J. Morys; Takahiro Hayashi; Pierre Moënne-Loccoz; Stephen J. Lippard","Modeling the Syn Disposition of Nitrogen Donors in Non-Heme Diiron Enzymes. Synthesis, Characterization, and Hydrogen Peroxide Reactivity of Diiron(III) Complexes with the Syn N-Donor Ligand H2BPG2DEV","Journal of the American Chemical Society","2009","131","","14508","14520","10.1021/ja906137y","","","0.71073","MoKα","","0.0993","0.0702","","","0.1817","0.2052","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105123","29.39","0.02","19.541","0.013","16.328","0.011","90","","103.023","0.012","90","","9136","11","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Fe2(O)(CO3)BPG2DEV]","","","- C46 H54 Fe2 N6 O16 -","- C46 H54 Fe2 N6 O16 -","- C368 H432 Fe16 N48 O128 -","8","1","","Simone Friedle; Jeremy J. Kodanko; Anna J. Morys; Takahiro Hayashi; Pierre Moënne-Loccoz; Stephen J. Lippard","Modeling the Syn Disposition of Nitrogen Donors in Non-Heme Diiron Enzymes. Synthesis, Characterization, and Hydrogen Peroxide Reactivity of Diiron(III) Complexes with the Syn N-Donor Ligand H2BPG2DEV","Journal of the American Chemical Society","2009","131","","14508","14520","10.1021/ja906137y","","","0.71073","MoKα","","0.0902","0.0621","","","0.1411","0.1533","","","","","","1.081","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105124","12.9471","0.0005","10.05","0.0004","14.9118","0.0006","90","","101.843","0.0004","90","","1898.99","0.13","103","2","103","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H36 O2 Si -","- C19 H36 O2 Si -","- C76 H144 O8 Si4 -","4","1","","Michel Prévost; K. A. Woerpel","Insertions of Silylenes into Vinyl Epoxides: Diastereoselective Synthesis of Functionalized, Optically Active trans-Dioxasilacyclooctenes","Journal of the American Chemical Society","2009","131","","14182","14183","10.1021/ja906204a","","","0.71073","MoKα","","0.0335","0.0304","","","0.0832","0.0861","","","","","","1.049","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105125","8.2287","0.0006","18.2598","0.0013","20.6213","0.0015","103.53","0.0009","90.5933","0.0009","102.354","0.0009","2936.7","0.4","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H48 O7 Si -","- C28 H48 O7 Si -","- C112 H192 O28 Si4 -","4","2","","Michel Prévost; K. A. Woerpel","Insertions of Silylenes into Vinyl Epoxides: Diastereoselective Synthesis of Functionalized, Optically Active trans-Dioxasilacyclooctenes","Journal of the American Chemical Society","2009","131","","14182","14183","10.1021/ja906204a","","","0.71073","MoKα","","0.0522","0.04","","","0.0991","0.1058","","","","","","1.022","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4105126","5.0947","0.0009","22.762","0.004","24.163","0.004","90","","90","","90","","2802.1","0.8","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H33 N O10 -","- C28 H33 N O10 -","- C112 H132 N4 O40 -","4","1","","Marlin Penner; Vivek Rauniyar; Ludwig T. Kaspar; Dennis G. Hall","Catalytic Asymmetric Synthesis of Palmerolide A via Organoboron Methodology","Journal of the American Chemical Society","2009","131","","14216","14217","10.1021/ja906429c","","","0.71073","MoKα","","0.1255","0.0591","","","0.0943","0.1124","","","","","","1.03","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105127","14.9202","0.0016","14.1025","0.0015","15.2798","0.0016","90","","101.111","0.001","90","","3154.8","0.6","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H36 B N -","- C37 H36 B N -","- C148 H144 B4 N4 -","4","1","","Chul Baik; Zachary M. Hudson; Hazem Amarne; Suning Wang","Enhancing the Photochemical Stability of N,C-Chelate Boryl Compounds: C-C Bond Formation versus C=C Bond cis,trans-Isomerization","Journal of the American Chemical Society","2009","131","","14549","14559","10.1021/ja906430s","","","0.71073","MoKα","","0.0848","0.0552","","","0.1503","0.164","","","","","","1.103","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105128","14.8343","0.0003","13.9749","0.0003","15.5452","0.0003","90","","102.543","0.002","90","","3145.73","0.11","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H41 B N -","- C40 H41 B N -","- C160 H164 B4 N4 -","4","1","","Chul Baik; Zachary M. Hudson; Hazem Amarne; Suning Wang","Enhancing the Photochemical Stability of N,C-Chelate Boryl Compounds: C-C Bond Formation versus C=C Bond cis,trans-Isomerization","Journal of the American Chemical Society","2009","131","","14549","14559","10.1021/ja906430s","","","0.71073","MoKα","","0.0993","0.0608","","","0.1546","0.1808","","","","","","1.038","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105129","18.4312","0.0011","11.1173","0.0008","15.6979","0.0009","90","","112.743","0.004","90","","2966.5","0.3","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H35 B Cl2 N -","- C35 H35 B Cl2 N -","- C140 H140 B4 Cl8 N4 -","4","1","","Chul Baik; Zachary M. Hudson; Hazem Amarne; Suning Wang","Enhancing the Photochemical Stability of N,C-Chelate Boryl Compounds: C-C Bond Formation versus C=C Bond cis,trans-Isomerization","Journal of the American Chemical Society","2009","131","","14549","14559","10.1021/ja906430s","","","0.71073","MoKα","","0.1758","0.0604","","","0.1073","0.148","","","","","","0.959","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105130","16.582","0.004","17.149","0.004","19.939","0.006","79.126","0.004","65.471","0.003","64.616","0.003","4660","2","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C99 H96 B3 N3 -","- C99 H96 B3 N3 -","- C198 H192 B6 N6 -","2","1","","Chul Baik; Zachary M. Hudson; Hazem Amarne; Suning Wang","Enhancing the Photochemical Stability of N,C-Chelate Boryl Compounds: C-C Bond Formation versus C=C Bond cis,trans-Isomerization","Journal of the American Chemical Society","2009","131","","14549","14559","10.1021/ja906430s","","","0.71073","MoKα","","0.1993","0.0672","","","0.1325","0.1619","","","","","","0.786","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105131","7.344","0.006","10.456","0.008","19.492","0.015","90","","90.422","0.009","90","","1497","2","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H30 I2 O8 -","- C32.32 H30 I2 O8 -","- C64.64 H60 I4 O16 -","2","1","","Hidehiro Suematsu; Tsutomu Katsuki","Iridium(III) Catalyzed Diastereo- and Enantioselective C-H Bond Functionalization","Journal of the American Chemical Society","2009","131","","14218","14219","10.1021/ja9065267","","","0.71073","MoKα","","0.1071","0.1053","","","0.2618","0.263","","","","","","1.244","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105132","27.695","0.008","15.054","0.005","32.739","0.011","90","0.0014","102.696","0.0016","90","0.0014","13316","7","120","2","120","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C78 H84 O6 Si3 -","- C78 H84 O6 Si3 -","- C624 H672 O48 Si24 -","8","2","","Shunsuke Furukawa; Junji Kobayashi; Takayuki Kawashima","Development of a Sila-Friedel-Crafts Reaction and Its Application to the Synthesis of Dibenzosilole Derivatives","Journal of the American Chemical Society","2009","131","","14192","14193","10.1021/ja906566r","","","0.7107","MoKα","","0.1961","0.1489","","","0.3862","0.4551","","","","","","1.58","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105133","18.846","0.0006","17.5996","0.0005","27.546","0.0008","90","","90","","90","","9136.5","0.5","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C47 H72 Ir N O P2 Si -","- C47 H72 Ir N O P2 Si -","- C376 H576 Ir8 N8 O8 P16 Si8 -","8","1","","Erin Morgan; Darren F. MacLean; Robert McDonald; Laura Turculet","Rhodium and Iridium Amido Complexes Supported by Silyl Pincer Ligation: Ammonia N-H Bond Activation by a [PSiP]Ir Complex","Journal of the American Chemical Society","2009","131","","14234","14236","10.1021/ja906646v","","","0.71073","MoKα","","0.0423","0.0236","","","0.0523","0.0618","","","","","","1.088","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105134","11.962","0.0006","18.534","0.0009","18.73","0.001","90","","103.205","0.0006","90","","4042.7","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H64 P3 Rh Si -","- C40 H64 P3 Rh Si -","- C160 H256 P12 Rh4 Si4 -","4","1","","Erin Morgan; Darren F. MacLean; Robert McDonald; Laura Turculet","Rhodium and Iridium Amido Complexes Supported by Silyl Pincer Ligation: Ammonia N-H Bond Activation by a [PSiP]Ir Complex","Journal of the American Chemical Society","2009","131","","14234","14236","10.1021/ja906646v","","","0.71073","MoKα","","0.0318","0.0264","","","0.0659","0.0693","","","","","","1.038","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105135","12.0501","0.0006","19.8548","0.001","17.779","0.0009","90","","91.6341","0.0007","90","","4251.9","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H66 Ir N P2 Si -","- C45 H66 Ir N P2 Si -","- C180 H264 Ir4 N4 P8 Si4 -","4","1","","Erin Morgan; Darren F. MacLean; Robert McDonald; Laura Turculet","Rhodium and Iridium Amido Complexes Supported by Silyl Pincer Ligation: Ammonia N-H Bond Activation by a [PSiP]Ir Complex","Journal of the American Chemical Society","2009","131","","14234","14236","10.1021/ja906646v","","","0.71073","MoKα","","0.0369","0.0262","","","0.0572","0.061","","","","","","1.043","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105136","11.7712","0.0019","17.415","0.003","20.937","0.003","90","","105.739","0.002","90","","4131.1","1.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H62 N P2 Rh Si -","- C43 H62 N P2 Rh Si -","- C172 H248 N4 P8 Rh4 Si4 -","4","1","","Erin Morgan; Darren F. MacLean; Robert McDonald; Laura Turculet","Rhodium and Iridium Amido Complexes Supported by Silyl Pincer Ligation: Ammonia N-H Bond Activation by a [PSiP]Ir Complex","Journal of the American Chemical Society","2009","131","","14234","14236","10.1021/ja906646v","","","0.71073","MoKα","","0.111","0.0519","","","0.1021","0.1241","","","","","","1.009","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105137","11.403","","12.964","","18.047","","74.12","","89.69","","86.76","","2561.8","","213","","213","","","","","","","","","7","P 1","P 1","1","","","","- C132 H94 B2 Cu2 F8 Fe2 N10 -","- C132 H94 B2 Cu2 F8 Fe2 N10 -","- C132 H94 B2 Cu2 F8 Fe2 N10 -","1","1","","Shoko Kume; Kuniharu Nomoto; Tetsuro Kusamoto; Hiroshi Nishihara","Intramolecular Electron Arrangement with a Rotative Trigger","Journal of the American Chemical Society","2009","131","","14198","14199","10.1021/ja906684g","","","0.71073","MoKα","","","0.0527","","","","0.1493","","","","","","1.082","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105138","11.807","0.005","11.176","0.005","40.409","0.005","90","0.005","94.775","0.005","90","0.005","5314","3","213","","213","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C68 H51 B Cu F4 Fe N5 -","- C68 H51 B Cu F4 Fe N5 -","- C272 H204 B4 Cu4 F16 Fe4 N20 -","4","1","","Shoko Kume; Kuniharu Nomoto; Tetsuro Kusamoto; Hiroshi Nishihara","Intramolecular Electron Arrangement with a Rotative Trigger","Journal of the American Chemical Society","2009","131","","14198","14199","10.1021/ja906684g","","","0.71073","MoKα","","","0.072","","","","0.1952","","","","","","1.081","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105139","12.3398","0.0008","12.9936","0.0008","24.7548","0.0016","90","","90","","90","","3969.1","0.4","153","2","153","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C30 H39 Cl5 F Ga N2 P6 -","- C30 H39 Cl5 F Ga N2 P6 -","- C120 H156 Cl20 F4 Ga4 N8 P24 -","4","1","","Michael H. Holthausen; Jan J. Weigand","Preparation of the [(DippNP)~2~(P~4~)~2~]^2+^-Dication by the Reaction of [DippNPCl]2 and a Lewis Acid with P~4~","Journal of the American Chemical Society","2009","131","","14210","14211","10.1021/ja906878q","","","0.71073","MoKα","","0.0291","0.0251","","","0.0608","0.0626","","","","","","1.036","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105140","24.2241","0.0017","11.4374","0.0008","21.2238","0.0015","90","","115.093","0.001","90","","5325.3","0.6","153","2","153","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H34 Cl14 Ga4 N2 P10 -","- C24 H34 Cl14 Ga4 N2 P10 -","- C96 H136 Cl56 Ga16 N8 P40 -","4","0.5","","Michael H. Holthausen; Jan J. Weigand","Preparation of the [(DippNP)~2~(P~4~)~2~]^2+^-Dication by the Reaction of [DippNPCl]2 and a Lewis Acid with P~4~","Journal of the American Chemical Society","2009","131","","14210","14211","10.1021/ja906878q","","","0.71073","MoKα","","0.0441","0.0301","","","0.0691","0.0745","","","","","","1.022","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105141","57.185","0.003","57.185","0.003","57.185","0.003","90","","90","","90","","187002","17","150","2","150","2","","","","","","","","5","F 4 3 2","F 4 2 3","209","","","","- C23.04 H36.83 Fe7 Na5 O50.92 -","- C22 H14 Fe7 Na2 O45 -","- C2112 H1344 Fe672 Na192 O4320 -","96","1","","Zhi-Ming Zhang; Shuang Yao; Yang-Guang Li; Rodolphe Clérac; Ying Lu; Zhong-Min Su; En-Bo Wang","Protein-Sized Chiral Fe168 Cages with NbO-Type Topology","Journal of the American Chemical Society","2009","131","","14600","14601","10.1021/ja903776h","","","0.71073","MoKα","","0.0883","0.0616","","","0.143","0.1533","","","","","","0.96","","","","has coordinates,has disorder","289031","2024-01-11","08:35:58",""
"4105142","57.1261","0.0017","57.1261","0.0017","57.1261","0.0017","90","","90","","90","","186425","10","150","2","150","2","","","","","","","","5","F 4 3 2","F 4 2 3","209","","","","- C23.04 H36.83 Fe7 Na5 O50.92 -","- C22 H14 Fe7 Na2 O45.5 -","- C2112 H1344 Fe672 Na192 O4368 -","96","1","","Zhi-Ming Zhang; Shuang Yao; Yang-Guang Li; Rodolphe Clérac; Ying Lu; Zhong-Min Su; En-Bo Wang","Protein-Sized Chiral Fe168 Cages with NbO-Type Topology","Journal of the American Chemical Society","2009","131","","14600","14601","10.1021/ja903776h","","","0.71073","MoKα","","0.1018","0.0596","","","0.157","0.2018","","","","","","1.084","","","","has coordinates,has disorder","289031","2024-01-11","08:36:03",""
"4105143","8.6689","0.0013","10.3474","0.0014","10.8645","0.0016","76.576","0.007","67.489","0.007","76.621","0.007","864.6","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H55 Hf2 I N2 -","- C37.0018 H55.0054 Hf2 I0.9982 N2 -","- C37.0018 H55.0054 Hf2 I0.9982 N2 -","1","0.5","","Donald J. Knobloch; David Benito-Garagorri; Wesley H. Bernskoetter; Ivan Keresztes; Emil Lobkovsky; Hannah Toomey; Paul J. Chirik","Addition of Methyl Triflate to a Hafnocene Dinitrogen Complex: Stepwise N2 Methylation and Conversion to a Hafnocene Hydrazonato Compound","Journal of the American Chemical Society","2009","131","","14903","14912","10.1021/ja904436a","","","0.71073","MoKα","","0.0603","0.0452","","","0.1071","0.111","","","","","","1.082","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105144","13.4973","0.0009","13.4973","0.0009","13.3928","0.0008","90","","90","","90","","2439.9","0.3","150","1","150","1","","","","","","","","5","I 4/m","-I 4","87","","","","- C48 H57 Fe4 O0.5 Si4 -","- C48 H56 Fe4 O0.5 Si4 -","- C96 H112 Fe8 O Si8 -","2","0.125","","David E. Herbert; Joe B. Gilroy; Wing Yan Chan; Laurent Chabanne; Anne Staubitz; Alan J. Lough; Ian Manners","Redox-Active Metallomacrocycles and Cyclic Metallopolymers: Photocontrolled Ring-Opening Oligomerization and Polymerization of Silicon-Bridged [1]Ferrocenophanes Using Substitutionally-Labile Lewis Bases as Initiators","Journal of the American Chemical Society","2009","131","","14958","14968","10.1021/ja904928c","","","0.71073","MoKα","","0.0624","0.0474","","","0.1352","0.146","","","","","","1.084","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105145","12.9003","0.0003","15.3544","0.0004","15.9986","0.0003","69.935","0.013","89.91","0.014","69.945","0.013","2771.8","0.4","150","1","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H70 Fe5 Si5 -","- C60 H70 Fe5 Si5 -","- C120 H140 Fe10 Si10 -","2","1","","David E. Herbert; Joe B. Gilroy; Wing Yan Chan; Laurent Chabanne; Anne Staubitz; Alan J. Lough; Ian Manners","Redox-Active Metallomacrocycles and Cyclic Metallopolymers: Photocontrolled Ring-Opening Oligomerization and Polymerization of Silicon-Bridged [1]Ferrocenophanes Using Substitutionally-Labile Lewis Bases as Initiators","Journal of the American Chemical Society","2009","131","","14958","14968","10.1021/ja904928c","","","0.71073","MoKα","","0.081","0.0466","","","0.1072","0.1236","","","","","","1.03","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105146","9.9248","0.0014","9.9248","0.0014","67.014","0.013","90","","90","","90","","6601","1.8","150","1","150","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C72 H84 Fe6 Si6 -","- C72 H84 Fe6 Si6 -","- C288 H336 Fe24 Si24 -","4","0.5","","David E. Herbert; Joe B. Gilroy; Wing Yan Chan; Laurent Chabanne; Anne Staubitz; Alan J. Lough; Ian Manners","Redox-Active Metallomacrocycles and Cyclic Metallopolymers: Photocontrolled Ring-Opening Oligomerization and Polymerization of Silicon-Bridged [1]Ferrocenophanes Using Substitutionally-Labile Lewis Bases as Initiators","Journal of the American Chemical Society","2009","131","","14958","14968","10.1021/ja904928c","","","0.71073","MoKα","","0.1014","0.055","","","0.1045","0.1255","","","","","","1.069","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105147","13.3855","0.0003","13.7448","0.0002","27.3253","0.0007","94.058","0.0013","98.887","0.001","113.06","0.0012","4522.19","0.17","150","1","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C84 H98 Fe7 Si7 -","- C84 H98 Fe7 Si7 -","- C168 H196 Fe14 Si14 -","2","1","","David E. Herbert; Joe B. Gilroy; Wing Yan Chan; Laurent Chabanne; Anne Staubitz; Alan J. Lough; Ian Manners","Redox-Active Metallomacrocycles and Cyclic Metallopolymers: Photocontrolled Ring-Opening Oligomerization and Polymerization of Silicon-Bridged [1]Ferrocenophanes Using Substitutionally-Labile Lewis Bases as Initiators","Journal of the American Chemical Society","2009","131","","14958","14968","10.1021/ja904928c","","","0.71073","MoKα","","0.0774","0.0528","","","0.1438","0.1543","","","","","","1.069","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105148","10.653","0.009","12.153","0.009","13.824","0.012","90","","101.614","0.004","90","","1753","2","103.15","","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 O3 P S -","- C18 H27 O3 P S -","- C72 H108 O12 P4 S4 -","4","1","","Shingo Ito; Kagehiro Munakata; Akifumi Nakamura; Kyoko Nozaki","Copolymerization of Vinyl Acetate with Ethylene by Palladium/Alkylphosphine-Sulfonate Catalysts","Journal of the American Chemical Society","2009","131","","14606","14607","10.1021/ja9050839","","","0.7107","MoKα","","0.1114","0.092","","","0.1848","0.195","","","","","","1.208","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105149","13.59","0.003","16.051","0.004","16.89","0.004","90","","111.273","0.0011","90","","3433.2","1.4","103.15","","103","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 Cl6 N O3 P Pd S -","- C28 H40 Cl6 N O3 P Pd S -","- C112 H160 Cl24 N4 O12 P4 Pd4 S4 -","4","1","","Shingo Ito; Kagehiro Munakata; Akifumi Nakamura; Kyoko Nozaki","Copolymerization of Vinyl Acetate with Ethylene by Palladium/Alkylphosphine-Sulfonate Catalysts","Journal of the American Chemical Society","2009","131","","14606","14607","10.1021/ja9050839","","","0.7107","MoKα","","0.0335","0.0308","","","0.0721","0.0737","","","","","","1.08","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105150","14.071","0.003","14.362","0.003","17.44","0.004","90","","113.129","0.0008","90","","3241.1","1.2","103.15","","103","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C48 H78 Cl12 N2 O6 P2 Pd2 S2 -","- C48 H78 Cl12 N2 O6 P2 Pd2 S2 -","- C96 H156 Cl24 N4 O12 P4 Pd4 S4 -","2","0.5","","Shingo Ito; Kagehiro Munakata; Akifumi Nakamura; Kyoko Nozaki","Copolymerization of Vinyl Acetate with Ethylene by Palladium/Alkylphosphine-Sulfonate Catalysts","Journal of the American Chemical Society","2009","131","","14606","14607","10.1021/ja9050839","","","0.7107","MoKα","","0.0381","0.0329","","","0.0734","0.0766","","","","","","1.09","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105151","16.0272","0.0011","16.0272","0.0011","59.8917","0.0011","90","","90","","120","","13323.3","1.3","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C54 H90 Co3 N12 Na12 O57 -","- C54 H24 Co3 N12 Na12 O56.99 -","- C324 H144 Co18 N72 Na72 O341.94 -","6","0.166667","","Marie-Claire Dul; Emilio Pardo; Rodrigue Lescouëzec; Lise-Marie Chamoreau; Françoise Villain; Yves Journaux; Rafael Ruiz-García; Joan Cano; Miguel Julve; Francesc Lloret; Jorge Pasán; Catalina Ruiz-Pérez","Redox Switch-Off of the Ferromagnetic Coupling in a Mixed-Spin Tricobalt(II) Triple Mesocate","Journal of the American Chemical Society","2009","131","","14614","14615","10.1021/ja9052202","","x-ray","0.71073","Mokα","","0.161","0.1162","","","0.3119","0.3565","","","","","","1.039","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105152","5.72385","0.0001","14.0831","0.0003","14.9468","0.0003","90","","90","","90","","1204.85","0.04","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H12 N2 O4 -","- C12 H12 N2 O4 -","- C48 H48 N8 O16 -","4","1","","Tomoyuki Mashiko; Naoya Kumagai; Masakatsu Shibasaki","Managing Highly Coordinative Substrates in Asymmetric Catalysis: A Catalytic Asymmetric Amination with a Lanthanum-Based Ternary Catalyst","Journal of the American Chemical Society","2009","131","","14990","14999","10.1021/ja9052653","","","1.54187","CuKα","","","0.0341","","","","0.0962","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105153","10.23","0.002","14.66","0.003","15.92","0.003","90","","101.55","0.03","90","","2339.2","0.8","10","2","10","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","C23H29O5F3S","","- C23 H29 F3 O5 S -","- C23 F3 O5 S -","- C92 F12 O20 S4 -","4","1","","Jörg Hallmann; Wolfgang Morgenroth; Carsten Paulmann; Jav Davaasambuu; Qingyu Kong; Michael Wulff; Simone Techert","Time-Resolved X-ray Diffraction of the Photochromic α-Styrylpyrylium Trifluoromethanesulfonate Crystal Films Reveals Ultrafast Structural Switching","Journal of the American Chemical Society","2009","131","","15018","15025","10.1021/ja905484u","","","0.62","","","0.0436","0.0423","","","0.1103","0.1154","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105154","10.83","0.002","13.87","0.003","16.02","0.003","90","","105.82","0.03","90","","2315.3","0.9","293","2","10","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","C46H58O10F6S2","","- C46 H58 F6 O10 S2 -","- C46 F6 O10 S2 -","- C92 F12 O20 S4 -","2","0.5","","Jörg Hallmann; Wolfgang Morgenroth; Carsten Paulmann; Jav Davaasambuu; Qingyu Kong; Michael Wulff; Simone Techert","Time-Resolved X-ray Diffraction of the Photochromic α-Styrylpyrylium Trifluoromethanesulfonate Crystal Films Reveals Ultrafast Structural Switching","Journal of the American Chemical Society","2009","131","","15018","15025","10.1021/ja905484u","","","0.62","","","0.0495","0.0511","","","0.1414","0.136","","","","","","1.059","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105155","10.23","0.002","14.66","0.003","15.92","0.003","90","","102.9","0.3","90","","2327","3","360","2","360","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H29 F3 O5 S -","- C46 F6 O10 S2 -","- C184 F24 O40 S8 -","4","1","","Jörg Hallmann; Wolfgang Morgenroth; Carsten Paulmann; Jav Davaasambuu; Qingyu Kong; Michael Wulff; Simone Techert","Time-Resolved X-ray Diffraction of the Photochromic α-Styrylpyrylium Trifluoromethanesulfonate Crystal Films Reveals Ultrafast Structural Switching","Journal of the American Chemical Society","2009","131","","15018","15025","10.1021/ja905484u","","","0.71073","synchrotronradiation","","0.0898","0.0823","","","0.1703","0.1754","","","","","","1.142","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105156","8.235","0.002","26.588","0.006","15.749","0.004","90","","101.539","0.0011","90","","3378.6","1.4","113.1","","113.1","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H47 B N7 O2 Rh S -","- C31 H47 B N7 O2 Rh S -","- C124 H188 B4 N28 O8 Rh4 S4 -","4","1","","Yoshiyuki Misumi; Hidetake Seino; Yasushi Mizobe","Heterolytic Cleavage of Hydrogen Molecule by Rhodium Thiolate Complexes That Catalyze Chemoselective Hydrogenation of Imines under Ambient Conditions","Journal of the American Chemical Society","2009","131","","14636","14637","10.1021/ja905835u","","","0.7107","MoKα","","","0.0341","","","","0.1145","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105157","5.6956","0.0008","11.8505","0.0017","22.719","0.003","90","","90","","90","","1533.4","0.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 O2 -","- C18 H22 O2 -","- C72 H88 O8 -","4","1","","En Zhang; Chun-An Fan; Yong-Qiang Tu; Fu-Min Zhang; Yan-Lin Song","Organocatalytic Asymmetric Vinylogous α-Ketol Rearrangement: Enantioselective Construction of Chiral All-Carbon Quaternary Stereocenters in Spirocyclic Diketones via Semipinacol-Type 1,2-Carbon Migration","Journal of the American Chemical Society","2009","131","","14626","14627","10.1021/ja906291n","","","0.71073","MoKα","","0.0553","0.0411","","","0.0918","0.0987","","","","","","1.043","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105158","11.662","0.006","6.404","0.003","21.73","0.01","90","","97.407","0.008","90","","1609.3","1.3","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H21 Br O2 -","- C18 H21 Br O2 -","- C72 H84 Br4 O8 -","4","2","","En Zhang; Chun-An Fan; Yong-Qiang Tu; Fu-Min Zhang; Yan-Lin Song","Organocatalytic Asymmetric Vinylogous α-Ketol Rearrangement: Enantioselective Construction of Chiral All-Carbon Quaternary Stereocenters in Spirocyclic Diketones via Semipinacol-Type 1,2-Carbon Migration","Journal of the American Chemical Society","2009","131","","14626","14627","10.1021/ja906291n","","","0.71073","MoKα","","0.1107","0.0483","","","0.0922","0.1102","","","","","","0.976","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105159","8.1452","0.0006","17.3379","0.0012","24.364","0.0017","90","","90","","90","","3440.7","0.4","125","2","125","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H19 Cl N2 O3 -","- C18 H19 Cl N2 O3 -","- C144 H152 Cl8 N16 O24 -","8","2","","S. Corey Valdez; James L. Leighton","Tandem Asymmetric Aza-Darzens/Ring-Opening Reactions: Dual Functionality from the Silane Lewis Acid","Journal of the American Chemical Society","2009","131","","14638","14639","10.1021/ja9066354","","","0.71073","MoKα","","0.0723","0.054","","","0.1455","0.1595","","","","","","1.044","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105160","5.7656","0.0004","8.9612","0.0006","29.955","0.002","90","","90","","90","","1547.68","0.18","125","2","125","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 N2 O3 -","- C18 H18 N2 O3 -","- C72 H72 N8 O12 -","4","1","","S. Corey Valdez; James L. Leighton","Tandem Asymmetric Aza-Darzens/Ring-Opening Reactions: Dual Functionality from the Silane Lewis Acid","Journal of the American Chemical Society","2009","131","","14638","14639","10.1021/ja9066354","","","0.71073","MoKα","","0.0389","0.0355","","","0.1006","0.1039","","","","","","1.032","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105161","13.6331","0.0009","11.0404","0.0007","22.001","0.0015","90","","102.501","0.001","90","","3233","0.4","170","2","170","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C33.5 H42 Br N3 O3 -","- C26 H24 Br N3 O3 -","- C104 H96 Br4 N12 O12 -","4","2","","S. Corey Valdez; James L. Leighton","Tandem Asymmetric Aza-Darzens/Ring-Opening Reactions: Dual Functionality from the Silane Lewis Acid","Journal of the American Chemical Society","2009","131","","14638","14639","10.1021/ja9066354","","","0.71073","MoKα","","0.079","0.0478","","","0.1242","0.1355","","","","","","0.845","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105162","15.742","0.003","26.645","0.005","17.681","0.004","90","","103.16","0.03","90","","7221","3","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C41 H40.5 N1.5 O7 Si -","- C41 H40.5 N1.5 O7 Si -","- C328 H324 N12 O56 Si8 -","8","4","","K. C. Nicolaou; Jochen Becker; Yee Hwee Lim; Alexandre Lemire; Thomas Neubauer; Ana Montero","Total Synthesis and Biological Evaluation of (+)- and (-)-Bisanthraquinone Antibiotic BE-43472B and Related Compounds","Journal of the American Chemical Society","2009","131","","14812","14826","10.1021/ja9073694","","","0.71073","MoKα","","0.1624","0.0925","","","0.2073","0.2501","","","","","","0.985","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105163","11.151","0.002","27.735","0.006","9.5831","0.0019","90","","109.99","0.03","90","","2785.2","1.1","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 O10 -","- C34 H34 O10 -","- C136 H136 O40 -","4","1","","K. C. Nicolaou; Jochen Becker; Yee Hwee Lim; Alexandre Lemire; Thomas Neubauer; Ana Montero","Total Synthesis and Biological Evaluation of (+)- and (-)-Bisanthraquinone Antibiotic BE-43472B and Related Compounds","Journal of the American Chemical Society","2009","131","","14812","14826","10.1021/ja9073694","","","0.71073","MoKα","","0.1025","0.0575","","","0.1309","0.1534","","","","","","1.008","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105164","12.657","0.003","14.294","0.003","28.298","0.006","90","","90","","90","","5120","2","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H22 O9 -","- C32 H22 O9 -","- C256 H176 O72 -","8","2","","K. C. Nicolaou; Jochen Becker; Yee Hwee Lim; Alexandre Lemire; Thomas Neubauer; Ana Montero","Total Synthesis and Biological Evaluation of (+)- and (-)-Bisanthraquinone Antibiotic BE-43472B and Related Compounds","Journal of the American Chemical Society","2009","131","","14812","14826","10.1021/ja9073694","","","0.71073","MoKα","","0.1375","0.0904","","","0.1804","0.2038","","","","","","1.106","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105165","12.608","0.003","14.246","0.003","28.197","0.006","90","","90","","90","","5064.6","1.9","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H22 O9 -","- C32 H22 O9 -","- C256 H176 O72 -","8","2","","K. C. Nicolaou; Jochen Becker; Yee Hwee Lim; Alexandre Lemire; Thomas Neubauer; Ana Montero","Total Synthesis and Biological Evaluation of (+)- and (-)-Bisanthraquinone Antibiotic BE-43472B and Related Compounds","Journal of the American Chemical Society","2009","131","","14812","14826","10.1021/ja9073694","","","0.71073","MoKα","","0.1161","0.0769","","","0.1444","0.1604","","","","","","1.114","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4105166","13.416","0.003","13.731","0.003","15.84","0.003","66.45","0.007","81.445","0.008","88.26","0.008","2643.8","1","153","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C50.54 H50 F12 N10 O4 P2 Ru2 -","- C50.518 H50 F12 N10 O4 P2 Ru2 -","- C101.036 H100 F24 N20 O8 P4 Ru4 -","2","1","","Fernando Bozoglian; Sophie Romain; Mehmed Z. Ertem; Tanya K. Todorova; Cristina Sens; Joaquim Mola; Montserrat Rodríguez; Isabel Romero; Jordi Benet-Buchholz; Xavier Fontrodona; Christopher J. Cramer; Laura Gagliardi; Antoni Llobet","The Ru-Hbpp Water Oxidation Catalyst","Journal of the American Chemical Society","2009","131","","15176","15187","10.1021/ja9036127","","","0.71073","MoKα","","0.0562","0.0437","","","0.119","0.1262","","","","","","1.052","","","","has coordinates,has disorder","288243","2023-12-12","09:57:14",""
"4105167","9.327","0.003","15.377","0.005","35.421","0.011","90","","90","","90","","5080","3","300","2","300","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C44 H31 F16 N10 O3 P2 Ru2 S -","- C44 H31 F16 N10 O3 P2 Ru2 S -","- C176 H124 F64 N40 O12 P8 Ru8 S4 -","4","0.5","","Fernando Bozoglian; Sophie Romain; Mehmed Z. Ertem; Tanya K. Todorova; Cristina Sens; Joaquim Mola; Montserrat Rodríguez; Isabel Romero; Jordi Benet-Buchholz; Xavier Fontrodona; Christopher J. Cramer; Laura Gagliardi; Antoni Llobet","The Ru-Hbpp Water Oxidation Catalyst","Journal of the American Chemical Society","2009","131","","15176","15187","10.1021/ja9036127","","","0.71073","MoKα","","0.2306","0.1037","","","0.241","0.3152","","","","","","1.041","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105168","12.973","0.005","16.288","0.006","25.794","0.01","90","","90","","90","","5450","4","573","2","300","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H36 Cl4 N10 O14 Ru2 -","- C46 H36 Cl4 N10 O14 Ru2 -","- C184 H144 Cl16 N40 O56 Ru8 -","4","1","","Fernando Bozoglian; Sophie Romain; Mehmed Z. Ertem; Tanya K. Todorova; Cristina Sens; Joaquim Mola; Montserrat Rodríguez; Isabel Romero; Jordi Benet-Buchholz; Xavier Fontrodona; Christopher J. Cramer; Laura Gagliardi; Antoni Llobet","The Ru-Hbpp Water Oxidation Catalyst","Journal of the American Chemical Society","2009","131","","15176","15187","10.1021/ja9036127","","","0.71073","MoKα","","0.0928","0.0563","","","0.1444","0.1637","","","","","","0.987","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105169","24.3673","0.0009","24.3673","0.0009","10.6844","0.0013","90","","90","","120","","5494.1","0.7","293","2","293","2","","","","","","","","4","P 65","P 65","170","Boc-D-Pro-Aib-Leu-Aib-Val-OMe","t-Butyloxycarbonyl-D-prolyl-alpha-aminoisobutyryl-leucyl -alpha-aminoisobutyryl-valyl-methyl ester","","- C30 H53 N5 O8 -","- C30 H53 N5 O8 -","- C180 H318 N30 O48 -","6","1","","Upadhyayula S. Raghavender; Subrayashastry Aravinda; Narayanaswamy Shamala; Rajkishor Rai; Padmanabhan Balaram","Characterization of Water Wires inside Hydrophobic Tubular Peptide Structures","Journal of the American Chemical Society","2009","131","","15130","15132","10.1021/ja9038906","","","0.71073","MoKα","","0.2226","0.0671","","","0.1446","0.2053","","","","","","0.932","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105170","24.292","0.0013","24.292","0.0013","10.4838","0.0011","90","","90","","120","","5357.7","0.7","293","2","293","2","","","","","","","","4","P 65","P 65","170","Boc-D-Pro-Aib-Val-Aib-Val-OMe","t-Butyloxycarbonyl-D-prolyl-alpha-aminoisobutyryl-valyl -alpha-aminoisobutyryl-valyl-methyl ester","","- C29 H51 N5 O9 -","- C29 H51 N5 O9 -","- C174 H306 N30 O54 -","6","1","","Upadhyayula S. Raghavender; Subrayashastry Aravinda; Narayanaswamy Shamala; Rajkishor Rai; Padmanabhan Balaram","Characterization of Water Wires inside Hydrophobic Tubular Peptide Structures","Journal of the American Chemical Society","2009","131","","15130","15132","10.1021/ja9038906","","","0.71073","MoKα","","0.0715","0.0554","","","0.1546","0.1765","","","","","","0.88","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105171","24.3161","0.0003","24.3161","0.0003","10.4805","0.0001","90","","90","","120","","5366.62","0.11","293","2","293","2","","","","","","","","4","P 65","P 65","170","Boc-D-Pro-Aib-Val-Aib-Val-OMe","t-Butyloxycarbonyl-D-prolyl-alpha-aminoisobutyryl-valyl -alpha-aminoisobutyryl-valyl-methyl ester","","- C29 H51 N5 O8.17 -","- C29 H51 N5 O8.17 -","- C174 H306 N30 O49.02 -","6","1","","Upadhyayula S. Raghavender; Subrayashastry Aravinda; Narayanaswamy Shamala; Rajkishor Rai; Padmanabhan Balaram","Characterization of Water Wires inside Hydrophobic Tubular Peptide Structures","Journal of the American Chemical Society","2009","131","","15130","15132","10.1021/ja9038906","","","1.54178","CuKα","","0.0637","0.0617","","","0.1844","0.1855","","","","","","1.039","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105172","16.996","0.005","12.515","0.005","16.344","0.005","90","0.005","100.107","0.005","90","0.005","3423","2","297","2","297","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C19 H20 N2 O S -","- C19 H20 N2 O S -","- C152 H160 N16 O8 S8 -","8","2","","Nan Li; Xiao-Hua Chen; Jin Song; Shi-Wei Luo; Wu Fan; Liu-Zhu Gong","Highly Enantioselective Organocatalytic Biginelli and Biginelli-Like Condensations: Reversal of the Stereochemistry by Tuning the 3,3'-Disubstituents of Phosphoric Acids","Journal of the American Chemical Society","2009","131","","15301","15310","10.1021/ja905320q","","","1.54184","CuKα","","0.0436","0.0401","","","0.0741","0.0756","","","","","","0.999","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105173","12.782","0.005","11.75","0.005","13.392","0.005","90","0.005","98.644","0.005","90","0.005","1988.5","1.4","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H21 Br N2 S -","- C20 H21 Br N2 S -","- C80 H84 Br4 N8 S4 -","4","2","","Nan Li; Xiao-Hua Chen; Jin Song; Shi-Wei Luo; Wu Fan; Liu-Zhu Gong","Highly Enantioselective Organocatalytic Biginelli and Biginelli-Like Condensations: Reversal of the Stereochemistry by Tuning the 3,3'-Disubstituents of Phosphoric Acids","Journal of the American Chemical Society","2009","131","","15301","15310","10.1021/ja905320q","","","1.54184","CuKα","","0.0593","0.0353","","","0.0624","0.0676","","","","","","1.006","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105174","8.328","0.002","10.116","0.003","7.2451","0.0019","90","","91.338","0.004","90","","610.2","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H4 Ba O6 -","- C4 H4 Ba O6 -","- C16 H16 Ba4 O24 -","4","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0341","0.0326","","","0.0819","0.0831","","","","","","1.074","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105175","10.8268","0.0007","9.9887","0.0007","8.525","0.0006","90","","126.588","0.001","90","","740.27","0.09","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H6 Ba O7 -","- C4 H6 Ba O7 -","- C16 H24 Ba4 O28 -","4","0.5","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0216","0.0214","","","0.0508","0.0508","","","","","","1.045","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105176","17.593","0.006","7.906","0.003","9.462","0.003","90","","121.066","0.005","90","","1127.3","0.7","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 Ca O6 -","- C4 H4 Ca O6 -","- C32 H32 Ca8 O48 -","8","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.041","0.0344","","","0.0822","0.0872","","","","","","1.061","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105177","6.2584","0.0015","8.251","0.002","10.448","0.003","94.887","0.006","105.914","0.006","107.662","0.005","486","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H12 Ca O10 -","- C4 H12 Ca O10 -","- C8 H24 Ca2 O20 -","2","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0746","0.0517","","","0.1211","0.1284","","","","","","1.015","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105178","7.6418","0.001","9.9656","0.0013","7.2395","0.0009","90","","90","","90","","551.33","0.12","298","2","298","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C4 H4 Ca O6 -","- C4 H4 Ca O6 -","- C16 H16 Ca4 O24 -","4","0.5","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0477","0.0468","","","0.1201","0.1213","","","","","","1.063","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105179","6.4031","0.0006","8.4315","0.0008","10.4933","0.001","95.196","0.002","106.402","0.002","107.052","0.002","510.2","0.08","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H12 O10 Sr -","- C4 H12 O10 Sr -","- C8 H24 O20 Sr2 -","2","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0384","0.0302","","","0.068","0.0705","","","","","","1.03","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105180","6.482","0.0007","7.977","0.0008","16.6234","0.0017","90","","95.501","0.002","90","","855.59","0.15","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H8 Ba O8 -","- C4 H8 Ba O8 -","- C16 H32 Ba4 O32 -","4","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0419","0.0336","","","0.085","0.0904","","","","","","1.096","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105181","18.7973","0.0016","5.1127","0.0004","18.5512","0.0016","90","","104.305","0.002","90","","1727.6","0.2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H9 Ba O8.5 -","- C4 H9 Ba O8.5 -","- C32 H72 Ba8 O68 -","8","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0588","0.0375","","","0.0678","0.072","","","","","","1.037","","","","has coordinates","271679","2022-01-02","08:39:52",""
"4105182","6.6143","0.0005","7.1191","0.0005","7.8433","0.0006","90","","98.334","0.002","90","","365.42","0.05","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C4 H6 O7 Sr -","- C4 H6 O7 Sr -","- C8 H12 O14 Sr2 -","2","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.057","0.0554","","","0.137","0.1392","","","","","","1.069","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105183","18.306","0.003","8.0984","0.0013","9.6058","0.0015","90","","121.334","0.003","90","","1216.4","0.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 O6 Sr -","- C4 H4 O6 Sr -","- C32 H32 O48 Sr8 -","8","1","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0786","0.0455","","","0.094","0.1081","","","","","","1.045","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105184","7.8865","0.001","10.0448","0.001","7.5186","0.0008","90","","90","","90","","595.61","0.12","298","2","298","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C4 H4 O6 Sr -","- C4 H4 O6 Sr -","- C16 H16 O24 Sr4 -","4","0.5","","Leah N. Appelhans; Monica Kosa; A. V. Radha; Petra Simoncic; Alexandra Navrotsky; Michele Parrinello; Anthony K. Cheetham","Phase Selection and Energetics in Chiral Alkaline Earth Tartrates and Their Racemic and Meso Analogues: Synthetic, Structural, Computational, and Calorimetric Studies","Journal of the American Chemical Society","2009","131","","15375","15386","10.1021/ja905690t","","","0.71073","MoKα","","0.0274","0.0265","","","0.0677","0.0683","","","","","","1.087","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105185","13.8313","0.0007","14.4109","0.0007","22.1159","0.001","90","","91.609","0.001","90","","4406.4","0.4","80","2","80","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(Ar[tBu]N)3Mo(N=c(NMe2)(SPh))","","","- C45 H65 Mo N5 S -","- C45 H65 Mo N5 S -","- C180 H260 Mo4 N20 S4 -","4","1","","Meaghan E. Germain; Manuel Temprado; Annie Castonguay; Olga P. Kryatova; Elena V. Rybak-Akimova; John J. Curley; Arjun Mendiratta; Yi-Chou Tsai; Christopher C. Cummins; Rajeev Prabhakar; James E. McDonough; Carl D. Hoff","Coordination-Mode Control of Bound Nitrile Radical Complex Reactivity: Intercepting End-on Nitrile-Mo(III) Radicals at Low Temperature","Journal of the American Chemical Society","2009","131","","15412","15423","10.1021/ja905849a","","","0.71073","MoKα","","0.0448","0.0356","","","0.0878","0.0936","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105186","21.7964","0.0002","13.1712","0.0002","25.5387","0.0003","90","","113.759","0.0005","90","","6710.37","0.15","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H70 B F26 P2 Rh -","- C62 H70 B F26 P2 Rh -","- C248 H280 B4 F104 P8 Rh4 -","4","1","","Thomas M. Douglas; Adrian B. Chaplin; Andrew S. Weller; Xinzheng Yang; Michael B. Hall","Monomeric and Oligomeric Amine-Borane σ-Complexes of Rhodium. Intermediates in the Catalytic Dehydrogenation of Amine-Boranes","Journal of the American Chemical Society","2009","131","","15440","15456","10.1021/ja906070r","","","0.71073","MoKα","","0.1291","0.0906","","","0.2499","0.2825","","","","","","1.023","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105187","50.6131","0.0004","19.6787","0.0002","14.3994","0.0001","90","","90","","90","","14341.8","0.2","150","2","150","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C60 H84 B3 F24 N2 P2 Rh -","- C60 H84 B3 F24 N2 P2 Rh -","- C480 H672 B24 F192 N16 P16 Rh8 -","8","2","","Thomas M. Douglas; Adrian B. Chaplin; Andrew S. Weller; Xinzheng Yang; Michael B. Hall","Monomeric and Oligomeric Amine-Borane σ-Complexes of Rhodium. Intermediates in the Catalytic Dehydrogenation of Amine-Boranes","Journal of the American Chemical Society","2009","131","","15440","15456","10.1021/ja906070r","","","0.71073","MoKα","","0.0718","0.0563","","","0.1357","0.1465","","","","","","1.076","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105188","11.5072","0.0006","16.0988","0.0008","17.1281","0.0008","76.541","0.003","72.712","0.003","77.066","0.004","2905.3","0.3","153","2","153","2","","","","","","","","5","P 1","P 1","1","","","","- C120 H85 F36 N12 O18.5 -","- C120 H84 F22.8 N12 O18.5 -","- C120 H84 F22.8 N12 O18.5 -","1","1","","Sylvain Koeller; Joji Kadota; Alain Deffieux; Frédéric Peruch; Stéphane Massip; Jean-Michel Léger; Jean-Pierre Desvergne; Brigitte Bibal","Ring-Opening Polymerization of l-Lactide Efficiently Triggered by an Amido-Indole. X-ray Structure of a Complex betweenl-Lactide and the Hydrogen-Bonding Organocatalyst","Journal of the American Chemical Society","2009","131","","15088","15089","10.1021/ja906119t","","","1.5418","CuKα","","0.2294","0.1435","","","0.37","0.4685","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105189","6.0401","0.0006","16.3369","0.0017","16.3744","0.0017","62.3777","0.0013","88.881","0.0014","84.8132","0.0014","1425.3","0.3","148","2","148","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H26 O2 -","- C15 H26 O2 -","- C60 H104 O8 -","4","2","","Matthew S. Dowling; Christopher D. Vanderwal","Ring-Closing Metathesis of Allylsilanes/Electrophilic Desilylation To Prepareexo-Methylidenecycloalkanes. Short Syntheses of Teucladiol and Poitediol","Journal of the American Chemical Society","2009","131","","15090","15091","10.1021/ja906241w","","","0.71073","MoKα","","0.0749","0.0472","","","0.103","0.1145","","","","","","1.037","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4105190","11.2195","0.0008","33.928","0.002","16.4312","0.0011","90","","107.115","0.005","90","","5977.6","0.7","248","2","248","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C66.5 H14 Cl F30 O4.5 S2 -","- C66.5 H13 Cl F30 O4.5 S1.999 -","- C266 H52 Cl4 F120 O18 S7.996 -","4","1","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Aromatic Expanded Isophlorins: Stable 30π Annulene Analogues with Diverse Structural Features","Journal of the American Chemical Society","2009","131","","15433","15439","10.1021/ja906290d","","","0.71073","MoKα","","0.1374","0.0973","","","0.2476","0.2821","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105191","24.7594","0.0008","7.9014","0.0003","21.7277","0.0006","90","","90","","90","","4250.7","0.2","173","2","173","2","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","","","- C66 H22 F30 O8 S3 -","- C66 H12 F30 O8.004 S3 -","- C132 H24 F60 O16.008 S6 -","2","0.25","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Aromatic Expanded Isophlorins: Stable 30π Annulene Analogues with Diverse Structural Features","Journal of the American Chemical Society","2009","131","","15433","15439","10.1021/ja906290d","","","0.71073","MoKα","","0.1582","0.1161","","","0.2816","0.3325","","","","","","1.383","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105192","9.7036","0.0004","12.8407","0.0005","15.7989","0.0006","101.927","0.002","92.695","0.002","94.785","0.002","1915.18","0.13","248","2","248","2","","","","","","","","6","P 1","P 1","1","","","","- C70 H16 Cl12 F30 S3 Se3 -","- C70 H16 Cl12 F30 S3 Se3 -","- C70 H16 Cl12 F30 S3 Se3 -","1","1","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Aromatic Expanded Isophlorins: Stable 30π Annulene Analogues with Diverse Structural Features","Journal of the American Chemical Society","2009","131","","15433","15439","10.1021/ja906290d","","","0.71073","MoKα","","0.1058","0.0505","","","0.1238","0.1523","","","","","","1.015","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105193","9.4066","0.001","13.0693","0.0014","15.5194","0.0017","103.922","0.002","90.72","0.002","96.358","0.002","1839","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C70 H16 Cl12 F30 S6 -","- C70.002 H16.002 Cl12 F30 S6 -","- C70.002 H16.002 Cl12 F30 S6 -","1","0.5","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Aromatic Expanded Isophlorins: Stable 30π Annulene Analogues with Diverse Structural Features","Journal of the American Chemical Society","2009","131","","15433","15439","10.1021/ja906290d","","","0.71073","MoKα","","0.0679","0.0544","","","0.1059","0.1134","","","","","","0.809","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105194","9.7879","0.0003","12.8233","0.0004","15.7687","0.0006","102.336","0.002","92.709","0.002","94.913","0.002","1922","0.11","248","2","248","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H16 Cl12 F30 S4 Se2 -","- C70 H16 Cl12 F30 S4 Se2 -","- C70 H16 Cl12 F30 S4 Se2 -","1","0.5","","J. Sreedhar Reddy; Venkataramanarao G. Anand","Aromatic Expanded Isophlorins: Stable 30π Annulene Analogues with Diverse Structural Features","Journal of the American Chemical Society","2009","131","","15433","15439","10.1021/ja906290d","","","0.71073","MoKα","","0.0883","0.0598","","","0.1631","0.1835","","","","","","1.024","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105195","14.7891","0.0015","10.9697","0.0011","13.8057","0.0015","90","","111.807","0.002","90","","2079.5","0.4","100","2","100","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C24 H64 As N4 P5 Si4 -","- C24 H64 As0.934 N4 P4.934 Si4 -","- C48 H128 As1.868 N8 P9.868 Si8 -","2","1","","Brandi M. Cossairt; Christopher C. Cummins","Properties and Reactivity Patterns of AsP3: An Experimental and Computational Study of Group 15 Elemental Molecules","Journal of the American Chemical Society","2009","131","","15501","15511","10.1021/ja906294m","","","0.71073","MoKα","","0.0741","0.0513","","","0.1123","0.1258","","","","","","1.032","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105196","22.7716","0.0005","22.7817","0.0004","24.361","0.0008","101.588","0.001","101.552","0.001","113.098","0.001","10828","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","AsP3FeCp*(dppe)","","","- C60 H59 As B Cl0.75 Fe P5 -","- C60.75 H60.5 As B Cl1.5 Fe P5 -","- C486 H484 As8 B8 Cl12 Fe8 P40 -","8","4","","Brandi M. Cossairt; Christopher C. Cummins","Properties and Reactivity Patterns of AsP3: An Experimental and Computational Study of Group 15 Elemental Molecules","Journal of the American Chemical Society","2009","131","","15501","15511","10.1021/ja906294m","","","1.54178","CuKα","","0.0806","0.0668","","","0.1771","0.1871","","","","","","1.052","","","","has coordinates,has disorder","178797","2020-10-21","18:00:00",""
"4105197","12.202","0.002","9.2582","0.0015","17.37","0.003","90","","96.076","0.003","90","","1951.2","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 Br O4 -","- C22 H23 Br O4 -","- C88 H92 Br4 O16 -","4","1","","Dixit Parmar; Lorna A. Duffy; Dhandapani V. Sadasivam; Hiroshi Matsubara; Paul A. Bradley; Robert A. Flowers; David J. Procter","Studies on the Mechanism, Selectivity, and Synthetic Utility of Lactone Reduction Using SmI2 and H2O","Journal of the American Chemical Society","2009","131","","15467","15473","10.1021/ja906396u","","","0.71073","MoKα","","0.0422","0.0312","","","0.0741","0.0784","","","","","","1.021","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105198","34.548","0.002","14.5329","0.001","19.1876","0.0013","90","","78.504","0.002","90","","9440.5","1.1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium tetrahydrofuran Uranium(IV) hexakis(benzyl)","","- C52 H58 K2 O2.5 U -","- C52 H58 K2 O2.5 U -","- C416 H464 K16 O20 U8 -","8","2","","Skye Fortier; Brent C. Melot; Guang Wu; Trevor W. Hayton","Homoleptic Uranium(IV) Alkyl Complexes: Synthesis and Characterization","Journal of the American Chemical Society","2009","131","","15512","15521","10.1021/ja906516e","","","0.71073","MoKα","","0.1429","0.0976","","","0.2363","0.2492","","","","","","1.121","","","","has coordinates","187017","2020-10-21","18:00:00",""
"4105199","10.9396","0.0008","28.544","0.002","32.502","0.002","90","","90","","90","","10149.1","1.2","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Uranium(IV) pentakis(methylenetrimethylsilane) lithium dodecakis(tert-butoxide) chloride","","- C68 H163 Cl Li14 O12 Si5 U -","- C68 H163 Cl Li14 O12 Si5 U -","- C272 H652 Cl4 Li56 O48 Si20 U4 -","4","1","","Skye Fortier; Brent C. Melot; Guang Wu; Trevor W. Hayton","Homoleptic Uranium(IV) Alkyl Complexes: Synthesis and Characterization","Journal of the American Chemical Society","2009","131","","15512","15521","10.1021/ja906516e","","","0.71073","MoKα","","0.0751","0.0448","","","0.0928","0.1116","","","","","","0.923","","","","has coordinates","178797","2020-10-21","18:00:00",""
"4105200","10.4775","0.0013","16.944","0.002","13.7753","0.0017","90","","103.39","0.002","90","","2379.1","0.5","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Lithium tetrakis(tetrahydrofuran) pentakis(neopentyl) uranium(IV)","","- C41 H37 Li O4 U -","- C41 Li O4 U -","- C82 Li2 O8 U2 -","2","0.5","","Skye Fortier; Brent C. Melot; Guang Wu; Trevor W. Hayton","Homoleptic Uranium(IV) Alkyl Complexes: Synthesis and Characterization","Journal of the American Chemical Society","2009","131","","15512","15521","10.1021/ja906516e","","","0.71073","MoKα","","0.0663","0.0534","","","0.1377","0.158","","","","","","1.106","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105201","13.9454","0.0017","15.3124","0.0016","25.567","0.003","90","","90","","90","","5459.5","1.1","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Lithium bis(tetramethylethylenediamine) hexamethyl Uranium(IV)","","- C18 H50 Li2 N4 U -","- C18 H38 Li2 N4 U -","- C144 H304 Li16 N32 U8 -","8","1","","Skye Fortier; Brent C. Melot; Guang Wu; Trevor W. Hayton","Homoleptic Uranium(IV) Alkyl Complexes: Synthesis and Characterization","Journal of the American Chemical Society","2009","131","","15512","15521","10.1021/ja906516e","","","0.71073","MoKα","","0.1031","0.0568","","","0.129","0.1528","","","","","","1.075","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105202","16.9278","0.0018","7.4154","0.0008","35.492","0.004","90","","95.125","0.002","90","","4437.4","0.8","203","2","203","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H19 Br I N O4 -","- C20 H19 Br I N O4 -","- C160 H152 Br8 I8 N8 O32 -","8","4","","David B. Guthrie; Steven J. Geib; Dennis P. Curran","Synthesis of Highly Enantioenriched 3,4-Dihydroquinolin-2-ones by 6-Exo-trig Radical Cyclizations of Axially Chiral α-Halo-ortho-alkenyl Anilides","Journal of the American Chemical Society","2009","131","","15492","15500","10.1021/ja9066282","","","0.71073","MoKα","","0.1007","0.0764","","","0.1861","0.1965","","","","","","1.298","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105203","10.5601","0.0018","7.3873","0.0013","14.727","0.003","90","","101.49","0.004","90","","1125.8","0.4","203","2","203","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H28 Br N O4 -","- C24 H28 Br N O4 -","- C48 H56 Br2 N2 O8 -","2","1","","David B. Guthrie; Steven J. Geib; Dennis P. Curran","Synthesis of Highly Enantioenriched 3,4-Dihydroquinolin-2-ones by 6-Exo-trig Radical Cyclizations of Axially Chiral α-Halo-ortho-alkenyl Anilides","Journal of the American Chemical Society","2009","131","","15492","15500","10.1021/ja9066282","","","0.71073","MoKα","","0.0747","0.05","","","0.1159","0.1338","","","","","","0.823","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105204","12.012","0.003","9.305","0.002","22.056","0.005","90","","101.822","0.005","90","","2412.9","1","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 N O5 -","- C27 H33 N O5 -","- C108 H132 N4 O20 -","4","1","","David B. Guthrie; Steven J. Geib; Dennis P. Curran","Synthesis of Highly Enantioenriched 3,4-Dihydroquinolin-2-ones by 6-Exo-trig Radical Cyclizations of Axially Chiral α-Halo-ortho-alkenyl Anilides","Journal of the American Chemical Society","2009","131","","15492","15500","10.1021/ja9066282","","","0.71073","MoKα","","0.1066","0.057","","","0.1323","0.1537","","","","","","0.922","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105205","34.444","0.003","34.444","0.003","46.286","0.006","90","","90","","120","","47556","9","200","2","200","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","Na7[(V=O)7Na7(H2O)7(b-CD)2].65H2O (1)","","- C84 H256 Na14 O149 V7 -","- C84 H112 Na7 O84 V7 -","- C756 H1008 Na63 O756 V63 -","9","0.5","","Norihisa Hoshino; Motohiro Nakano; Hiroyuki Nojiri; Wolfgang Wernsdorfer; Hiroki Oshio","Templating Odd Numbered Magnetic Rings: Oxovanadium Heptagons Sandwiched by β-Cyclodextrins","Journal of the American Chemical Society","2009","131","","15100","15101","10.1021/ja9066496","","","0.71073","MoKα","","0.104","0.0709","","","0.1761","0.1912","","","","","","0.924","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105206","21.322","0.008","18.694","0.007","23.798","0.009","90","","100.184","0.006","90","","9336","6","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Na7[(V=O)7Na7(H2O)7(b-CD)2].39H2O (2)","","- C84 H204 Na14 O123 V7 -","- C84 H112 Na7 O84 V7 -","- C168 H224 Na14 O168 V14 -","2","1","","Norihisa Hoshino; Motohiro Nakano; Hiroyuki Nojiri; Wolfgang Wernsdorfer; Hiroki Oshio","Templating Odd Numbered Magnetic Rings: Oxovanadium Heptagons Sandwiched by β-Cyclodextrins","Journal of the American Chemical Society","2009","131","","15100","15101","10.1021/ja9066496","","","0.71073","MoKα","","0.1137","0.0772","","","0.1925","0.2067","","","","","","0.883","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105207","12.589","0.002","14.928","0.003","15.567","0.003","90","","90","","90","","2925.5","0.9","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H20 N2 S -","- C15 H20 N2 S -","- C120 H160 N16 S8 -","8","1","","Zitao Wang; Yang Wang; Wen-Xiong Zhang; Zhaomin Hou; Zhenfeng Xi","Efficient One-Pot Synthesis of 2,3-Dihydropyrimidinthiones via Multicomponent Coupling of Terminal Alkynes, Elemental Sulfur, and Carbodiimides","Journal of the American Chemical Society","2009","131","","15108","15109","10.1021/ja9069419","","","0.71073","MoKα","","0.0704","0.0379","","","0.0661","0.0713","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105208","23.185","0.007","9.352","0.003","18.826","0.006","90","","121.493","0.018","90","","3481","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H58 Ca O2 Si6 -","- C22 H58 Ca O2 Si6 -","- C88 H232 Ca4 O8 Si24 -","4","0.5","","KaKing Yan; Brianna M. Upton; Arkady Ellern; Aaron D. Sadow","Lewis Acid-Mediated β-Hydride Abstraction Reactions of Divalent M(C(SiHMe2)3)2THF2(M = Ca, Yb)","Journal of the American Chemical Society","2009","131","","15110","15111","10.1021/ja9070865","","","0.71073","MoKα","","0.1185","0.0804","","","0.1921","0.2165","","","","","","1.037","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105209","11.0485","0.0015","23.131","0.003","15.359","0.002","90","","96.616","0.002","90","","3899.1","0.9","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H38 B Ca F15 O2 Si3 -","- C33 H38 B Ca F15 O2 Si3 -","- C132 H152 B4 Ca4 F60 O8 Si12 -","4","1","","KaKing Yan; Brianna M. Upton; Arkady Ellern; Aaron D. Sadow","Lewis Acid-Mediated β-Hydride Abstraction Reactions of Divalent M(C(SiHMe2)3)2THF2(M = Ca, Yb)","Journal of the American Chemical Society","2009","131","","15110","15111","10.1021/ja9070865","","","0.71073","MoKα","","0.0626","0.0418","","","0.099","0.1093","","","","","","1.013","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105210","8.512","0.007","8.569","0.007","9.253","0.009","104.555","0.019","91.47","0.02","114.49","0.02","588","0.9","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H40 Si6 -","- C14 H40 Si6 -","- C14 H40 Si6 -","1","0.5","","KaKing Yan; Brianna M. Upton; Arkady Ellern; Aaron D. Sadow","Lewis Acid-Mediated β-Hydride Abstraction Reactions of Divalent M(C(SiHMe2)3)2THF2(M = Ca, Yb)","Journal of the American Chemical Society","2009","131","","15110","15111","10.1021/ja9070865","","","0.71073","MoKα","","0.1016","0.0771","","","0.1992","0.2429","","","","","","1.034","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105211","22.792","0.012","9.284","0.004","18.655","0.01","90","","121.189","0.016","90","","3377","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H58 O2 Si6 Yb -","- C22 H58 O2 Si6 Yb -","- C88 H232 O8 Si24 Yb4 -","4","0.5","","KaKing Yan; Brianna M. Upton; Arkady Ellern; Aaron D. Sadow","Lewis Acid-Mediated β-Hydride Abstraction Reactions of Divalent M(C(SiHMe2)3)2THF2(M = Ca, Yb)","Journal of the American Chemical Society","2009","131","","15110","15111","10.1021/ja9070865","","","0.71073","MoKα","","0.048","0.0329","","","0.0627","0.0684","","","","","","1.029","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105212","10.2093","0.0008","15.3491","0.0012","24.6786","0.0019","90","","90","","90","","3867.2","0.5","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Yb(HBPh3)2THF","bis(hydridotriphenylborato)tetrahydrofuran ytterbium(II)","","- C47 H48 B2 O Yb -","- C47 H48 B2 O Yb -","- C188 H192 B8 O4 Yb4 -","4","1","","KaKing Yan; Brianna M. Upton; Arkady Ellern; Aaron D. Sadow","Lewis Acid-Mediated β-Hydride Abstraction Reactions of Divalent M(C(SiHMe2)3)2THF2(M = Ca, Yb)","Journal of the American Chemical Society","2009","131","","15110","15111","10.1021/ja9070865","","","0.71073","MoKα","","0.0279","0.024","","","0.0544","0.0559","","","","","","1.006","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105213","11.0583","0.0007","23.1942","0.0014","15.371","0.0009","90","","97.032","0.001","90","","3912.8","0.4","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H38 B F15 O2 Si3 Yb -","- C33 H38 B F15 O2 Si3 Yb -","- C132 H152 B4 F60 O8 Si12 Yb4 -","4","1","","KaKing Yan; Brianna M. Upton; Arkady Ellern; Aaron D. Sadow","Lewis Acid-Mediated β-Hydride Abstraction Reactions of Divalent M(C(SiHMe2)3)2THF2(M = Ca, Yb)","Journal of the American Chemical Society","2009","131","","15110","15111","10.1021/ja9070865","","","0.71073","MoKα","","0.0262","0.0215","","","0.0526","0.0549","","","","","","1.032","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105214","9.98","0.0004","21.6272","0.0007","17.1","0.0007","90","","90.7161","0.0013","90","","3690.6","0.2","123","2","123","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","tetraallyl-C60","","","- C72 H20 -","- C72 H20 -","- C288 H80 -","4","1","","Masakazu Nambo; Atsushi Wakamiya; Shigehiro Yamaguchi; Kenichiro Itami","Regioselective Unsymmetrical Tetraallylation of C60 through Palladium Catalysis","Journal of the American Chemical Society","2009","131","","15112","15113","10.1021/ja9071173","","","0.71069","MoKa","","0.1915","0.095","","","0.23","0.2943","","","","","","1.024","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105215","16.505","0.005","10.134","0.003","20.035","0.006","90","","109.164","0.004","90","","3165.4","1.6","123","2","123","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,2-diallyl-C60","","","- C66 H10 -","- C66 H10 -","- C264 H40 -","4","1","","Masakazu Nambo; Atsushi Wakamiya; Shigehiro Yamaguchi; Kenichiro Itami","Regioselective Unsymmetrical Tetraallylation of C60 through Palladium Catalysis","Journal of the American Chemical Society","2009","131","","15112","15113","10.1021/ja9071173","","","0.7107","MoKa","","0.1484","0.1226","","","0.344","0.363","","","","","","1.318","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105216","12.0154","0.0013","10.6506","0.0011","13.5976","0.0014","90","","94.059","0.002","90","","1735.7","0.3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H44 Cl2 N2 Ru -","- C37 H46 Cl2 N2 Ru -","- C74 H92 Cl4 N4 Ru2 -","2","1","","Kung-Pern Wang; Sang Young Yun; Daesung Lee; Donald J. Wink","Structure and Reactivity of Alkyne-Chelated Ruthenium Alkylidene Complexes","Journal of the American Chemical Society","2009","131","","15114","15115","10.1021/ja907155r","","","0.71073","MoKα","","0.0475","0.0379","","","0.0762","0.0798","","","","","","1.005","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105217","8.4902","0.0005","11.6888","0.0009","7.6132","0.0005","90","","90","","90","","755.54","0.09","296","2","296","2","","","","","","","","5","C m m m","-C 2 2","65","","","","- Cs2 K O14 Si4 U2 -","- Cs2 K O14 Si4 U2 -","- Cs4 K2 O28 Si8 U4 -","2","0.125","","Cheng-Shiuan Lee; Sue-Lein Wang; Kwang-Hwa Lii","Cs2K(UO)2Si4O12: A Mixed-Valence Uranium(IV,V) Silicate","Journal of the American Chemical Society","2009","131","","15116","15117","10.1021/ja9071805","","","0.71073","MoKα","","0.0142","0.0138","","","0.0345","0.0347","","","","","","1.195","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105218","11.022","0.007","18.809","0.013","11.102","0.008","90","","109.586","0.011","90","","2168","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 Br N2 O P -","- C24 H23 Br N2 O P -","- C96 H92 Br4 N8 O4 P4 -","4","1","","Joshua P. Abell; Hisashi Yamamoto","Dual-Activation Asymmetric Strecker Reaction of Aldimines and Ketimines Catalyzed by a Tethered Bis(8-quinolinolato) Aluminum Complex","Journal of the American Chemical Society","2009","131","","15118","15119","10.1021/ja907268g","","","0.71073","MoKα","","0.0949","0.0723","","","0.1349","0.1408","","","","","","1.165","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105219","19.943","0.006","19.943","0.006","10.142","0.004","90","","90","","120","","3493","2","100","2","100","2","","","","","","","","6","P 65","P 65","170","","","","- C23 H23 Br N2 O P -","- C23 H23 Br N2 O P -","- C138 H138 Br6 N12 O6 P6 -","6","1","","Joshua P. Abell; Hisashi Yamamoto","Dual-Activation Asymmetric Strecker Reaction of Aldimines and Ketimines Catalyzed by a Tethered Bis(8-quinolinolato) Aluminum Complex","Journal of the American Chemical Society","2009","131","","15118","15119","10.1021/ja907268g","","","0.71073","MoKα","","0.0702","0.0482","","","0.1082","0.1138","","","","","","0.917","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105220","24.3013","0.0009","24.3013","0.0009","54.57","0.003","90","","90","","90","","32226","2","100","2","100","2","","","","","","","","4","P -4 c 2","P -4 -2c","116","BeBTB","","","- C54 H36 Be6 O18 -","- C54 H36 Be6 O18 -","- C432 H288 Be48 O144 -","8","1","","Kenji Sumida; Matthew R. Hill; Satoshi Horike; Anne Dailly; Jeffrey R. Long","Synthesis and Hydrogen Storage Properties of Be12(OH)12(1,3,5-benzenetribenzoate)4","Journal of the American Chemical Society","2009","131","","15120","15121","10.1021/ja9072707","","","1.54178","CuKα","","0.0363","0.0315","","","0.0849","0.0863","","","","","","0.961","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105221","19.38","0.004","15.591","0.003","14.358","0.003","90","","92.26","0.03","90","","4334.9","1.5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H49 F6 N3 O7 S3 -","- C37 H49 F6 N3 O7 S3 -","- C148 H196 F24 N12 O28 S12 -","4","0.5","","Caleb D. Martin; Christine M. Le; Paul J. Ragogna","Remarkably Stable Chalcogen(II) Dications","Journal of the American Chemical Society","2009","131","","15126","15127","10.1021/ja9073968","","","0.71073","MoKα","","0.0818","0.0496","","","0.1137","0.1297","","","","","","1.034","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105222","19.3723","0.0011","15.4754","0.0009","14.5351","0.0007","90","","91.768","0.002","90","","4355.5","0.4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H49 F6 N3 O7 S2 Se -","- C37 H49 F6 N3 O7 S2 Se -","- C148 H196 F24 N12 O28 S8 Se4 -","4","0.5","","Caleb D. Martin; Christine M. Le; Paul J. Ragogna","Remarkably Stable Chalcogen(II) Dications","Journal of the American Chemical Society","2009","131","","15126","15127","10.1021/ja9073968","","","0.71073","MoKα","","0.0537","0.0434","","","0.1088","0.1149","","","","","","1.037","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105223","11.995","0.002","8.2243","0.0016","16.523","0.003","90","","100.76","0.03","90","","1601.3","0.5","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C27 H26 F6 N4 O6 S2 Te -","- C27 H26 F6 N4 O6 S2 Te -","- C54 H52 F12 N8 O12 S4 Te2 -","2","1","","Caleb D. Martin; Christine M. Le; Paul J. Ragogna","Remarkably Stable Chalcogen(II) Dications","Journal of the American Chemical Society","2009","131","","15126","15127","10.1021/ja9073968","","","0.71073","MoKα","","0.0452","0.0362","","","0.0871","0.0988","","","","","","1.101","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105224","9.115","0.003","9.932","0.003","12.311","0.004","79.456","0.009","89.201","0.01","63.883","0.009","981","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H18 O4 S -","- C24 H16 O4 S -","- C48 H32 O8 S2 -","2","1","","Amit Basak; Sanket Das; Dibyendu Mallick; Eluvathingal D. Jemmis","Which One Is Preferred: Myers-Saito Cyclization of Ene-Yne-Allene or Garratt-Braverman Cyclization of Conjugated Bisallenic Sulfone? A Theoretical and Experimental Study","Journal of the American Chemical Society","2009","131","","15695","15704","10.1021/ja9023644","","","0.71073","MoKα","","0.1465","0.0764","","","0.1859","0.2094","","","","","","0.985","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105225","14.311","0.003","18.36","0.004","21.044","0.004","90","","90","","90","","5529","2","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C59 H49.25 B3 Cl3.25 N O7 S0.75 -","- C59.203 H49.274 B3 Cl3.274 N O7 S0.783 -","- C236.812 H197.096 B12 Cl13.096 N4 O28 S3.132 -","4","1","","Gang Hu; Li Huang; Rui H. Huang; William D. Wulff","Evidence for a Boroxinate Based Brønsted Acid Derivative of VAPOL as the Active Catalyst in the Catalytic Asymmetric Aziridination Reaction","Journal of the American Chemical Society","2009","131","","15615","15617","10.1021/ja904589k","","","0.71073","MoKα","","0.1545","0.0895","","","0.2242","0.245","","","","","","1.413","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105226","12.865","0.003","17.944","0.004","21.546","0.004","90","","90","","90","","4973.9","1.9","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C60 H47 B3 Cl2 N2 O7 -","- C60 H47 B3 Cl2 N2 O7 -","- C240 H188 B12 Cl8 N8 O28 -","4","1","","Gang Hu; Li Huang; Rui H. Huang; William D. Wulff","Evidence for a Boroxinate Based Brønsted Acid Derivative of VAPOL as the Active Catalyst in the Catalytic Asymmetric Aziridination Reaction","Journal of the American Chemical Society","2009","131","","15615","15617","10.1021/ja904589k","","","0.71073","MoKα","","0.083","0.0469","","","0.1174","0.1384","","","","","","0.894","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105227","9.1653","0.0011","11.1937","0.0013","14.2705","0.0017","78.851","0.002","89.57","0.002","89.34","0.002","1436.3","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H41 F6 N O Os P2 -","- C26 H41 F6 N O Os P2 -","- C52 H82 F12 N2 O2 Os2 P4 -","2","1","","Ruth Castro-Rodrigo; Miguel A. Esteruelas; Sara Fuertes; Ana M. López; Fernando López; José L. Mascareñas; Silvia Mozo; Enrique Oñate; Lucía Saya; Lara Villarino","Formation of Osmium- and Ruthenium-Cyclobutylidene Complexes by Ring Expansion of Alkylidenecyclopropanes","Journal of the American Chemical Society","2009","131","","15572","15573","10.1021/ja904893j","","","0.71073","MoKα","","0.0453","0.038","","","0.0759","0.0781","","","","","","1.104","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105228","14.356","0.009","14.579","0.009","30.45","0.018","90","","90","","90","","6373","7","100","2","100","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C28.2 H42.4 B2 F4 N7 O0.4 Os P -","- C28.2 H42.4 B2 F4 N7 O0.4 Os P -","- C225.6 H339.2 B16 F32 N56 O3.2 Os8 P8 -","8","1","","Ruth Castro-Rodrigo; Miguel A. Esteruelas; Sara Fuertes; Ana M. López; Fernando López; José L. Mascareñas; Silvia Mozo; Enrique Oñate; Lucía Saya; Lara Villarino","Formation of Osmium- and Ruthenium-Cyclobutylidene Complexes by Ring Expansion of Alkylidenecyclopropanes","Journal of the American Chemical Society","2009","131","","15572","15573","10.1021/ja904893j","","","0.71073","MoKα","","0.0833","0.0641","","","0.112","0.1182","","","","","","1.226","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105229","10.4105","0.0005","10.8685","0.0006","16.5368","0.001","77.003","0.003","76.36","0.002","64.354","0.002","1622.99","0.16","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H50 Cl N O2 P Rh -","- C34 H50 Cl N O2 P Rh -","- C68 H100 Cl2 N2 O4 P2 Rh2 -","2","1","","Derek M. Dalton; Kevin M. Oberg; Robert T. Yu; Ernest E. Lee; Stéphane Perreault; Mark Emil Oinen; Melissa L. Pease; Guillaume Malik; Tomislav Rovis","Enantioselective Rhodium-Catalyzed [2 + 2 + 2] Cycloadditions of Terminal Alkynes and Alkenyl Isocyanates: Mechanistic Insights Lead to a Unified Model that Rationalizes Product Selectivity","Journal of the American Chemical Society","2009","131","","15717","15728","10.1021/ja905065j","","","0.71073","MoKα","","0.041","0.0336","","","0.0761","0.0792","","","","","","1.104","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105230","11.2417","0.0005","14.6792","0.0006","21.3614","0.0009","90","","90","","90","","3525","0.3","296","2","296","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C36 H46 Cl N O2 P Rh Si2 -","- C36 H46 Cl N O2 P Rh Si2 -","- C144 H184 Cl4 N4 O8 P4 Rh4 Si8 -","4","1","","Derek M. Dalton; Kevin M. Oberg; Robert T. Yu; Ernest E. Lee; Stéphane Perreault; Mark Emil Oinen; Melissa L. Pease; Guillaume Malik; Tomislav Rovis","Enantioselective Rhodium-Catalyzed [2 + 2 + 2] Cycloadditions of Terminal Alkynes and Alkenyl Isocyanates: Mechanistic Insights Lead to a Unified Model that Rationalizes Product Selectivity","Journal of the American Chemical Society","2009","131","","15717","15728","10.1021/ja905065j","","","0.71073","MoKα","","0","0.0453","","","0.0863","0.1035","","","","","","0.996","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105231","10.8877","0.0003","18.0279","0.0005","11.1484","0.0003","90","","91.924","0.001","90","","2187","0.1","120","","120","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C43 H50 Cl5 N O4 P Rh -","- C43 H50 Cl5 N O4 P Rh -","- C86 H100 Cl10 N2 O8 P2 Rh2 -","2","1","","Derek M. Dalton; Kevin M. Oberg; Robert T. Yu; Ernest E. Lee; Stéphane Perreault; Mark Emil Oinen; Melissa L. Pease; Guillaume Malik; Tomislav Rovis","Enantioselective Rhodium-Catalyzed [2 + 2 + 2] Cycloadditions of Terminal Alkynes and Alkenyl Isocyanates: Mechanistic Insights Lead to a Unified Model that Rationalizes Product Selectivity","Journal of the American Chemical Society","2009","131","","15717","15728","10.1021/ja905065j","","","0.71073","MoKα","","0.0786","0.0511","","","0.1067","0.1195","","","","","","1.005","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105232","15.3754","0.0004","17.3853","0.0004","18.1214","0.0004","90","","90","","90","","4844","0.2","120","","120","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C51 H64 Cl N O4 P Rh -","- C51 H64 Cl N O4 P Rh -","- C204 H256 Cl4 N4 O16 P4 Rh4 -","4","1","","Derek M. Dalton; Kevin M. Oberg; Robert T. Yu; Ernest E. Lee; Stéphane Perreault; Mark Emil Oinen; Melissa L. Pease; Guillaume Malik; Tomislav Rovis","Enantioselective Rhodium-Catalyzed [2 + 2 + 2] Cycloadditions of Terminal Alkynes and Alkenyl Isocyanates: Mechanistic Insights Lead to a Unified Model that Rationalizes Product Selectivity","Journal of the American Chemical Society","2009","131","","15717","15728","10.1021/ja905065j","","","0.71073","MoKα","","0.0916","0.0532","","","0.1025","0.1183","","","","","","1.006","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105233","10.8926","0.0007","18.1189","0.0011","11.223","0.0007","90","","91.835","0.003","90","","2213.9","0.2","120","","120","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C45 H52 Cl5 N O4 P Rh -","- C45 H52 Cl5 N O4 P Rh -","- C90 H104 Cl10 N2 O8 P2 Rh2 -","2","1","","Derek M. Dalton; Kevin M. Oberg; Robert T. Yu; Ernest E. Lee; Stéphane Perreault; Mark Emil Oinen; Melissa L. Pease; Guillaume Malik; Tomislav Rovis","Enantioselective Rhodium-Catalyzed [2 + 2 + 2] Cycloadditions of Terminal Alkynes and Alkenyl Isocyanates: Mechanistic Insights Lead to a Unified Model that Rationalizes Product Selectivity","Journal of the American Chemical Society","2009","131","","15717","15728","10.1021/ja905065j","","","0.71073","MoKα","","0.0246","0.0232","","","0.0574","0.0581","","","","","","1.018","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105234","16.861","0.003","10.925","0.002","23.401","0.005","90","","110.76","0.03","90","","4030.7","1.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H61 P Si6 Zr -","- C31 H61 P Si6 Zr -","- C124 H244 P4 Si24 Zr4 -","4","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.0787","0.0634","","","0.2189","0.2438","","","","","","0.994","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105235","11.365","0.002","15.798","0.003","17.117","0.003","90","","90","","90","","3073.3","1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H47 P Si5 Zr -","- C22 H47 P Si5 Zr -","- C88 H188 P4 Si20 Zr4 -","4","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.1111","0.0646","","","0.1102","0.1255","","","","","","0.889","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105236","9.878","0.002","10.085","0.002","16.779","0.003","90.47","0.03","90.22","0.03","117.42","0.03","1483.6","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H46 Si6 Ti -","- C22 H46 Si6 Ti -","- C44 H92 Si12 Ti2 -","2","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.17","0.0984","","","0.2191","0.2586","","","","","","1.014","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105237","16.908","0.003","10.926","0.002","23.415","0.005","90","","110.94","0.03","90","","4039.9","1.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H63 Ge2 Hf P Si4 -","- C32 H63 Ge2 Hf P Si4 -","- C128 H252 Ge8 Hf4 P4 Si16 -","4","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.0578","0.0452","","","0.0901","0.0947","","","","","","1.073","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105238","11.461","0.002","11.77","0.002","13.139","0.003","84","0.03","84.43","0.03","86.36","0.03","1751.8","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H55 Ge2 P Si4 Zr -","- C25 H55 Ge2 P Si4 Zr -","- C50 H110 Ge4 P2 Si8 Zr2 -","2","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.1","0.0712","","","0.1462","0.1606","","","","","","1.026","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105239","10.982","0.002","11.835","0.002","17.5","0.004","86.81","0.03","87.77","0.03","75.29","0.03","2195.8","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H64 Hf Si6 Sn3 -","- C28 H64 Hf Si6 Sn3 -","- C56 H128 Hf2 Si12 Sn6 -","2","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.08","0.0701","","","0.2179","0.2332","","","","","","1.109","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105240","10.916","0.002","11.849","0.002","17.496","0.003","87.04","0.03","87.75","0.03","76.3","0.03","2194.8","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H64 Si6 Sn3 Zr -","- C28 H64 Si6 Sn3 Zr -","- C56 H128 Si12 Sn6 Zr2 -","2","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.1202","0.0885","","","0.1501","0.1621","","","","","","1.204","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105241","16.865","0.003","10.921","0.002","23.394","0.005","90","","110.88","0.03","90","","4025.8","1.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H63 Ge Hf P Si5 -","- C32 H63 Ge Hf P Si5 -","- C128 H252 Ge4 Hf4 P4 Si20 -","4","1","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.0526","0.044","","","0.0939","0.0975","","","","","","1.144","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105242","19.289","0.004","12.751","0.003","10.29","0.002","90","","117.74","0.03","90","","2240","1","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C24 H72 Ge4 Si8 -","- C24 H72 Ge4 Si8 -","- C48 H144 Ge8 Si16 -","2","0.5","","Michaela Zirngast; Michaela Flock; Judith Baumgartner; Christoph Marschner","Group 4 Metallocene Complexes of Disilenes, Digermenes, and a Silagermene","Journal of the American Chemical Society","2009","131","","15952","15962","10.1021/ja905654r","","","0.71073","MoKα","","0.0631","0.0527","","","0.1166","0.1235","","","","","","1.059","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105243","15.508","0.0004","16.1827","0.0005","16.3415","0.0006","90.5519","0.0011","99.3054","0.0011","103.893","0.0016","3923.7","0.2","130","2","130","2","","","","","","","","8","P -1","-P 1","2","ML097_3","ML097_3","","- C134 H209 F24 N12 O4.5 P4 Pd6 Tl4 -","- C134 H209 F24 N12 O4.5 P4 Pd6 Tl4 -","- C134 H209 F24 N12 O4.5 P4 Pd6 Tl4 -","1","0.5","","Michael P. Lanci; Matthew S. Remy; Werner Kaminsky; James M. Mayer; Melanie S. Sanford","Oxidatively Induced Reductive Elimination from (tBu2bpy)Pd(Me)2: Palladium(IV) Intermediates in a One-Electron Oxidation Reaction","Journal of the American Chemical Society","2009","131","","15618","15620","10.1021/ja905816q","","","0.71073","MoKα","","0.1167","0.0549","","","0.1133","0.135","","","","","","0.96","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105244","14.0829","0.0003","14.0829","0.0003","5.9129","0.0003","90","","90","","120","","1015.58","0.06","150","","150","","","","","","","","Synthesized by the authors. See text","4","P 31","P 31","144","","","","- C16 H15 Cl O -","- C16 H15 Cl O -","- C48 H45 Cl3 O3 -","3","1","","Lucie E. Zimmer; André B. Charette","Enantioselective Synthesis of 1,2,3-Trisubstituted Cyclopropanes Usinggem-Dizinc Reagents","Journal of the American Chemical Society","2009","131","","15624","15626","10.1021/ja906033g","","","1.54178","CuKα","","0.0605","0.0597","","","0.1567","0.1574","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105245","3.769","0.0005","18.064","0.002","9.6698","0.0013","90","","99.88","0.01","90","","648.59","0.14","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,8-Di(4-pyridyl)-1,3,5,7-octatetrayne","","- C18 H8 N2 -","- C18 H8 N2 -","- C36 H16 N4 -","2","0.5","","Changsheng Wang; Andrei S. Batsanov; Martin R. Bryce; Santiago Martín; Richard J. Nichols; Simon J. Higgins; Víctor M. García-Suárez; Colin J. Lambert","Oligoyne Single Molecule Wires","Journal of the American Chemical Society","2009","131","","15647","15654","10.1021/ja9061129","","","0.71073","MoKα","","0.0647","0.0448","","","0.108","0.1172","","","","","","1.044","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105246","6.2122","0.0004","12.8417","0.0009","12.9157","0.0009","84.887","0.003","79.116","0.003","80.662","0.003","996.59","0.12","203","","","","","","","","","","Carreira laboratory","4","P -1","-P 1","2","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","2","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0871","0.0523","","","0.1355","0.1659","","","","","","0.904","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105247","16.4","0.002","5.6769","0.0008","10.0838","0.0013","90","","104.045","0.009","90","","910.7","0.2","22","","","","","","","","","","Carreira laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.094","0.0548","","","0.1511","0.1848","","","","","","0.991","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105248","16.226","0.0011","7.1681","0.0004","8.4596","0.0004","90","","90.878","0.002","90","","983.82","0.1","203","","","","","","","","","","LOC ETH Zurich","4","P 1 21/c 1","-P 2ybc","14","","3,4,5-trichlorohexane-1,2-diol","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0811","0.0709","","","0.1776","0.1915","","","","","","1.387","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105249","5.8807","0.0001","15.3856","0.0004","10.3567","0.0003","90","","92.8583","0.0009","90","","935.89","0.04","223","","","","","","","","","","LOC ETH Zurich","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0349","0.0313","","","0.1006","0.1078","","","","","","0.896","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105250","5.9791","0.0002","9.9546","0.0004","15.7432","0.0006","90","","90","","90","","937.03","0.06","173","","","","","","","","","","LOC ETH Zurich","4","P 21 21 21","P 2ac 2ab","19","","(2R,3S,4R,5R)-2,4,5-trichlorohexane-1,3-diol","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0434","0.0389","","","0.1049","0.1124","","","","","","0.812","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105251","19.6489","0.0006","5.0979","0.0002","20.4002","0.0006","90","","111.962","0.002","90","","1895.16","0.11","223","","","","","","","","","","LOC ETH Zurich","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C48 H88 Cl24 O16 -","8","2","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0789","0.0597","","","0.1502","0.1751","","","","","","1.148","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105252","10.0179","0.0003","10.8181","0.0003","17.9104","0.0005","90","","90","","90","","1941.03","0.1","203","","","","","","","","","","LOC ETH Zurich","4","P b n a","-P 2ac 2b","60","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C48 H88 Cl24 O16 -","8","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0392","0.0336","","","0.1174","0.1248","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105253","8.0208","0.0008","6.0426","0.0006","9.7977","0.001","90","","95.619","0.005","90","","472.58","0.08","293","","","","","","","","","","LOC ETH Zurich, CN796_2_1_1","4","P 1 21 1","P 2yb","4","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C12 H22 Cl6 O4 -","2","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0912","0.0641","","","0.1589","0.1833","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105254","12.7354","0.0004","8.1967","0.0003","10.1268","0.0003","90","","109.523","0.002","90","","996.34","0.06","223","","","","","","","","","","LOC ETH Zurich","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0436","0.0396","","","0.1466","0.1527","","","","","","1.253","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105255","12.7131","0.0005","5.0275","0.0002","15.2227","0.0006","90","","109.055","0.002","90","","919.65","0.06","223","","","","","","","","","","LOC ETH Zurich","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.0532","0.0372","","","0.1108","0.1424","","","","","","0.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105256","15.9264","0.0008","6.2254","0.0003","9.5377","0.0004","90","","104.182","0.002","90","","916.82","0.07","223","","","","","","","","","","LOC ETH Zurich","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 Cl3 O2 -","- C6 H11 Cl3 O2 -","- C24 H44 Cl12 O8 -","4","1","","Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira","Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products","Journal of the American Chemical Society","2009","131","","15866","15876","10.1021/ja906461h","","","0.71073","MoKα","","0.1095","0.1015","","","0.2943","0.2983","","","","","","2.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105257","8.509","0.0006","13.1425","0.0007","9.904","0.0006","90","","92.759","0.008","90","","1106.28","0.12","170","2","170","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N2 -","- C14 H12 N2 -","- C56 H48 N8 -","4","1","","Ron Siewertsen; Hendrikje Neumann; Bengt Buchheim-Stehn; Rainer Herges; Christian Näther; Falk Renth; Friedrich Temps","Highly Efficient Reversible Z-E Photoisomerization of a Bridged Azobenzene with Visible Light through Resolved S1(nπ*) Absorption Bands","Journal of the American Chemical Society","2009","131","","15594","15595","10.1021/ja906547d","","","0.71073","MoKα","","0.0682","0.0481","","","0.1251","0.1372","","","","","","1.048","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105258","19.115","0.002","13.0015","0.0014","19.112","0.002","90","","113.704","0.005","90","","4349.1","0.8","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Chlorido{2,6-bis[1-(2,6-diisopropylphenylimino-κ<i>N</i>)ethyl]pyridine- κ<i>N</i>(.1-)}nickel(II)‒toluene (1/2)","","- C47 H59 Cl N3 Ni -","- C47 H59 Cl N3 Ni -","- C188 H236 Cl4 N12 Ni4 -","4","1","","Tony D. Manuel; Jan-Uwe Rohde","Reaction of a Redox-Active Ligand Complex of Nickel with Dioxygen Probes Ligand-Radical Character","Journal of the American Chemical Society","2009","131","","15582","15583","10.1021/ja9065943","","","0.71073","MoKα","","0.1343","0.0577","","","0.1296","0.1679","","","","","","1","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105259","14.1976","0.0015","15.7496","0.0017","16.8785","0.0018","90","","107.454","0.005","90","","3600.4","0.7","190","2","190","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorido{6-[1-(2,6-diisopropylphenylimino-κ<i>N</i>)ethyl]pyridyl- κ<i>N</i>-2-<i>N</i>-(2,6-diisopropylphenyl)carboxamidato- κ<i>N</i>}nickel(II)‒nitromethane (1/2)","","- C34 H46 Cl N5 Ni O5 -","- C34 H46 Cl N5 Ni O5 -","- C136 H184 Cl4 N20 Ni4 O20 -","4","1","","Tony D. Manuel; Jan-Uwe Rohde","Reaction of a Redox-Active Ligand Complex of Nickel with Dioxygen Probes Ligand-Radical Character","Journal of the American Chemical Society","2009","131","","15582","15583","10.1021/ja9065943","","","0.71073","MoKα","","0.0637","0.0403","","","0.0904","0.1029","","","","","","1.028","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105260","34.1837","0.0003","34.1837","0.0003","34.1837","0.0003","90","","90","","90","","39944.5","0.6","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C36 H88 Ge12 Nd8 O68 -","- C36 Ge12 Nd8 O54.98 -","- C576 Ge192 Nd128 O879.68 -","16","0.333333","","Huan He; Gao-Juan Cao; Shou-Tian Zheng; Guo-Yu Yang","Lanthanide Germanate Cluster Organic Frameworks Constructed from {Ln8Ge12} or {Ln11Ge12} Cage Cluster Building Blocks","Journal of the American Chemical Society","2009","131","","15588","15589","10.1021/ja906735v","","","0.71073","MoKα","","0.0556","0.0513","","","0.1438","0.1471","","","","","","1.093","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105261","32.2786","0.0011","32.2786","0.0011","32.2786","0.0011","90","","90","","90","","33631","2","293","2","293","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C72 H132 Cl Ge12 N6 O91 Pr11 -","- C72 Cl0.99 Ge12 N6 O74 Pr11 -","- C576 Cl7.92 Ge96 N48 O592 Pr88 -","8","0.166667","","Huan He; Gao-Juan Cao; Shou-Tian Zheng; Guo-Yu Yang","Lanthanide Germanate Cluster Organic Frameworks Constructed from {Ln8Ge12} or {Ln11Ge12} Cage Cluster Building Blocks","Journal of the American Chemical Society","2009","131","","15588","15589","10.1021/ja906735v","","","0.71073","MoKα","","0.0568","0.056","","","0.1504","0.1509","","","","","","1.096","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105262","32.1918","0.0002","32.1918","0.0002","32.1918","0.0002","90","","90","","90","","33360.7","0.4","293","2","293","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C72 H132 Cl Ge12 N6 Nd11 O91 -","- C72 Cl0.99 Ge12 N6 Nd11 O72.98 -","- C576 Cl7.92 Ge96 N48 Nd88 O583.84 -","8","0.166667","","Huan He; Gao-Juan Cao; Shou-Tian Zheng; Guo-Yu Yang","Lanthanide Germanate Cluster Organic Frameworks Constructed from {Ln8Ge12} or {Ln11Ge12} Cage Cluster Building Blocks","Journal of the American Chemical Society","2009","131","","15588","15589","10.1021/ja906735v","","","0.71073","MoKα","","0.0665","0.0663","","","0.1629","0.1637","","","","","","1.096","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105263","32.0221","0.0011","32.0221","0.0011","32.0221","0.0011","90","","90","","90","","32836","2","293","2","293","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C72 H124 Cl Eu11 Ge12 N6 O87 -","- C72 Eu11 Ge12 N6 O70.04 -","- C576 Eu88 Ge96 N48 O560.32 -","8","0.166667","","Huan He; Gao-Juan Cao; Shou-Tian Zheng; Guo-Yu Yang","Lanthanide Germanate Cluster Organic Frameworks Constructed from {Ln8Ge12} or {Ln11Ge12} Cage Cluster Building Blocks","Journal of the American Chemical Society","2009","131","","15588","15589","10.1021/ja906735v","","","0.71073","MoKα","","0.056","0.0516","","","0.1467","0.1648","","","","","","1.091","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105264","32.0142","0.0004","32.0142","0.0004","32.0142","0.0004","90","","90","","90","","32811.6","0.7","293","2","293","2","","","","","","","","7","I -4 3 m","I -4 2 3","217","","","","- C72 H122 Cl Gd11 Ge12 N6 O86 -","- C72 Gd11 Ge12 N6 O69.98 -","- C576 Gd88 Ge96 N48 O559.84 -","8","0.166667","","Huan He; Gao-Juan Cao; Shou-Tian Zheng; Guo-Yu Yang","Lanthanide Germanate Cluster Organic Frameworks Constructed from {Ln8Ge12} or {Ln11Ge12} Cage Cluster Building Blocks","Journal of the American Chemical Society","2009","131","","15588","15589","10.1021/ja906735v","","","0.71073","MoKα","","0.0578","0.0577","","","0.1531","0.1533","","","","","","1.066","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105265","10.154","0.002","11.161","0.002","19.7","0.004","90","","90","","90","","2232.6","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H27 N O6 -","- C24 H27 N O6 -","- C96 H108 N4 O24 -","4","1","","K. C. Nicolaou; G. Scott Tria; David J. Edmonds; Moumita Kar","Total Syntheses of (\±)-Platencin and (-)-Platencin","Journal of the American Chemical Society","2009","131","","15909","15917","10.1021/ja906801g","","","0.71073","MoKα","","0.095","0.0696","","","0.1569","0.169","","","","","","1.092","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105266","6.0634","0.0012","11.813","0.002","16.238","0.003","90","","90","","90","","1163.1","0.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O2 -","- C13 H20 O2 -","- C52 H80 O8 -","4","1","","K. C. Nicolaou; G. Scott Tria; David J. Edmonds; Moumita Kar","Total Syntheses of (\±)-Platencin and (-)-Platencin","Journal of the American Chemical Society","2009","131","","15909","15917","10.1021/ja906801g","","","0.71073","MoKα","","0.0465","0.0414","","","0.1136","0.1178","","","","","","1.069","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105267","22.0808","0.0008","16.6729","0.0006","14.5623","0.0005","90","","90","","90","","5361.1","0.3","130","2","130","2","","","","","","","","6","P b c n","-P 2n 2ab","60","D-63","D-63","","- C23 H25 F6 N3 O5 Pd -","- C23 H25 F6 N3 O5 Pd -","- C184 H200 F48 N24 O40 Pd8 -","8","1","","Paul A. Sibbald; Carolyn F. Rosewall; Rodney D. Swartz; Forrest E. Michael","Mechanism of N-Fluorobenzenesulfonimide Promoted Diamination and Carboamination Reactions: Divergent Reactivity of a Pd(IV) Species","Journal of the American Chemical Society","2009","131","","15945","15951","10.1021/ja906915w","","","0.71073","MoKα","","0.1382","0.0544","","","0.1131","0.141","","","","","","0.986","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105268","10.9042","0.0012","18.895","0.002","15.2167","0.0016","90","","109.945","0.002","90","","2947.1","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H49 Ir O P2 -","- C31 H49 Ir O P2 -","- C124 H196 Ir4 O4 P8 -","4","1","","Jongwook Choi; Yuriy Choliy; Xiawei Zhang; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Cleavage of sp3 C-O Bonds via Oxidative Addition of C-H Bonds","Journal of the American Chemical Society","2009","131","","15627","15629","10.1021/ja906930u","","","0.71073","MoKα","","0.0508","0.0339","","","0.0726","0.0788","","","","","","1.023","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105269","54.624","0.003","11.2955","0.0006","22.5933","0.0011","90","","102.985","0.001","90","","13583.7","1.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H49 F6 Ir O P2 -","- C33 H49 F6 Ir O P2 -","- C528 H784 F96 Ir16 O16 P32 -","16","2","","Jongwook Choi; Yuriy Choliy; Xiawei Zhang; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Cleavage of sp3 C-O Bonds via Oxidative Addition of C-H Bonds","Journal of the American Chemical Society","2009","131","","15627","15629","10.1021/ja906930u","","","0.71073","MoKα","","0.066","0.0494","","","0.1257","0.1346","","","","","","1.098","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105270","11.2722","0.0008","30.082","0.002","11.4828","0.0008","90","","116.13","0.001","90","","3495.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35.25 H52 F5 Ir O P2 -","- C35.125 H52 F5 Ir O P2 -","- C140.5 H208 F20 Ir4 O4 P8 -","4","1","","Jongwook Choi; Yuriy Choliy; Xiawei Zhang; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Cleavage of sp3 C-O Bonds via Oxidative Addition of C-H Bonds","Journal of the American Chemical Society","2009","131","","15627","15629","10.1021/ja906930u","","","0.71073","MoKα","","0.039","0.0347","","","0.0799","0.0818","","","","","","1.028","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105271","11.7698","0.0008","19.4207","0.0014","14.9529","0.0011","90","","110.538","0.001","90","","3200.7","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31.71 H48.42 F4 Ir O P2 -","- C31.71 H48.42 F4 Ir O P2 -","- C126.84 H193.68 F16 Ir4 O4 P8 -","4","1","","Jongwook Choi; Yuriy Choliy; Xiawei Zhang; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Cleavage of sp3 C-O Bonds via Oxidative Addition of C-H Bonds","Journal of the American Chemical Society","2009","131","","15627","15629","10.1021/ja906930u","","","0.71073","MoKα","","0.0289","0.0248","","","0.0537","0.0552","","","","","","1.009","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105272","10.6099","0.0006","13.2209","0.0008","21.7424","0.0013","90","","104.037","0.001","90","","2958.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H49 Ir O P2 -","- C30 H49 Ir O P2 -","- C120 H196 Ir4 O4 P8 -","4","1","","Jongwook Choi; Yuriy Choliy; Xiawei Zhang; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Cleavage of sp3 C-O Bonds via Oxidative Addition of C-H Bonds","Journal of the American Chemical Society","2009","131","","15627","15629","10.1021/ja906930u","","","0.71073","MoKα","","0.0386","0.0275","","","0.0575","0.0617","","","","","","0.967","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105273","10.7003","0.0009","14.8286","0.0013","20.0664","0.0018","90","","100.499","0.002","90","","3130.6","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H44 F4 Ir O P2 -","- C31 H44 F4 Ir O P2 -","- C124 H176 F16 Ir4 O4 P8 -","4","1","","Jongwook Choi; Yuriy Choliy; Xiawei Zhang; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Cleavage of sp3 C-O Bonds via Oxidative Addition of C-H Bonds","Journal of the American Chemical Society","2009","131","","15627","15629","10.1021/ja906930u","","","0.71073","MoKα","","0.0367","0.0275","","","0.0593","0.0623","","","","","","0.998","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105274","7.3186","0.0007","22.46","0.02","13.2979","0.0013","90","","93.896","0.005","90","","2181","2","150","","150","","","","","","","","Synthesized by the authors. See text","3","P 1 21 1","P 2yb","4","","","","- C18 H20 O -","- C18 H20 O -","- C108 H120 O6 -","6","3","","Sébastien R. Goudreau; André B. Charette","In Situ Generation of Zinc Carbenoids from Diazo Compounds and Zinc Salts: Asymmetric Synthesis of 1,2,3-Substituted Cyclopropanes","Journal of the American Chemical Society","2009","131","","15633","15635","10.1021/ja9074776","","","1.54178","CuKα","","0.0467","0.0406","","","0.1067","0.1118","","","","","","1.025","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105275","13.177","0.0011","15.864","0.0014","16.2706","0.0014","90","","90","","90","","3401.2","0.5","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C39 H22 B F15 Fe Zr -","- C39 H22 B F15 Fe Zr -","- C156 H88 B4 F60 Fe4 Zr4 -","4","1","","Alberto Ramos; Edwin Otten; Douglas W. Stephan","Stabilizing Zr and Ti Cations by Interaction With a Ferrocenyl Fragment","Journal of the American Chemical Society","2009","131","","15610","15611","10.1021/ja9077446","","","0.71073","MoKα","","0.0395","0.0301","","","0.0678","0.0714","","","","","","1.033","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105276","13.4146","0.0016","15.9532","0.0017","16.5904","0.0017","90","","90","","90","","3550.4","0.7","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C41 H26 B F15 Fe Zr -","- C41 H26 B F15 Fe Zr -","- C164 H104 B4 F60 Fe4 Zr4 -","4","1","","Alberto Ramos; Edwin Otten; Douglas W. Stephan","Stabilizing Zr and Ti Cations by Interaction With a Ferrocenyl Fragment","Journal of the American Chemical Society","2009","131","","15610","15611","10.1021/ja9077446","","","0.71073","MoKα","","0.0628","0.0401","","","0.0757","0.0835","","","","","","1.014","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105277","12.7013","0.0006","15.4895","0.0008","22.0666","0.0011","110.254","0.002","97.413","0.002","91.311","0.002","4028.2","0.4","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C43.5 H32.25 B Br0.25 F15 Fe P Zr -","- C43.5 H31 B Br0.25 F15 Fe P Zr -","- C174 H124 B4 Br F60 Fe4 P4 Zr4 -","4","2","","Alberto Ramos; Edwin Otten; Douglas W. Stephan","Stabilizing Zr and Ti Cations by Interaction With a Ferrocenyl Fragment","Journal of the American Chemical Society","2009","131","","15610","15611","10.1021/ja9077446","","","0.71073","MoKα","","0.0552","0.0346","","","0.0787","0.0883","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105278","9.7656","0.0003","28.7619","0.0007","16.3906","0.0004","90","","106.234","0.001","90","","4420.2","0.2","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C46 H44 B F15 Fe N P Ti -","- C46 H44 B F15 Fe N P Ti -","- C184 H176 B4 F60 Fe4 N4 P4 Ti4 -","4","1","","Alberto Ramos; Edwin Otten; Douglas W. Stephan","Stabilizing Zr and Ti Cations by Interaction With a Ferrocenyl Fragment","Journal of the American Chemical Society","2009","131","","15610","15611","10.1021/ja9077446","","","0.71073","MoKα","","0.0476","0.0371","","","0.0835","0.0875","","","","","","1.062","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105279","12.1242","0.0008","21.3988","0.0011","23.125","0.003","90","","90","","90","","5999.6","0.9","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H30 Mo Zn12 -","- C40 H30 Mo Zn12 -","- C160 H120 Mo4 Zn48 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.1424","0.0676","","","0.1712","0.195","","","","","","0.832","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105280","12.745","0.003","23.559","0.005","18.921","0.005","90","","93.81","0.02","90","","5669","2","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H72 Ga4 Mo Zn4 -","- C44 H72 Ga4 Mo Zn4 -","- C176 H288 Ga16 Mo4 Zn16 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.1446","0.0622","","","0.1536","0.2094","","","","","","0.91","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105281","17.3477","0.0008","17.5178","0.0009","18.8957","0.0009","90","","94.774","0.004","90","","5722.4","0.5","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H84 Ga2 Mo Zn8 -","- C52 H84 Ga2 Mo Zn8 -","- C208 H336 Ga8 Mo4 Zn32 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0925","0.0382","","","0.0818","0.1253","","","","","","0.816","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105282","17.2946","0.0011","17.39","0.002","18.725","0.002","90","","94.516","0.007","90","","5614.1","1","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C52 H84 Ru Zn10 -","- C52 H84 Ru Zn10 -","- C208 H336 Ru4 Zn40 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.158","0.0468","","","0.0839","0.1084","","","","","","0.832","","","","has coordinates,has disorder","178798","2020-10-21","18:00:00",""
"4105283","12.5205","0.0004","23.2905","0.0007","22.5218","0.0008","90","","123.522","0.002","90","","5475.2","0.3","105","2","105","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H72 Ga0 Ru Zn8 -","- C44 H72 Ru Zn8 -","- C176 H288 Ru4 Zn32 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0951","0.0533","","","0.1456","0.1559","","","","","","0.968","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105284","19.584","0.0007","12.5029","0.0005","17.3314","0.0006","90","","90","","90","","4243.7","0.3","113","2","113","2","","","","","","","","3","P m c 21","P 2c -2","26","","","","- C36 Rh Zn9 -","- C36 Rh Zn9 -","- C144 Rh4 Zn36 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0854","0.0399","","","0.0927","0.1402","","","","","","0.916","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105285","16.9525","0.0007","16.583","0.0004","23.4379","0.0009","90","","110.783","0.004","90","","6160.2","0.4","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H72 Ga Rh Zn7 -","- C44 H72 Ga Rh Zn7 -","- C176 H288 Ga4 Rh4 Zn28 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.072","0.0383","","","0.1055","0.11","","","","","","0.882","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105286","29.9453","0.0013","20.8547","0.0006","22.1767","0.0007","90","","126.644","0.003","90","","11112.2","0.8","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H72 F0 Ni Zn8 -","- C44 H72 Ni Zn8 -","- C352 H576 Ni8 Zn64 -","8","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0819","0.0372","","","0.0907","0.1001","","","","","","0.78","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105287","12.6106","0.0003","23.3762","0.0009","18.9914","0.0007","90","","93.411","0.003","90","","5588.5","0.3","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H72 Ga0 Pd Zn8 -","- C44 H72 Pd Zn8 -","- C176 H288 Pd4 Zn32 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0709","0.0433","","","0.1248","0.141","","","","","","0.939","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105288","12.5896","0.0012","23.1888","0.0008","19.066","0.004","90","","93.262","0.011","90","","5557.1","1.3","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H69 Ga0 Pt Zn8 -","- C44 H69 Pt Zn8 -","- C176 H276 Pt4 Zn32 -","4","1","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0787","0.0455","","","0.1266","0.1384","","","","","","0.994","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105289","17.2256","0.0003","17.7766","0.0003","18.5676","0.0003","90","","90","","90","","5685.63","0.17","113","2","113","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C52 H90 O Pt Zn8 -","- C52 H90 O Pt Zn8 -","- C208 H360 O4 Pt4 Zn32 -","4","0.5","","Thomas Cadenbach; Timo Bollermann; Christian Gemel; Mustafa Tombul; Israel Fernandez; Moritz von Hopffgarten; Gernot Frenking; Roland A. Fischer","Molecular Alloys, Linking Organometallics with Intermetallic Hume-Rothery Phases: The Highly Coordinated Transition Metal Compounds [M(ZnR)n] (n >= 8) Containing Organo-Zinc Ligands","Journal of the American Chemical Society","2009","131","","16063","16077","10.1021/ja904061w","","","0.71073","MoKα","","0.0435","0.0234","","","0.0532","0.057","","","","","","0.949","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105290","15.0956","0.0011","27.0921","0.0019","25.7271","0.0018","90","","106.834","0.002","90","","10070.8","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H61 Mo6 N1.5 O25 P0.5 Zn2 -","- C32 H4 Mo6 N1.5 O24 P0.5 Zn2 -","- C256 H32 Mo48 N12 O192 P4 Zn16 -","8","1","","L. Marleny Rodriguez-Albelo; A. Rabdel Ruiz-Salvador; Alvaro Sampieri; Dewi W. Lewis; Ariel Gómez; Brigitte Nohra; Pierre Mialane; Jérôme Marrot; Francis Sécheresse; Caroline Mellot-Draznieks; Rosa Ngo Biboum; Bineta Keita; Louis Nadjo; Anne Dolbecq","Zeolitic Polyoxometalate-Based Metal-Organic Frameworks (Z-POMOFs): Computational Evaluation of Hypothetical Polymorphs and the Successful Targeted Synthesis of the Redox-Active Z-POMOF1","Journal of the American Chemical Society","2009","131","","16078","16087","10.1021/ja905009e","","","0.71073","MoKα","","0.1024","0.0618","","","0.1303","0.1457","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105291","5.7817","0.001","5.7817","","5.7817","","90","","90","","90","","193.27","0.03","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Cu0.5 In0.5 Se -","- Cu0.5 In0.5 Se -","- Cu2 In2 Se4 -","4","0.0416667","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.12991","","10.01","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4105292","5.7937","0.0025","5.7937","","11.554","0.008","90","","90","","90","","387.8","0.3","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu In Se2 -","- Cu In Se2 -","- Cu4 In4 Se8 -","4","0.25","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.2789","","8.68","","","","","","","has coordinates,has Fobs","178798","2020-10-21","18:00:00",""
"4105293","5.7886","0.0005","5.7886","","5.7886","","90","","90","","90","","193.964","0.017","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Cu In Se -","- Cu In Se -","- Cu4 In4 Se4 -","4","0.0416667","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.21111","","18.52","","","","","","","has coordinates,has Fobs","178798","2020-10-21","18:00:00",""
"4105294","5.7852","0.0013","5.7852","","11.5964","0.0016","90","","90","","90","","388.11","0.1","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu In Se2 -","- Cu In Se2 -","- Cu4 In4 Se8 -","4","0.25","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.26008","","14.14","","","","","","","has coordinates,has Fobs","178798","2020-10-21","18:00:00",""
"4105295","6.9986","0.0004","6.9986","","7.1357","0.0006","90","","90","","120","","302.68","0.03","","","","","","","","","","","","2","P 63 c m","P 6c -2","185","","","","- Cu3 P -","- Cu3 P -","- Cu18 P6 -","6","0.5","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.47963","","25.52","","","","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105296","6.469","0.007","6.469","","4.203","0.005","90","","90","","90","","175.9","0.3","","","","","","","","","","","","2","P -4 21 m","P -4 2ab","113","","","","- Cu3 Se2 -","- Cu3 Se2 -","- Cu6 Se4 -","2","0.25","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.21824","","6.35","","","","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105297","6.66","0.05","6.66","","4.102","0.012","90","","90","","90","","181.9","1.5","","","","","","","","","","","","2","P -4 21 m","P -4 2ab","113","","","","- Cu3 Se2 -","- Cu3 Se2 -","- Cu6 Se4 -","2","0.25","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.05031","","8.35","","","","","","","has coordinates,has Fobs","178798","2020-10-21","18:00:00",""
"4105298","5.0252","0.0009","6.1941","0.0011","3.7447","0.0007","90","","90","","90","","116.56","0.04","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Cu Se2 -","- Cu Se2 -","- Cu2 Se4 -","2","0.25","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.34194","","16.26","","","","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105299","8.5116","0.0006","8.534","0.0006","11.9392","0.001","75.976","0.003","82.396","0.003","74.39","0.004","808.26","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H21 N O4 S -","- C16 H21 N O4 S -","- C32 H42 N2 O8 S2 -","2","1","","Vanessa M. Williams; Jong Rock Kong; Byoung Joon Ko; Yogita Mantri; Jennifer S. Brodbelt; Mu-Hyun Baik; Michael J. Krische","ESI-MS, DFT, and Synthetic Studies on the H2-Mediated Coupling of Acetylene: Insertion of C=X Bonds into Rhodacyclopentadienes and Brønsted Acid Cocatalyzed Hydrogenolysis of Organorhodium Intermediates","Journal of the American Chemical Society","2009","131","","16054","16062","10.1021/ja906225n","","","0.71073","MoKα","","0.1399","0.1255","","","0.2089","0.2114","","","","","","3.102","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4105300","20.398","0.0001","20.398","0.0001","20.398","0.0001","90","","90","","90","","8487.17","0.07","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C36 H12 In3 N2.5 O24 -","- C36 H12 In3 O24 -","- C144 H48 In12 O96 -","4","0.0833333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","0.0432","0.042","","","0.1361","0.1372","","","","","","1.145","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105301","29.1453","0.0001","29.1453","0.0001","16.991","0.0002","90","","90","","120","","12499.3","0.16","293","2","293","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C72 H96 In3 N3 O24 -","- C72 H96 In3 N3 O24 -","- C432 H576 In18 N18 O144 -","6","0.333333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","","0.0307","","","0.0755","0.0771","","","","","","1.013","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105302","29.155","0.002","29.155","0.002","17.367","0.003","90","","90","","120","","12784","3","293","2","293","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C84 H117 In3 N3 O24 -","- C84 H117 In3 N3 O24 -","- C504 H702 In18 N18 O144 -","6","0.333333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","0.0732","0.0584","","","0.1289","0.147","","","","","","1.052","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105303","20.431","0.0001","20.431","0.0001","20.431","0.0001","90","","90","","90","","8528.43","0.07","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C36 H12 In3 N0 O24 -","- C36 H12 In3 O24 -","- C144 H48 In12 O96 -","4","0.0833333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","0.0638","0.0547","","","0.1632","0.1663","","","","","","1.13","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105304","20.4639","0.0001","20.4639","0.0001","20.4639","0.0001","90","","90","","90","","8569.69","0.07","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C54 H60 In3 N3 O33 -","- C54 In3 N3 O33 -","- C216 In12 N12 O132 -","4","0.0833333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","0.0716","0.059","","","0.1676","0.173","","","","","","1.113","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105305","20.4029","0.0008","20.4029","0.0008","20.4029","0.0008","90","","90","","90","","8493.3","0.6","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C36 H12 In3 N0 O24 -","- C36 H12 In3 O24 -","- C144 H48 In12 O96 -","4","0.0833333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","0.0576","0.0482","","","0.1398","0.1481","","","","","","1.073","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105306","20.3878","0.0004","20.3878","0.0004","20.3878","0.0004","90","","90","","90","","8474.4","0.3","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C36 H0 In3 N0 O24 -","- C36 In3 O24 -","- C144 In12 O96 -","4","0.0833333","","Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu","Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties","Journal of the American Chemical Society","2009","131","","16027","16029","10.1021/ja906302t","","","0.71073","MoKα","","0.0405","0.0385","","","0.136","0.1369","","","","","","1.323","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105307","11.4455","0.0007","14.181","0.0008","16.6488","0.001","77.11","0.001","74.535","0.001","66.732","0.001","2371.3","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","Molybdenum AsP2","","","- C43.98 H58.03 As Mo N3 O5 P2 W -","- C43.982 H58.036 As Mo N3 O5 P2 W -","- C87.964 H116.072 As2 Mo2 N6 O10 P4 W2 -","2","1","","Heather A. Spinney; Nicholas A. Piro; Christopher C. Cummins","Triple-Bond Reactivity of an AsP Complex Intermediate: Synthesis Stemming from Molecular Arsenic, As4","Journal of the American Chemical Society","2009","131","","16233","16243","10.1021/ja906550h","","","0.71073","MoKα","","0.039","0.0283","","","0.0607","0.0652","","","","","","1.032","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105308","11.749","0.0005","16.47","0.0007","17.3444","0.0007","69.876","0.001","78.401","0.001","87.067","0.001","3086.4","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","(Mes*NPAs)Nb(N[Np]Ar)3","","","- C61 H99 As N4 Nb O P -","- C61 H99 As N4 Nb O P -","- C122 H198 As2 N8 Nb2 O2 P2 -","2","1","","Heather A. Spinney; Nicholas A. Piro; Christopher C. Cummins","Triple-Bond Reactivity of an AsP Complex Intermediate: Synthesis Stemming from Molecular Arsenic, As4","Journal of the American Chemical Society","2009","131","","16233","16243","10.1021/ja906550h","","","0.71073","MoKα","","0.0667","0.0413","","","0.0939","0.1033","","","","","","1.012","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105309","13.8402","0.0016","9.094","0.001","15.3767","0.0017","90","","109.567","0.002","90","","1823.6","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","AsPW(CO)5 Cyclohexadiene Trap","","","- C17 H16 As O5 P W -","- C17 H16 As O5 P W -","- C68 H64 As4 O20 P4 W4 -","4","1","","Heather A. Spinney; Nicholas A. Piro; Christopher C. Cummins","Triple-Bond Reactivity of an AsP Complex Intermediate: Synthesis Stemming from Molecular Arsenic, As4","Journal of the American Chemical Society","2009","131","","16233","16243","10.1021/ja906550h","","","0.71073","MoKα","","0.0178","0.0155","","","0.0351","0.0362","","","","","","1.051","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105310","15.411","0.007","7.065","0.003","18.782","0.009","90","","102.912","0.008","90","","1993.3","1.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","AsPW(CO)5 Butadiene trap","","","- C17 H20 As O5 P W -","- C17 H20 As O5 P W -","- C68 H80 As4 O20 P4 W4 -","4","1","","Heather A. Spinney; Nicholas A. Piro; Christopher C. Cummins","Triple-Bond Reactivity of an AsP Complex Intermediate: Synthesis Stemming from Molecular Arsenic, As4","Journal of the American Chemical Society","2009","131","","16233","16243","10.1021/ja906550h","","","0.71073","MoKα","","0.0273","0.021","","","0.0518","0.0551","","","","","","1.057","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105311","13.998","0.003","25.218","0.005","19.476","0.004","90","","95.353","0.004","90","","6845","2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","niobium arsenide anion","","","- C63 H112 As N3 Na Nb O10 -","- C63 H112 As N3 Na Nb O10 -","- C252 H448 As4 N12 Na4 Nb4 O40 -","4","1","","Heather A. Spinney; Nicholas A. Piro; Christopher C. Cummins","Triple-Bond Reactivity of an AsP Complex Intermediate: Synthesis Stemming from Molecular Arsenic, As4","Journal of the American Chemical Society","2009","131","","16233","16243","10.1021/ja906550h","","","0.71073","MoKα","","0.0743","0.0414","","","0.0908","0.1055","","","","","","1.029","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105312","20.6006","0.001","11.2495","0.0005","22.3478","0.001","90","","115.889","0.001","90","","4659.3","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45.5 H74 As N3 Na Nb O -","- C45.504 H74.008 As N3 Na Nb O1.001 -","- C182.016 H296.032 As4 N12 Na4 Nb4 O4.004 -","4","1","","Heather A. Spinney; Nicholas A. Piro; Christopher C. Cummins","Triple-Bond Reactivity of an AsP Complex Intermediate: Synthesis Stemming from Molecular Arsenic, As4","Journal of the American Chemical Society","2009","131","","16233","16243","10.1021/ja906550h","","","0.71073","MoKα","","0.0492","0.0344","","","0.0803","0.0886","","","","","","1.037","","","","has coordinates,has disorder","286259","2023-09-07","06:02:01",""
"4105313","10.5271","0.0009","13.3224","0.0009","15.1121","0.0013","90","","109.569","0.006","90","","1997","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 B Fe Li O2 -","- C18 H32 B Fe Li O2 -","- C72 H128 B4 Fe4 Li4 O8 -","4","1","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.0574","0.0454","","","0.1214","0.1262","","","","","","1.072","","","","has coordinates","264764","2021-05-03","08:11:06",""
"4105314","11.1642","0.0013","11.4223","0.0014","11.9409","0.0015","73.147","0.01","81.396","0.01","87.087","0.01","1440.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 B Fe Li O -","- C14 H22 B Fe Li O -","- C56 H88 B4 Fe4 Li4 O4 -","4","2","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.065","0.0344","","","0.0662","0.0722","","","","","","0.857","","","","has coordinates","264764","2021-05-03","08:11:06",""
"4105315","14.798","0.003","15.367","0.003","17.476","0.004","103.324","0.016","92.741","0.016","99.274","0.016","3801.6","1.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C41.33 H81.33 B4 Fe2 Li4 O5.33 -","- C41.3333 H81.3333 B4 Fe2 Li4 O5.33333 -","- C124 H244 B12 Fe6 Li12 O16 -","3","1.5","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.1554","0.0535","","","0.079","0.1018","","","","","","0.667","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105316","16.2127","0.0018","5.8859","0.0009","25.442","0.003","90","","90","","90","","2427.8","0.5","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C12 H17 B Fe S -","- C12 H17 B Fe S -","- C96 H136 B8 Fe8 S8 -","8","2","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.084","0.0436","","","0.0905","0.101","","","","","","0.787","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105317","5.944","0.002","9.561","0.003","9.609","0.003","113.82","0.02","97.85","0.03","92.99","0.03","491.4","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H34 B2 Fe N2 -","- C18 H34 B2 Fe N2 -","- C18 H34 B2 Fe N2 -","1","0.5","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.1506","0.1251","","","0.3335","0.3527","","","","","","1.237","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105318","7.4731","0.0011","29.742","0.005","9.3452","0.0018","90","","90.12","0.014","90","","2077.1","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H29 B Fe2 -","- C26 H29 B Fe2 -","- C104 H116 B4 Fe8 -","4","1","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.1359","0.0652","","","0.1323","0.1544","","","","","","0.811","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105319","12.778","0.003","12.778","0.003","6.697","0.0014","90","","90","","120","","947","0.4","173","2","173","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C18 H33 B -","- C18 H33 B -","- C36 H66 B2 -","2","0.166667","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.1477","0.1134","","","0.3059","0.3449","","","","","","1.075","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105320","7.675","0.0006","10.6775","0.0006","27.069","0.002","90","","96.613","0.006","90","","2203.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 B Fe2 -","- C28 H25 B Fe2 -","- C112 H100 B4 Fe8 -","4","1","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.0643","0.0495","","","0.1203","0.1259","","","","","","1.125","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105321","7.3279","0.0004","10.6551","0.0004","27.7377","0.0016","90","","91.604","0.005","90","","2164.9","0.19","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H29 B Fe2 -","- C26 H29 B Fe2 -","- C104 H116 B4 Fe8 -","4","1","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.0307","0.0287","","","0.0603","0.0624","","","","","","1.066","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105322","20.701","0.005","43.699","0.011","8.231","0.002","90","","90","","90","","7446","3","90","2","90","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C48 H52 Ge -","- C48 H52 Ge -","- C384 H416 Ge8 -","8","0.5","","Yang Peng; Jing-Dong Guo; Bobby D. Ellis; Zhongliang Zhu; James C. Fettinger; Shigeru Nagase; Philip P. Power","Reaction of Hydrogen or Ammonia with Unsaturated Germanium or Tin Molecules under Ambient Conditions: Oxidative Addition versus Arene Elimination","Journal of the American Chemical Society","2009","131","","16272","16282","10.1021/ja9068408","","","0.71073","MoKα","","0.0673","0.0462","","","0.1017","0.1118","","","","","","1.009","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105323","8.5642","0.001","21.275","0.003","23.86","0.003","90","","89.973","0.002","90","","4347.4","1","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C55 H61 Ge N -","- C55 H61 Ge N -","- C220 H244 Ge4 N4 -","4","1","","Yang Peng; Jing-Dong Guo; Bobby D. Ellis; Zhongliang Zhu; James C. Fettinger; Shigeru Nagase; Philip P. Power","Reaction of Hydrogen or Ammonia with Unsaturated Germanium or Tin Molecules under Ambient Conditions: Oxidative Addition versus Arene Elimination","Journal of the American Chemical Society","2009","131","","16272","16282","10.1021/ja9068408","","","0.71073","MoKα","","0.0333","0.0308","","","0.0804","0.0818","","","","","","1.03","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105324","13.581","0.002","35.514","0.006","11.6831","0.0019","90","","99.55","0.003","90","","5556.8","1.5","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C67 H85 Ge N -","- C67 H85 Ge N -","- C268 H340 Ge4 N4 -","4","0.5","","Yang Peng; Jing-Dong Guo; Bobby D. Ellis; Zhongliang Zhu; James C. Fettinger; Shigeru Nagase; Philip P. Power","Reaction of Hydrogen or Ammonia with Unsaturated Germanium or Tin Molecules under Ambient Conditions: Oxidative Addition versus Arene Elimination","Journal of the American Chemical Society","2009","131","","16272","16282","10.1021/ja9068408","","","0.71069","MoKα","","0.1275","0.0746","","","0.124","0.1381","","","","","","1.037","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105325","8.6345","0.0012","12.8195","0.0018","21.717","0.003","102.628","0.0019","95.034","0.002","93.0434","0.0019","2330.2","0.6","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C55 H62 N2 Sn2 -","- C55 H62 N2 Sn2 -","- C110 H124 N4 Sn4 -","2","1","","Yang Peng; Jing-Dong Guo; Bobby D. Ellis; Zhongliang Zhu; James C. Fettinger; Shigeru Nagase; Philip P. Power","Reaction of Hydrogen or Ammonia with Unsaturated Germanium or Tin Molecules under Ambient Conditions: Oxidative Addition versus Arene Elimination","Journal of the American Chemical Society","2009","131","","16272","16282","10.1021/ja9068408","","","0.71073","MoKα","","0.0429","0.0325","","","0.0838","0.087","","","","","","1.066","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105326","5.3337","0.0003","8.4781","0.0005","10.0357","0.0006","90","","99.05","0.006","90","","448.16","0.05","295","1","295","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H15 N O -","- C9 H15 N O -","- C18 H30 N2 O2 -","2","1","","William J. Nodes; David R. Nutt; Ann M. Chippindale; Alexander J. A. Cobb","Enantioselective Intramolecular Michael Addition of Nitronates onto Conjugated Esters: Access to Cyclic γ-Amino Acids with up to Three Stereocenters","Journal of the American Chemical Society","2009","131","","16016","16017","10.1021/ja9070915","","","1.5418","CuKα","","0.0341","0.0321","","0.0377","0.0376","0.0376","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105327","14.5595","0.0015","12.4587","0.0013","15.6241","0.0017","90","","97.105","0.003","90","","2812.3","0.5","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C51 H86 N6 O11 -","- C51 H86 N6 O11 -","- C102 H172 N12 O22 -","2","1","","Li Guo; Yonggui Chi; Aaron M. Almeida; Ilia A. Guzei; Brian K. Parker; Samuel H. Gellman","Stereospecific Synthesis of Conformationally Constrained γ-Amino Acids: New Foldamer Building Blocks That Support Helical Secondary Structure","Journal of the American Chemical Society","2009","131","","16018","16020","10.1021/ja907233q","","","1.54178","Cu-Kα","","0.0445","0.0419","","","0.1049","0.107","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105328","10.77","0.003","17.053","0.005","11.738","0.004","90","","99.878","0.019","90","","2123.9","1.1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C44 H64 N4 O7 -","- C44 H64 N4 O7 -","- C88 H128 N8 O14 -","2","1","","Li Guo; Yonggui Chi; Aaron M. Almeida; Ilia A. Guzei; Brian K. Parker; Samuel H. Gellman","Stereospecific Synthesis of Conformationally Constrained γ-Amino Acids: New Foldamer Building Blocks That Support Helical Secondary Structure","Journal of the American Chemical Society","2009","131","","16018","16020","10.1021/ja907233q","","","1.54178","Cu-Kα","","0.0272","0.027","","","0.0706","0.0708","","","","","","1.038","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4105329","6.9458","0.0014","6.5551","0.0013","9.955","0.002","90","","90.42","0.003","90","","453.24","0.16","173","2","173","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- K4 P8 Te4 -","- K4 P8 Te4 -","- K4 P8 Te4 -","1","0.25","","In Chung; Jung-Hwan Song; Myung Gil Kim; Christos D. Malliakas; Angela L. Karst; Arthur J. Freeman; David P. Weliky; Mercouri G. Kanatzidis","The Tellurophosphate K4P8Te4: Phase-Change Properties, Exfoliation, Photoluminescence in Solution and Nanospheres","Journal of the American Chemical Society","2009","131","","16303","16312","10.1021/ja907273g","","","0.71073","MoKα","","0.056","0.0397","","","0.0889","0.0958","","","","","","1.099","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105330","14.485","0.003","19.552","0.004","29.126","0.006","90","","90","","90","","8249","3","153.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C75 H110 N2 O32 -","- C75 H110 N2 O32 -","- C300 H440 N8 O128 -","4","1","","Jun Terao; Susumu Tsuda; Yuji Tanaka; Kento Okoshi; Tetsuaki Fujihara; Yasushi Tsuji; Nobuaki Kambe","Synthesis of Organic-Soluble Conjugated Polyrotaxanes by Polymerization of Linked Rotaxanes","Journal of the American Chemical Society","2009","131","","16004","16005","10.1021/ja9074437","","","0.7107","MoKα","","","0.103","","","","0.2319","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105331","10.681","0.002","15.35","0.003","18.887","0.004","90","","92.59","0.03","90","","3093.4","1.1","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","6-KetoDipp-Triflate","","","- C31 H41 F3 N2 O5 S -","- C31 H41 F3 N2 O5 S -","- C124 H164 F12 N8 O20 S4 -","4","1","","Todd W. Hudnall; Christopher W. Bielawski","An N,N'-Diamidocarbene: Studies in C-H Insertion, Reversible Carbonylation, and Transition-Metal Coordination Chemistry","Journal of the American Chemical Society","2009","131","","16039","16041","10.1021/ja907481w","","","0.71073","MoKα","","0.0987","0.0666","","","0.142","0.171","","","","","","1.009","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105332","15.726","0.003","9.803","0.002","17.111","0.003","90","","90","","90","","2637.9","0.9","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","6-KetoDipp-carbene","","","- C30 H40 N2 O2 -","- C30 H40 N2 O2 -","- C120 H160 N8 O8 -","4","1","","Todd W. Hudnall; Christopher W. Bielawski","An N,N'-Diamidocarbene: Studies in C-H Insertion, Reversible Carbonylation, and Transition-Metal Coordination Chemistry","Journal of the American Chemical Society","2009","131","","16039","16041","10.1021/ja907481w","","","0.71073","MoKα","","0.0475","0.0385","","","0.0897","0.1024","","","","","","1.005","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105333","10.617","0.002","11.695","0.002","16.402","0.003","82.83","0.03","87.57","0.03","79.23","0.03","1984.7","0.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","6-KetoDipp-Ketene","","","- C37 H58 N3 Na O3 Si2 -","- C37 H58 N3 Na O3 Si2 -","- C74 H116 N6 Na2 O6 Si4 -","2","1","","Todd W. Hudnall; Christopher W. Bielawski","An N,N'-Diamidocarbene: Studies in C-H Insertion, Reversible Carbonylation, and Transition-Metal Coordination Chemistry","Journal of the American Chemical Society","2009","131","","16039","16041","10.1021/ja907481w","","","0.71073","MoKα","","0.2894","0.1038","","","0.1437","0.2015","","","","","","1.028","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105334","16.468","0.003","19.084","0.004","11.224","0.002","90","","90","","90","","3527.4","1.2","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","6-KetoDipp-Ir(COD)Cl","","","- C38 H52 Cl Ir N2 O2 -","- C38 H52 Cl Ir N2 O2 -","- C152 H208 Cl4 Ir4 N8 O8 -","4","0.5","","Todd W. Hudnall; Christopher W. Bielawski","An N,N'-Diamidocarbene: Studies in C-H Insertion, Reversible Carbonylation, and Transition-Metal Coordination Chemistry","Journal of the American Chemical Society","2009","131","","16039","16041","10.1021/ja907481w","","","0.71073","MoKα","","0.0438","0.0257","","","0.0714","0.1083","","","","","","1.005","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105335","10.0543","0.0003","26.7727","0.0008","16.572","0.0005","90","","103.799","0.001","90","","4332.1","0.2","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H68 N3 O2 Si2 Y -","- C38 H68 N3 O2 Si2 Y -","- C152 H272 N12 O8 Si8 Y4 -","4","1","","John W. Kramer; Daniel S. Treitler; Erin W. Dunn; Pascal M. Castro; Thierry Roisnel; Christophe M. Thomas; Geoffrey W. Coates","Polymerization of Enantiopure Monomers Using Syndiospecific Catalysts: A New Approach To Sequence Control in Polymer Synthesis","Journal of the American Chemical Society","2009","131","","16042","16044","10.1021/ja9075327","","x-ray","0.71073","MoKα","","0.0653","0.0409","","","0.0901","0.0982","","","","","","1.031","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105336","9.9384","0.0005","14.0259","0.0009","16.6178","0.0012","104.902","0.003","98.051","0.003","100.395","0.003","2159","0.2","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C86 H150 N4 O6 Y2 -","- C86 H150 N4 O6 Y2 -","- C86 H150 N4 O6 Y2 -","1","0.5","","John W. Kramer; Daniel S. Treitler; Erin W. Dunn; Pascal M. Castro; Thierry Roisnel; Christophe M. Thomas; Geoffrey W. Coates","Polymerization of Enantiopure Monomers Using Syndiospecific Catalysts: A New Approach To Sequence Control in Polymer Synthesis","Journal of the American Chemical Society","2009","131","","16042","16044","10.1021/ja9075327","","x-ray","0.71073","MoKα","","0.0924","0.0574","","","0.1189","0.131","","","","","","0.975","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105337","16.09457","0.00026","16.09457","","3.98958","0.00008","90","","90","","90","","1033.44","0.03","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","ClBPSSEt","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Masaki Mito; Yuki Komorida; Hideki Tsuruda; John S. Tse; Serge Desgreniers; Yauso Ohishi; Alicea A. Leitch; Kristina Cvrkalj; Craig M. Robertson; Richard T. Oakley","Heavy Atom Ferromagnets under Pressure: Structural Changes and the Magnetic Response","Journal of the American Chemical Society","2009","131","","16012","16013","10.1021/ja908238w","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.18414","","","","","","","","","has coordinates,has Fobs","178799","2020-10-21","18:00:00",""
"4105338","16.07661","0.00018","16.07661","","3.94232","0.00006","90","","90","","90","","1018.92","0.019","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","ClBPSSEt","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Masaki Mito; Yuki Komorida; Hideki Tsuruda; John S. Tse; Serge Desgreniers; Yauso Ohishi; Alicea A. Leitch; Kristina Cvrkalj; Craig M. Robertson; Richard T. Oakley","Heavy Atom Ferromagnets under Pressure: Structural Changes and the Magnetic Response","Journal of the American Chemical Society","2009","131","","16012","16013","10.1021/ja908238w","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.12574","","","","","","","","","has coordinates,has Fobs","178799","2020-10-21","18:00:00",""
"4105339","15.90088","0.00027","15.90088","","3.80246","0.00008","90","","90","","90","","961.41","0.03","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","ClBPSSEt","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Masaki Mito; Yuki Komorida; Hideki Tsuruda; John S. Tse; Serge Desgreniers; Yauso Ohishi; Alicea A. Leitch; Kristina Cvrkalj; Craig M. Robertson; Richard T. Oakley","Heavy Atom Ferromagnets under Pressure: Structural Changes and the Magnetic Response","Journal of the American Chemical Society","2009","131","","16012","16013","10.1021/ja908238w","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.09667","","","","","","","","","has coordinates,has Fobs","178799","2020-10-21","18:00:00",""
"4105340","15.83767","0.00024","15.83767","","3.73814","0.00007","90","","90","","90","","937.64","0.02","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","ClBPSSEt","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Masaki Mito; Yuki Komorida; Hideki Tsuruda; John S. Tse; Serge Desgreniers; Yauso Ohishi; Alicea A. Leitch; Kristina Cvrkalj; Craig M. Robertson; Richard T. Oakley","Heavy Atom Ferromagnets under Pressure: Structural Changes and the Magnetic Response","Journal of the American Chemical Society","2009","131","","16012","16013","10.1021/ja908238w","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.08648","","","","","","","","","has coordinates,has Fobs","178799","2020-10-21","18:00:00",""
"4105341","15.78087","0.00028","15.78087","","3.6909","0.00008","90","","90","","90","","919.17","0.03","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","ClBPSSEt","","","- C7 H5 Cl N3 Se4 -","- C7 H5 Cl N3 Se4 -","- C28 H20 Cl4 N12 Se16 -","4","0.5","","Masaki Mito; Yuki Komorida; Hideki Tsuruda; John S. Tse; Serge Desgreniers; Yauso Ohishi; Alicea A. Leitch; Kristina Cvrkalj; Craig M. Robertson; Richard T. Oakley","Heavy Atom Ferromagnets under Pressure: Structural Changes and the Magnetic Response","Journal of the American Chemical Society","2009","131","","16012","16013","10.1021/ja908238w","powder diffraction","x-ray","0.51446","synchrotron","","","","","","","","0.07402","","","","","","","","","has coordinates,has Fobs","178799","2020-10-21","18:00:00",""
"4105342","10.1169","0.0002","14.662","0.0003","21.1692","0.0005","90","","90","","90","","3140.11","0.12","153","2","153","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H18 O5 -","- C18 H18 O5 -","- C144 H144 O40 -","8","1","","Philip Magnus; Neeraj Sane; Benjamin P. Fauber; Vince Lynch","Concise Syntheses of (-)-Galanthamine and (\±)-Codeine via Intramolecular Alkylation of a Phenol Derivative","Journal of the American Chemical Society","2009","131","","16045","16047","10.1021/ja9085534","","","0.71073","MoKα","","0.0793","0.048","","","0.1134","0.1307","","","","","","0.988","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105343","9.6329","0.0002","20.8917","0.0006","7.191","0.0003","90","","109.168","0.0013","90","","1366.94","0.08","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 O6 -","- C16 H15.94 O6 -","- C64 H63.76 O24 -","4","1","","Philip Magnus; Neeraj Sane; Benjamin P. Fauber; Vince Lynch","Concise Syntheses of (-)-Galanthamine and (\±)-Codeine via Intramolecular Alkylation of a Phenol Derivative","Journal of the American Chemical Society","2009","131","","16045","16047","10.1021/ja9085534","","","0.71073","MoKα","","0.064","0.042","","","0.0927","0.1028","","","","","","1.032","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105344","27.2222","0.0004","6.6121","0.0001","19.9706","0.0005","90","","105.697","0.001","90","","3460.57","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 B N2 O4 -","- C18 H23 B N2 O4 -","- C144 H184 B8 N16 O32 -","8","2","","Philip Magnus; Neeraj Sane; Benjamin P. Fauber; Vince Lynch","Concise Syntheses of (-)-Galanthamine and (\±)-Codeine via Intramolecular Alkylation of a Phenol Derivative","Journal of the American Chemical Society","2009","131","","16045","16047","10.1021/ja9085534","","","1.54187","CuKα","","0.2992","0.1482","","","0.1543","0.2138","","","","","","1.753","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105345","8.4748","0.0002","18.2912","0.0004","11.1855","0.0003","90","","95.346","0.0009","90","","1726.37","0.07","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N O6 -","- C19 H19 N O6 -","- C76 H76 N4 O24 -","4","1","","Philip Magnus; Neeraj Sane; Benjamin P. Fauber; Vince Lynch","Concise Syntheses of (-)-Galanthamine and (\±)-Codeine via Intramolecular Alkylation of a Phenol Derivative","Journal of the American Chemical Society","2009","131","","16045","16047","10.1021/ja9085534","","","0.71073","MoKα","","0.0737","0.0445","","","0.1018","0.1162","","","","","","0.997","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105346","8.7189","0.0002","9.8011","0.0003","11.0087","0.0003","106.745","0.001","92.89","0.001","109.487","0.001","837.99","0.04","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H21 N O6 -","- C19 H21 N O6 -","- C38 H42 N2 O12 -","2","1","","Philip Magnus; Neeraj Sane; Benjamin P. Fauber; Vince Lynch","Concise Syntheses of (-)-Galanthamine and (\±)-Codeine via Intramolecular Alkylation of a Phenol Derivative","Journal of the American Chemical Society","2009","131","","16045","16047","10.1021/ja9085534","","","0.71073","MoKα","","0.0578","0.0386","","","0.0903","0.102","","","","","","1.011","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105347","5.7876","0.001","5.7876","","11.6045","0.0014","90","","90","","90","","388.71","0.08","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","","","- Cu In Se2 -","- Cu In Se2 -","- Cu4 In4 Se8 -","4","0.25","","Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth","Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors","Journal of the American Chemical Society","2009","131","","16177","16188","10.1021/ja905730n","powder diffraction","x-ray","1.54051","Kα~1~","","","","","","","","0.05031","","8.35","","","","","","","has coordinates,has Fobs","178799","2020-10-21","18:00:00",""
"4105348","18.5035","0.0005","22.3371","0.0006","23.7134","0.0007","90","","90","","90","","9801.1","0.5","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 21 21 21","P 2ac 2ab","19","","","","- C60 H48 Cl16 N4 O18 Rh2 -","- C60 H48 Cl16 N4 O18 Rh2 -","- C240 H192 Cl64 N16 O72 Rh8 -","4","1","","Vincent N. G. Lindsay; Wei Lin; André B. Charette","Experimental Evidence for the All-Up Reactive Conformation of Chiral Rhodium(II) Carboxylate Catalysts: Enantioselective Synthesis of cis-Cyclopropane α-Amino Acids","Journal of the American Chemical Society","2009","131","","16383","16385","10.1021/ja9044955","","","1.54178","CuKα","","0.0841","0.0713","","","0.2063","0.2189","","","","","","1.044","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105349","8.1895","0.0014","5.7464","0.0009","16.269","0.003","90","","97.801","0.005","90","","758.5","0.2","150","","150","","","","","","","","Synthesized by the authors. See text","4","P 1 21 1","P 2yb","4","","","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C34 H30 N2 O8 -","2","1","","Vincent N. G. Lindsay; Wei Lin; André B. Charette","Experimental Evidence for the All-Up Reactive Conformation of Chiral Rhodium(II) Carboxylate Catalysts: Enantioselective Synthesis of cis-Cyclopropane α-Amino Acids","Journal of the American Chemical Society","2009","131","","16383","16385","10.1021/ja9044955","","","1.54178","CuKα","","0.0914","0.0535","","","0.1166","0.1303","","","","","","1.14","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105350","19.177","0.0003","22.7929","0.0003","23.4525","0.0003","90","","90","","90","","10251.1","0.2","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 21 21 21","P 2ac 2ab","19","","","","- C56 H42 Br16 N4 O18 Rh2 -","- C56 H42 Br16 N4 O18 Rh2 -","- C224 H168 Br64 N16 O72 Rh8 -","4","1","","Vincent N. G. Lindsay; Wei Lin; André B. Charette","Experimental Evidence for the All-Up Reactive Conformation of Chiral Rhodium(II) Carboxylate Catalysts: Enantioselective Synthesis of cis-Cyclopropane α-Amino Acids","Journal of the American Chemical Society","2009","131","","16383","16385","10.1021/ja9044955","","","1.54178","CuKα","","0.0559","0.0381","","","0.0812","0.0839","","","","","","1.028","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4105351","16.0549","0.0019","21.667","0.003","18.052","0.002","90","","92.792","0.003","90","","6272.1","1.3","200","2","200","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C60 H64 N4 O20 Rh2 -","- C60 H64 N4 O20 Rh2 -","- C240 H256 N16 O80 Rh8 -","4","2","","Vincent N. G. Lindsay; Wei Lin; André B. Charette","Experimental Evidence for the All-Up Reactive Conformation of Chiral Rhodium(II) Carboxylate Catalysts: Enantioselective Synthesis of cis-Cyclopropane α-Amino Acids","Journal of the American Chemical Society","2009","131","","16383","16385","10.1021/ja9044955","","","0.71073","MoKα","","0.0644","0.051","","","0.1352","0.1432","","","","","","1.043","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105352","22.3018","0.0007","22.3018","","21.439","0.0008","90","","90","","90","","10663.1","0.5","150","","150","","","","","","","","Synthesized by the authors. See text","6","P 4 21 2","P 4ab 2ab","90","","","","- C56 H44 Cl16 N4 O18 Rh2 -","- C56 H40 Cl16 N4 O18 Rh2 -","- C224 H160 Cl64 N16 O72 Rh8 -","4","0.5","","Vincent N. G. Lindsay; Wei Lin; André B. Charette","Experimental Evidence for the All-Up Reactive Conformation of Chiral Rhodium(II) Carboxylate Catalysts: Enantioselective Synthesis of cis-Cyclopropane α-Amino Acids","Journal of the American Chemical Society","2009","131","","16383","16385","10.1021/ja9044955","","","1.54178","CuKα","","0.1177","0.0877","","","0.2344","0.2546","","","","","","1.041","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105353","9.0828","0.0018","20.691","0.004","25.599","0.005","90","","90","","90","","4810.9","1.6","93","2","93","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H22 Cl3 N3 Pt -","- C25 H22 Cl3 N3 Pt -","- C200 H176 Cl24 N24 Pt8 -","8","1","","Paul J. Lusby; Peter Müller; Sarah J. Pike; Alexandra M. Z. Slawin","Stimuli-Responsive Reversible Assembly of 2D and 3D Metallosupramolecular Architectures","Journal of the American Chemical Society","2009","131","","16398","16400","10.1021/ja907297z","","","0.71073","MoKα","","0.1012","0.0648","","","0.1437","0.162","","","","","","1.088","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105354","28.995","0.006","11.188","0.002","22.014","0.005","90","","129.933","0.005","90","","5476","2","93","2","93","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H29 N3 O3 Pt S -","- C31 H29 N3 O3 Pt S -","- C248 H232 N24 O24 Pt8 S8 -","8","1","","Paul J. Lusby; Peter Müller; Sarah J. Pike; Alexandra M. Z. Slawin","Stimuli-Responsive Reversible Assembly of 2D and 3D Metallosupramolecular Architectures","Journal of the American Chemical Society","2009","131","","16398","16400","10.1021/ja907297z","","","0.71073","MoKα","","0.11","0.0707","","","0.1651","0.1906","","","","","","1.135","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105355","13.5137","0.0017","13.8563","0.0018","21.01","0.002","97.384","0.007","100.261","0.007","116.076","0.007","3380.6","0.7","93","2","93","2","","","","","","","","7","P -1","-P 1","2","","","","- C113 H95 F24 N17 O10 P4 Pt4 -","- C113 H95 F24 N17 O10 P4 Pt4 -","- C113 H95 F24 N17 O10 P4 Pt4 -","1","0.5","","Paul J. Lusby; Peter Müller; Sarah J. Pike; Alexandra M. Z. Slawin","Stimuli-Responsive Reversible Assembly of 2D and 3D Metallosupramolecular Architectures","Journal of the American Chemical Society","2009","131","","16398","16400","10.1021/ja907297z","","","0.71073","MoKα","","0.0729","0.0673","","","0.1857","0.1944","","","","","","1.046","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105356","12.0825","0.0008","12.0825","0.0008","17.397","0.0011","90","","90","","90","","2539.7","0.3","100","2","100","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C30 H30 N2 O4 -","- C30 H28 N2 O4 -","- C120 H112 N8 O16 -","4","0.5","","Marwan W. Ghosn; Christian Wolf","Chiral Amplification with a Stereodynamic Triaryl Probe: Assignment of the Absolute Configuration and Enantiomeric Excess of Amino Alcohols","Journal of the American Chemical Society","2009","131","","16360","16361","10.1021/ja907741v","","","0.71073","MoKα","","0.0551","0.0484","","","0.1184","0.123","","","","","","1.062","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105357","12.0796","0.0007","12.0796","0.0007","17.3913","0.001","90","","90","","90","","2537.7","0.3","100","2","100","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C30 H30 N2 O4 -","- C30 H30 N2 O4 -","- C120 H120 N8 O16 -","4","0.5","","Marwan W. Ghosn; Christian Wolf","Chiral Amplification with a Stereodynamic Triaryl Probe: Assignment of the Absolute Configuration and Enantiomeric Excess of Amino Alcohols","Journal of the American Chemical Society","2009","131","","16360","16361","10.1021/ja907741v","","","0.71073","MoKα","","0.0351","0.0316","","","0.0784","0.081","","","","","","1.035","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105358","12.3733","0.0013","12.3733","0.0013","17.4603","0.0019","90","","90","","90","","2673.1","0.5","100","2","100","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C32 H34 N2 O4 -","- C32 H34 N2 O4 -","- C128 H136 N8 O16 -","4","0.5","","Marwan W. Ghosn; Christian Wolf","Chiral Amplification with a Stereodynamic Triaryl Probe: Assignment of the Absolute Configuration and Enantiomeric Excess of Amino Alcohols","Journal of the American Chemical Society","2009","131","","16360","16361","10.1021/ja907741v","","","0.71073","MoKα","","0.0945","0.0505","","","0.0741","0.0845","","","","","","1.043","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105359","11.1036","0.0009","12.5845","0.0011","20.5049","0.0017","90","","100.568","0.001","90","","2816.6","0.4","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C59 H82 Br2 Mo N2 O2 Si -","- C59 H82 Br2 Mo N2 O2 Si -","- C118 H164 Br4 Mo2 N4 O4 Si2 -","2","1","","Simon J. Meek; Steven J. Malcolmson; Bo Li; Richard R. Schrock; Amir H. Hoveyda","The Significance of Degenerate Processes to Enantioselective Olefin Metathesis Reactions Promoted by Stereogenic-at-Mo Complexes","Journal of the American Chemical Society","2009","131","","16407","16409","10.1021/ja907805f","","","0.71073","MoKα","","0.0257","0.0237","","","0.0531","0.0535","","","","","","0.941","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105360","8.425","0.005","9.548","0.004","11.843","0.007","90","","108.59","0.06","90","","903","0.9","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","rac-(1R,4S,6R)-4,6-Dimethyl-2-methylene-1,3-dithiane-1-oxide","","- C7 H12 O S2 -","- C7 H12 O S2 -","- C28 H48 O4 S8 -","4","1","","Roland Ulshöfer; Joachim Podlech","Stereoelectronic Effects in Vinyl Sulfoxides","Journal of the American Chemical Society","2009","131","","16618","16619","10.1021/ja904354g","","","0.71073","MoKα","","0.0354","0.0313","","","0.0803","0.0828","","","","","","1.031","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105361","9.669","","11.802","","10.02","","90","","111.59","","90","","1063.2","","150","2","150","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","rac-(1R,4S,6R)-4,6-Dimethyl-2-(propan-2-ylidene)-1,3-dithiane-1-oxide","","- C9 H16 O S2 -","- C9 H16 O S2 -","- C36 H64 O4 S8 -","4","1","","Roland Ulshöfer; Joachim Podlech","Stereoelectronic Effects in Vinyl Sulfoxides","Journal of the American Chemical Society","2009","131","","16618","16619","10.1021/ja904354g","","","0.71073","MoKα","","0.0483","0.0391","","","0.1175","0.122","","","","","","1.07","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105362","10.3288","0.0003","12.5828","0.0003","14.4276","0.0004","110.315","0.002","99.272","0.001","100.188","0.002","1679.67","0.08","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C39 H47 B N6 -","- C39 H47 B N6 -","- C78 H94 B2 N12 -","2","1","","Martyn P. Coles; Pedro J. Aragón-Sáez; Sarah H. Oakley; Peter B. Hitchcock; Matthew G. Davidson; Zvonimir B. Maksić; Robert Vianello; Ivo Leito; Ivari Kaljurand; David C. Apperley","Superbasicity of a Bis-guanidino Compound with a Flexible Linker: A Theoretical and Experimental Study","Journal of the American Chemical Society","2009","131","","16858","16868","10.1021/ja906618g","","x-ray","0.71073","MoKα","","0.0948","0.0622","","","0.1571","0.1796","","","","","","1.024","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105363","10.2719","0.0003","12.4868","0.0003","14.3087","0.0005","109.992","0.002","99.77","0.001","100.197","0.002","1644.02","0.09","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H47 B N6 -","- C38.994 H47 B N6 -","- C77.988 H94 B2 N12 -","2","1","","Martyn P. Coles; Pedro J. Aragón-Sáez; Sarah H. Oakley; Peter B. Hitchcock; Matthew G. Davidson; Zvonimir B. Maksić; Robert Vianello; Ivo Leito; Ivari Kaljurand; David C. Apperley","Superbasicity of a Bis-guanidino Compound with a Flexible Linker: A Theoretical and Experimental Study","Journal of the American Chemical Society","2009","131","","16858","16868","10.1021/ja906618g","","x-ray","0.71073","MoKα","","0.0613","0.0459","","","0.1269","0.1421","","","","","","1.052","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105364","10.174","0.0005","12.377","0.0007","14.195","0.0008","109.885","0.002","100.387","0.002","99.863","0.004","1600.23","0.16","50","2","50","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H47 B N6 -","- C38.994 H47 B N6 -","- C77.988 H94 B2 N12 -","2","1","","Martyn P. Coles; Pedro J. Aragón-Sáez; Sarah H. Oakley; Peter B. Hitchcock; Matthew G. Davidson; Zvonimir B. Maksić; Robert Vianello; Ivo Leito; Ivari Kaljurand; David C. Apperley","Superbasicity of a Bis-guanidino Compound with a Flexible Linker: A Theoretical and Experimental Study","Journal of the American Chemical Society","2009","131","","16858","16868","10.1021/ja906618g","","","0.71073","MoKα","","0.0825","0.0503","","","0.1197","0.135","","","","","","1.027","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105365","14.99","0.0001","14.99","0.0001","14.99","0.0001","63.763","","63.763","","63.763","","2579.48","0.03","173","2","173","2","","","","","","","","8","R -3 :R","-P 3*","148","","","","- C103 H90 Au6 B2 F8 N6 O3 P6 -","- C103 Au6 B2 F8 N6 O3 P6 -","- C103 Au6 B2 F8 N6 O3 P6 -","1","0.166667","","Jian-Hua Jia; Quan-Ming Wang","Intensely Luminescent Gold(I)-Silver(I) Cluster with Hypercoordinated Carbon","Journal of the American Chemical Society","2009","131","","16634","16635","10.1021/ja906695h","","","0.71073","MoKα","","0.0435","0.0267","","","0.0625","0.0645","","","","","","0.932","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105366","15.5515","0.0008","27.1485","0.0009","16.1075","0.0007","90","","114.276","0.005","90","","6199.2","0.5","223","2","223","2","","","","","","","","10","P 1 21/n 1","-P 2yn","14","","","","- C107 H94 Ag2 Au6 B4 Cl8 F16 N6 O P6 -","- C107 H94 Ag2 Au6 B4 Cl8 F16 N6 O P6 -","- C214 H188 Ag4 Au12 B8 Cl16 F32 N12 O2 P12 -","2","0.5","","Jian-Hua Jia; Quan-Ming Wang","Intensely Luminescent Gold(I)-Silver(I) Cluster with Hypercoordinated Carbon","Journal of the American Chemical Society","2009","131","","16634","16635","10.1021/ja906695h","","","0.71073","MoKα","","0.1156","0.051","","","0.1066","0.1148","","","","","","0.901","","","","has coordinates","188980","2020-10-21","18:00:00",""
"4105367","6.7176","0.0013","12.24","0.002","7.1196","0.0014","90","","109.84","0.03","90","","550.7","0.2","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H16 O2 -","- C13 H16 O2 -","- C26 H32 O4 -","2","1","","K. C. Nicolaou; Ang Li; David J. Edmonds; G. Scott Tria; Shelby P. Ellery","Total Synthesis of Platensimycin and Related Natural Products","Journal of the American Chemical Society","2009","131","","16905","16918","10.1021/ja9068003","","","0.71073","MoKα","","0.064","0.0484","","","0.0984","0.1061","","","","","","1.027","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105368","5.2036","0.001","13.466","0.003","30.421","0.006","90","","90","","90","","2131.7","0.8","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H23 Br N2 O4 S -","- C21 H23 Br N2 O4 S -","- C84 H92 Br4 N8 O16 S4 -","4","1","","K. C. Nicolaou; Ang Li; David J. Edmonds; G. Scott Tria; Shelby P. Ellery","Total Synthesis of Platensimycin and Related Natural Products","Journal of the American Chemical Society","2009","131","","16905","16918","10.1021/ja9068003","","","0.71073","MoKα","","0.0784","0.0553","","","0.1078","0.1165","","","","","","1.071","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105369","6.1733","0.0006","11.7996","0.0014","22.9584","0.0018","90","","90","","90","","1672.3","0.3","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2S,6R)-6-(benzyloxymethyl)-2-isopropyl-5,5-dimethyl-1,3-dioxan-4-ol","","- C17 H26 O4 -","- C17 H26 O4 -","- C68 H104 O16 -","4","1","","Morris Markert; Ulf Scheffler; Rainer Mahrwald","Asymmetric Histidine-Catalyzed Cross-Aldol Reactions of Enolizable Aldehydes: Access to Defined Configured Quaternary Stereogenic Centers","Journal of the American Chemical Society","2009","131","","16642","16643","10.1021/ja907054y","","","1.54186","CuKα","","0.0814","0.075","","","0.1963","0.2023","","","","","","1.06","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105370","6.0434","0.0009","8.5691","0.001","10.8387","0.0015","90","","95.146","0.018","90","","559.04","0.13","180","2","180","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(R)-3-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-3-hydroxy-2,2- dimethylpropanal","","- C10 H18 O4 -","- C10 H18 O4 -","- C20 H36 O8 -","2","1","","Morris Markert; Ulf Scheffler; Rainer Mahrwald","Asymmetric Histidine-Catalyzed Cross-Aldol Reactions of Enolizable Aldehydes: Access to Defined Configured Quaternary Stereogenic Centers","Journal of the American Chemical Society","2009","131","","16642","16643","10.1021/ja907054y","","","0.71073","MoKα","","0.0305","0.0297","","","0.0767","0.0772","","","","","","1.055","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105371","9.8337","0.0013","9.8337","0.0013","5.9948","0.0007","90","","90","","120","","502.04","0.11","180","2","180","2","","","","","","","","3","P 32","P 32","145","","(S)-3-hydroxy-4,4-dimethyldihydrofuran-2(3H)-one","","- C6 H10 O3 -","- C6 H10 O3 -","- C18 H30 O9 -","3","1","","Morris Markert; Ulf Scheffler; Rainer Mahrwald","Asymmetric Histidine-Catalyzed Cross-Aldol Reactions of Enolizable Aldehydes: Access to Defined Configured Quaternary Stereogenic Centers","Journal of the American Chemical Society","2009","131","","16642","16643","10.1021/ja907054y","","","0.71073","MoKα","","0.0319","0.0256","","","0.0469","0.0479","","","","","","0.967","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105372","8.0425","0.0013","6.6274","0.0008","25.446","0.005","90","","93.479","0.014","90","","1353.8","0.4","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(S)-((R)-2,2-dimethyl-1,3-dioxalan-4-yl)((S)-4-(hydroxymethyl)2,2- dimethyl-1,3-dioxolan-4-yl)methanol","","- C12 H22 O6 -","- C12 H22 O6 -","- C48 H88 O24 -","4","2","","Morris Markert; Ulf Scheffler; Rainer Mahrwald","Asymmetric Histidine-Catalyzed Cross-Aldol Reactions of Enolizable Aldehydes: Access to Defined Configured Quaternary Stereogenic Centers","Journal of the American Chemical Society","2009","131","","16642","16643","10.1021/ja907054y","","","0.71073","MoKα","","0.1142","0.0883","","","0.2102","0.2329","","","","","","0.993","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105373","9.5917","0.0004","13.0319","0.0005","10.8481","0.0004","90","","96.686","0.003","90","","1346.77","0.09","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Au(Etthiazdt)2NEt4","","","- C36 H60 Au2 N6 S16 -","- C36 H60 Au2 N6 S16 -","- C36 H60 Au2 N6 S16 -","1","0.25","","Nadine Tenn; Nathalie Bellec; Olivier Jeannin; Lidia Piekara-Sady; Pascale Auban-Senzier; Jorge Íñiguez; Enric Canadell; Dominique Lorcy","A Single-Component Molecular Metal Based on a Thiazole Dithiolate Gold Complex","Journal of the American Chemical Society","2009","131","","16961","16967","10.1021/ja907426s","","","0.71073","MoKα","","0.0714","0.0383","","","0.072","0.0813","","","","","","1.072","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105374","14.06","0.002","4.0593","0.0006","14.259","0.002","90","","93.524","0.005","90","","812.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","AuEtthiazdt2neutral","","","- C10 H10 Au N2 S8 -","- C10 H10 Au N2 S8 -","- C20 H20 Au2 N4 S16 -","2","0.5","","Nadine Tenn; Nathalie Bellec; Olivier Jeannin; Lidia Piekara-Sady; Pascale Auban-Senzier; Jorge Íñiguez; Enric Canadell; Dominique Lorcy","A Single-Component Molecular Metal Based on a Thiazole Dithiolate Gold Complex","Journal of the American Chemical Society","2009","131","","16961","16967","10.1021/ja907426s","","","0.71073","MoKα","","0.0421","0.0322","","","0.0664","0.0702","","","","","","1.061","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105375","13.4659","0.0012","11.5349","0.0011","14.053","0.0013","90","","109.123","0.001","90","","2062.4","0.3","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 As2 F6 O6 P S2 -","- C9 H21 As2 F6 O6 P S2 -","- C36 H84 As8 F24 O24 P4 S8 -","4","1","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.0368","0.0283","","","0.0707","0.0748","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105376","11.7585","0.0008","12.8289","0.0009","12.9423","0.0009","90","","96.48","0.001","90","","1939.9","0.2","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 As F3 O3 P S -","- C16 H19 As F3 O3 P S -","- C64 H76 As4 F12 O12 P4 S4 -","4","1","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.0428","0.0335","","","0.0838","0.0889","","","","","","1.044","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105377","28.143","0.004","15.696","0.002","11.3857","0.0015","90","","97.8153","0.0017","90","","4982.7","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Al2 As2 Cl8 P2 -","- C18 H28 Al2 As2 Cl8 P2 -","- C108 H168 Al12 As12 Cl48 P12 -","6","1.5","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.0586","0.0425","","","0.1026","0.1104","","","","","","1.047","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105378","20.132","0.003","14.311","0.0018","15.4865","0.0019","90","","101.167","0.0018","90","","4377.3","1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H33 Al2 As2 Cl8 P -","- C37 H33 Al2 As2 Cl8 P -","- C148 H132 Al8 As8 Cl32 P4 -","4","1","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.0505","0.0376","","","0.0898","0.0978","","","","","","1.049","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105379","11.327","0.003","11.345","0.003","20.433","0.006","90.271","0.004","98.929","0.004","90.595","0.004","2593.7","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H40 Al2 As2 Cl8 P2 -","- C48 H40 Al2 As2 Cl8 P2 -","- C96 H80 Al4 As4 Cl16 P4 -","2","1","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.1012","0.0813","","","0.2232","0.2448","","","","","","1.066","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105380","10.142","0.002","11.858","0.003","22.81","0.005","81.329","0.003","79.316","0.003","85.433","0.003","2661.1","1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H46 Al2 Cl10 P2 Sb2 -","- C43 H46 Al2 Cl10 P2 Sb2 -","- C86 H92 Al4 Cl20 P4 Sb4 -","2","1","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.1088","0.0861","","","0.1988","0.2094","","","","","","1.208","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105381","11.5699","0.0005","10.866","0.0005","21.0827","0.0009","90","","101.329","0.001","90","","2598.8","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H40 Al2 Cl8 P2 Sb2 -","- C48 H40 Al2 Cl8 P2 Sb2 -","- C96 H80 Al4 Cl16 P4 Sb4 -","2","0.5","","Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson","Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds","Journal of the American Chemical Society","2009","131","","17000","17008","10.1021/ja907613c","","","0.71073","MoKα","","0.026","0.0232","","","0.0596","0.062","","","","","","1.044","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105382","17.312","0.003","12.0841","0.0018","13.904","0.002","90","","111.917","0.002","90","","2698.5","0.7","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","'Potassium uranyl peroxide oxalate hydrate","","- C8 K6 O26 U2 -","- C8 K6 O26 U2 -","- C32 K24 O104 U8 -","4","1","","Ginger E. Sigmon; Jie Ling; Daniel K. Unruh; Laura Moore-Shay; Matthew Ward; Brittany Weaver; Peter C. Burns","Uranyl-Peroxide Interactions Favor Nanocluster Self-Assembly","Journal of the American Chemical Society","2009","131","","16648","16649","10.1021/ja907837u","","","0.71073","MoKα","","0.0613","0.0366","","","0.0722","0.0818","","","","","","0.999","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105383","18.625","0.003","26.652","0.004","15.66","0.002","90","","90","","90","","7774","2","273","2","273","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Sodium uranyl peroxide oxalate hydrate","","- C12 Na12 O77 U6 -","- C12 Na12 O77 U6 -","- C48 Na48 O308 U24 -","4","0.5","","Ginger E. Sigmon; Jie Ling; Daniel K. Unruh; Laura Moore-Shay; Matthew Ward; Brittany Weaver; Peter C. Burns","Uranyl-Peroxide Interactions Favor Nanocluster Self-Assembly","Journal of the American Chemical Society","2009","131","","16648","16649","10.1021/ja907837u","","","0.71073","MoKα","","0.0912","0.0643","","","0.1678","0.1864","","","","","","1.052","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105384","10.2949","0.0007","19.5235","0.0014","27.0032","0.0019","90","","90","","90","","5427.4","0.7","273","2","273","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Potassium uranyl peroxide oxalate hydrate","","- C10 K10 O53 U5 -","- C10 K10 O53 U5 -","- C40 K40 O212 U20 -","4","0.5","","Ginger E. Sigmon; Jie Ling; Daniel K. Unruh; Laura Moore-Shay; Matthew Ward; Brittany Weaver; Peter C. Burns","Uranyl-Peroxide Interactions Favor Nanocluster Self-Assembly","Journal of the American Chemical Society","2009","131","","16648","16649","10.1021/ja907837u","","","0.71073","MoKα","","0.0423","0.0287","","","0.0759","0.0787","","","","","","0.95","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105385","34.939","0.013","19.099","0.007","35.944","0.013","90","","113.625","0.008","90","","21975","14","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Sodium tetraproply uranyl peroxide","","- C108 H234 N9 Na11.2 O109 U20 -","- C108 N9 Na11.19 O108 U20 -","- C432 N36 Na44.76 O432 U80 -","4","1","","Ginger E. Sigmon; Jie Ling; Daniel K. Unruh; Laura Moore-Shay; Matthew Ward; Brittany Weaver; Peter C. Burns","Uranyl-Peroxide Interactions Favor Nanocluster Self-Assembly","Journal of the American Chemical Society","2009","131","","16648","16649","10.1021/ja907837u","","","0.71073","MoKα","","0.1299","0.0641","","","0.1427","0.1784","","","","","","1.037","","","","has coordinates","289268","2024-02-02","08:58:43",""
"4105386","8.941","0.003","27.929","0.009","16.334","0.005","90","","105.848","0.008","90","","3924","2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C74 H74 Cl8 N10 Ni2 O8 S2 -","- C74 H74 Cl8 N10 Ni2 O8 S2 -","- C148 H148 Cl16 N20 Ni4 O16 S4 -","2","1","","Xiang Liu; James A. Henderson; Takeo Sasaki; Yoshito Kishi","Dramatic Improvement in Catalyst Loadings and Molar Ratios of Coupling Partners for Ni/Cr-Mediated Coupling Reactions: Heterobimetallic Catalysts","Journal of the American Chemical Society","2009","131","","16678","16680","10.1021/ja9079308","","","0.71073","MoKα","","0.1567","0.0793","","","0.1646","0.1854","","","","","","1.018","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105387","12.0047","0.0004","12.0319","0.0004","17.332","0.0006","90.282","0.002","94.171","0.004","101.03","0.002","2450.22","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H74 Li4 N6 Ti2 -","- C49 H74 Li4 N6 Ti2 -","- C98 H148 Li8 N12 Ti4 -","2","1","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","0.71073","MoKα","","0.0745","0.0331","","","0.0506","0.0537","","","","","","0.764","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105388","20.9957","0.0004","7.9976","0.0002","12.6211","0.0002","90","","90","","90","","2119.27","0.07","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C21 H34 Li N3 Ti -","- C21 H34 Li N3 Ti -","- C84 H136 Li4 N12 Ti4 -","4","1","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","1.54184","CuKα","","0.0282","0.0272","","","0.0725","0.0731","","","","","","1.092","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105389","31.9896","0.0004","10.02607","0.0001","17.1398","0.0002","90","","107.582","0.0012","90","","5240.45","0.11","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H21 Mo O5 P Ti -","- C29 H21 Mo O5 P Ti -","- C232 H168 Mo8 O40 P8 Ti8 -","8","1","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","0.71073","MoKα","","0.0334","0.0208","","","0.0419","0.0429","","","","","","0.879","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105390","10.2073","0.0002","13.3413","0.0002","18.5216","0.0004","90","","91.036","0.002","90","","2521.83","0.08","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C28 H29 Au Cl O P Ti -","- C28 H29 Au Cl O P Ti -","- C112 H116 Au4 Cl4 O4 P4 Ti4 -","4","2","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","1.54184","CuKα","","0.0669","0.0606","","","0.1445","0.1495","","","","","","1.033","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105391","25.8727","0.001","8.2464","0.0002","20.6849","0.0008","90","","118.242","0.004","90","","3887.9","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H42 Au Cl P2 Ti2 -","- C48 H42 Au Cl P2 Ti2 -","- C192 H168 Au4 Cl4 P8 Ti8 -","4","0.5","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","0.71073","MoKα","","0.0362","0.0261","","","0.0524","0.0531","","","","","","0.927","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105392","10.38647","0.00014","13.1253","0.0002","22.924","0.0003","90","","90","","90","","3125.13","0.08","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H30 Cl2 P2 Pt Ti -","- C36 H30 Cl2 P2 Pt Ti -","- C144 H120 Cl8 P8 Pt4 Ti4 -","4","1","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","0.71073","MoKα","","0.0426","0.0299","","","0.0331","0.0337","","","","","","0.887","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105393","11.4048","0.0003","15.3408","0.0004","14.5731","0.0005","90","","98.262","0.003","90","","2523.23","0.13","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H48 Cl8 P2 Pt Ti2 -","- C51 H48 Cl8 P2 Pt Ti2 -","- C102 H96 Cl16 P4 Pt2 Ti4 -","2","0.5","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","0.71073","MoKα","","0.063","0.0303","","","0.0524","0.0547","","","","","","0.817","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105394","10.0746","0.0006","10.5051","0.001","12.4587","0.0008","114.28","0.008","92.36","0.006","103.396","0.006","1155.31","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H46 Cl6 P2 Pt Ti2 -","- C50 H46 Cl6 P2 Pt Ti2 -","- C50 H46 Cl6 P2 Pt Ti2 -","1","0.5","","Swagat K. Mohapatra; Susanne Büschel; Constantin Daniliuc; Peter G. Jones; Matthias Tamm","Selective Lithiation and Phosphane-Functionalization of [(η7-C7H7)Ti(η5-C5H5)] (Troticene) and Its Use for the Preparation of Early-Late Heterobimetallic Complexes","Journal of the American Chemical Society","2009","131","","17014","17023","10.1021/ja9080056","","","0.71073","MoKα","","0.0289","0.0242","","","0.0389","0.0394","","","","","","0.879","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105395","6.598","0.0013","10.743","0.002","26.511","0.005","90","","90","","90","","1879.2","0.6","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H21 Br O5 -","- C20 H21 Br O5 -","- C80 H84 Br4 O20 -","4","1","","Pingfan Li; Hisashi Yamamoto","Lewis Acid Catalyzed Inverse-Electron-Demand Diels-Alder Reaction of Tropones","Journal of the American Chemical Society","2009","131","","16628","16629","10.1021/ja908127f","","","0.71073","MoKα","","0.0433","0.0361","","","0.0691","0.0705","","","","","","0.908","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105396","6.296","0.0013","6.743","0.0014","9.347","0.002","95.088","0.003","93.518","0.003","91.218","0.004","394.37","0.14","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C9 H7 Br O2 -","- C9 H7 Br O2 -","- C18 H14 Br2 O4 -","2","2","","Pingfan Li; Hisashi Yamamoto","Lewis Acid Catalyzed Inverse-Electron-Demand Diels-Alder Reaction of Tropones","Journal of the American Chemical Society","2009","131","","16628","16629","10.1021/ja908127f","","","0.71073","MoKα","","0.0421","0.0366","","","0.0857","0.0874","","","","","","1.016","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105397","7.1229","0.0004","7.75","0.0004","11.403","0.0007","90","","90","","90","","629.47","0.06","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-{(μ2-Chloro)-(μ2-dioxane-O,O')-lithium(i)}","","- C4 H8 Cl Li O2 -","- C4 H8 Cl Li O2 -","- C16 H32 Cl4 Li4 O8 -","4","1","","Liqun Jin; Chao Liu; Jing Liu; Fang Hu; Yu Lan; Andrei S. Batsanov; Judith A. K. Howard; Todd B. Marder; Aiwen Lei","Revelation of the Difference between Arylzinc Reagents Prepared from Aryl Grignard and Aryllithium Reagents Respectively: Kinetic and Structural Features","Journal of the American Chemical Society","2009","131","","16656","16657","10.1021/ja908198d","","","0.71073","MoKα","","0.0211","0.0201","","","0.0518","0.0523","","","","","","1.06","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105398","14.863","0.002","10.4843","0.0017","16.936","0.003","90","","100.13","0.03","90","","2598","0.8","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21.42 H36.51 Br0.65 Cl2.44 Mg O4 Zn -","- C21.364 H36.47 Br0.664 Cl2.442 Mg O4 Zn -","- C85.456 H145.88 Br2.656 Cl9.768 Mg4 O16 Zn4 -","4","1","","Liqun Jin; Chao Liu; Jing Liu; Fang Hu; Yu Lan; Andrei S. Batsanov; Judith A. K. Howard; Todd B. Marder; Aiwen Lei","Revelation of the Difference between Arylzinc Reagents Prepared from Aryl Grignard and Aryllithium Reagents Respectively: Kinetic and Structural Features","Journal of the American Chemical Society","2009","131","","16656","16657","10.1021/ja908198d","","","0.71073","MoKα","","0.1915","0.0754","","","0.1502","0.1921","","","","","","1.003","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105399","10.5223","0.0008","13.2057","0.001","19.7516","0.0015","103.955","0.001","101.557","0.001","100.116","0.001","2536.1","0.3","85","2","85","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H33 Cl2 F6 N7 O Zn -","- C56 H33 Cl2 F6 N7 O Zn -","- C112 H66 Cl4 F12 N14 O2 Zn2 -","2","1","","Timothy C. Berto; V. K. K. Praneeth; Lauren E. Goodrich; Nicolai Lehnert","Iron-Porphyrin NO Complexes with Covalently Attached N-Donor Ligands: Formation of a Stable Six-Coordinate Species in Solution","Journal of the American Chemical Society","2009","131","","17116","17126","10.1021/ja904368n","","","0.71073","MoKα","","0.0778","0.057","","","0.163","0.177","","","","","","1.075","","","","has coordinates,has disorder","178799","2020-10-21","18:00:00",""
"4105400","18.935","0.004","7.047","0.0014","13.304","0.003","90","","123.92","0.03","90","","1473.1","0.7","20","0.1","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C18 H25 O2.5 -","- C18 H25 O2.5 -","- C72 H100 O10 -","4","1","","Elizabeth A. Zhurova; Vladimir V. Zhurov; Deepak Chopra; Adam I. Stash; A. Alan Pinkerton","17α-Estradiol.1/2 H2O: Super-Structural Ordering, Electronic Properties, Chemical Bonding, and Biological Activity in Comparison with Other Estrogens","Journal of the American Chemical Society","2009","131","","17260","17269","10.1021/ja906057z","","","0.71073","MoKα","","","0.0174","","","","0.01","","","","","","1.0302","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105401","8.7557","0.0004","11.6162","0.0005","23.5245","0.0011","85.6293","0.0016","80.2264","0.0018","88.77","0.002","2350.96","0.18","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H78 O4 Si2 -","- C46 H78 O4 Si2 -","- C92 H156 O8 Si4 -","2","1","","Tanmoy Dutta; Kathy B. Woody; Sean R. Parkin; Mark D. Watson; Johannes Gierschner","Conjugated Polymers with Large Effective Stokes Shift: Benzobisdioxole-Based Poly(phenylene ethynylene)s","Journal of the American Chemical Society","2009","131","","17321","17327","10.1021/ja9068134","","","0.71073","MoKα","","0.1369","0.1028","","","0.2535","0.2766","","","","","","1.092","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105402","12.9491","0.0005","21.29","0.0006","11.6829","0.0005","90","","90","","90","","3220.8","0.2","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C18 H12 Cd N2 O4 -","- C18 H12 Cd N2 O4 -","- C72 H48 Cd4 N8 O16 -","4","0.5","","JianJun Zhang; Lukasz Wojtas; Randy W. Larsen; Mohamed Eddaoudi; Michael J. Zaworotko","Temperature and Concentration Control over Interpenetration in a Metal-Organic Material","Journal of the American Chemical Society","2009","131","","17040","17041","10.1021/ja906911q","","","1.54178","CuKα","","0.057","0.0428","","","0.1033","0.1081","","","","","","1.019","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105403","13.0941","0.0019","14.506","0.002","19.684","0.003","95.217","0.002","90.019","0.002","95.349","0.002","3707","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.38 H32.75 Cl4.75 N2 O8 Pd2 -","- C32.375 H32.75 Cl4.75 N2 O8 Pd2 -","- C129.5 H131 Cl19 N8 O32 Pd8 -","4","2","","David C. Powers; Matthias A. L. Geibel; Johannes E. M. N. Klein; Tobias Ritter","Bimetallic Palladium Catalysis: Direct Observation of Pd(III)-Pd(III) Intermediates","Journal of the American Chemical Society","2009","131","","17050","17051","10.1021/ja906935c","","","0.71073","MoKα","","0.0608","0.0433","","","0.0916","0.1012","","","","","","1.047","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105404","9.5836","0.0008","12.2635","0.0008","18.164","0.002","90","0.004","90","0.004","90","0.003","2134.8","0.3","296.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H25 N O2 -","- C26 H25 N O2 -","- C104 H100 N4 O8 -","4","1","","Kazuyuki Matsumura; Tadashi Mori; Yoshihisa Inoue","Wavelength Control of Diastereodifferentiating Paternó-Büchi Reaction of Chiral Cyanobenzoates with Diphenylethene through Direct versus Charge-Transfer Excitation","Journal of the American Chemical Society","2009","131","","17076","17077","10.1021/ja907156j","","","0.7107","MoKα","","","0.085","","","","0.082","","","","","","1.386","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105405","16.083","0.003","18.405","0.004","20.111","0.004","102.564","0.01","99.4","0.01","91.116","0.011","5723","2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- Ce2.5 H12 K N0.5 O82 Ru4 Si2 W20 -","- Ce3 O123.5 Ru4 Si2 W20 -","- Ce6 O247 Ru8 Si4 W40 -","2","1","","Yurii V. Geletii; Claire Besson; Yu Hou; Qiushi Yin; Djamaladdin G. Musaev; David Quiñonero; Rui Cao; Kenneth I. Hardcastle; Anna Proust; Paul Kögerler; Craig L. Hill","Structural, Physicochemical, and Reactivity Properties of an All-Inorganic, Highly Active Tetraruthenium Homogeneous Catalyst for Water Oxidation","Journal of the American Chemical Society","2009","131","","17360","17370","10.1021/ja907277b","","","0.71073","MoKα","","0.0634","0.0541","","","0.1867","0.1961","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105406","14.7305","0.0008","19.6144","0.0009","20.8418","0.001","100.745","0.003","99.569","0.003","94.958","0.003","5790.9","0.5","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C16 H78 Cl4 K2 N8 O82 Ru4 Si2 W20 -","- C2 Cl4 K2 N O82 Ru4 Si2 W20 -","- C4 Cl8 K4 N2 O164 Ru8 Si4 W40 -","2","1","","Yurii V. Geletii; Claire Besson; Yu Hou; Qiushi Yin; Djamaladdin G. Musaev; David Quiñonero; Rui Cao; Kenneth I. Hardcastle; Anna Proust; Paul Kögerler; Craig L. Hill","Structural, Physicochemical, and Reactivity Properties of an All-Inorganic, Highly Active Tetraruthenium Homogeneous Catalyst for Water Oxidation","Journal of the American Chemical Society","2009","131","","17360","17370","10.1021/ja907277b","","","0.71073","MoKα","","0.1799","0.0897","","","0.2436","0.3063","","","","","","1.015","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105407","8.631","0.0003","11.245","0.0003","12.1742","0.0004","99.8602","0.0003","104.289","0.0003","99.05","0.0003","1103.19","0.06","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H74 Si4 U2 -","- C40 H74 Si4 U2 -","- C40 H74 Si4 U2 -","1","0.5","","William J. Evans; Christopher A. Traina; Joseph W. Ziller","Synthesis of Heteroleptic Uranium (μ-η6:η6-C6H6)2- Sandwich Complexes via Facile Displacement of (η5-C5Me5)1- by Ligands of Lower Hapticity and Their Conversion to Heteroleptic Bis(imido) Compounds","Journal of the American Chemical Society","2009","131","","17473","17481","10.1021/ja9075259","","","0.71073","MoKα","","0.0138","0.0132","","","0.0327","0.0329","","","","","","1.045","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105408","11.0169","0.0017","17.007","0.003","13.543","0.002","90","","90.3839","0.0019","90","","2537.4","0.7","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H82 O2 U2 -","- C56 H82 O2 U2 -","- C112 H164 O4 U4 -","2","0.5","","William J. Evans; Christopher A. Traina; Joseph W. Ziller","Synthesis of Heteroleptic Uranium (μ-η6:η6-C6H6)2- Sandwich Complexes via Facile Displacement of (η5-C5Me5)1- by Ligands of Lower Hapticity and Their Conversion to Heteroleptic Bis(imido) Compounds","Journal of the American Chemical Society","2009","131","","17473","17481","10.1021/ja9075259","","","0.71073","MoKα","","0.0649","0.0552","","","0.1362","0.145","","","","","","1.22","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105409","9.938","0.0007","10.8469","0.0008","20.2681","0.0019","92.82","0.001","91.435","0.001","116.534","0.001","1949.6","0.3","148","2","148","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H69 N4 U -","- C41 H69 N4 U -","- C82 H138 N8 U2 -","2","1","","William J. Evans; Christopher A. Traina; Joseph W. Ziller","Synthesis of Heteroleptic Uranium (μ-η6:η6-C6H6)2- Sandwich Complexes via Facile Displacement of (η5-C5Me5)1- by Ligands of Lower Hapticity and Their Conversion to Heteroleptic Bis(imido) Compounds","Journal of the American Chemical Society","2009","131","","17473","17481","10.1021/ja9075259","","","0.71073","MoKα","","0.0169","0.0159","","","0.0389","0.0393","","","","","","1.044","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105410","9.9011","0.0006","13.3585","0.0008","15.3247","0.0009","84.6455","0.0007","80.706","0.0007","80.4456","0.0007","1967.9","0.2","88","2","88","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H59 N2 U -","- C40 H59 N2 U -","- C80 H118 N4 U2 -","2","1","","William J. Evans; Christopher A. Traina; Joseph W. Ziller","Synthesis of Heteroleptic Uranium (μ-η6:η6-C6H6)2- Sandwich Complexes via Facile Displacement of (η5-C5Me5)1- by Ligands of Lower Hapticity and Their Conversion to Heteroleptic Bis(imido) Compounds","Journal of the American Chemical Society","2009","131","","17473","17481","10.1021/ja9075259","","","0.71073","MoKα","","0.0273","0.0261","","","0.076","0.0767","","","","","","1.125","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105411","13.5148","0.0007","18.2529","0.0009","19.2967","0.001","90","","90.0839","0.0007","90","","4760.2","0.4","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H79 N5 Si2 U -","- C47 H79 N5 Si2 U -","- C188 H316 N20 Si8 U4 -","4","1","","William J. Evans; Christopher A. Traina; Joseph W. Ziller","Synthesis of Heteroleptic Uranium (μ-η6:η6-C6H6)2- Sandwich Complexes via Facile Displacement of (η5-C5Me5)1- by Ligands of Lower Hapticity and Their Conversion to Heteroleptic Bis(imido) Compounds","Journal of the American Chemical Society","2009","131","","17473","17481","10.1021/ja9075259","","","0.71073","MoKα","","0.0637","0.0452","","","0.1052","0.1128","","","","","","1.042","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105412","4.1182","0.0008","14.193","0.003","29.071","0.006","90","","90","","90","","1699.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H15 Br O3 -","- C21 H15 Br O3 -","- C84 H60 Br4 O12 -","4","1","","Xingwei Guo; Rong Yu; Haijun Li; Zhiping Li","Iron-Catalyzed Tandem Oxidative Coupling and Annulation: An Efficient Approach to Construct Polysubstituted Benzofurans","Journal of the American Chemical Society","2009","131","","17387","17393","10.1021/ja907568j","","","0.71073","MoKα","","0.1377","0.0375","","","0.0473","0.0581","","","","","","0.657","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105413","9.562","0.005","10.587","0.004","15.491","0.007","96.133","0.006","107.6","0.005","90.475","0.009","1484.9","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H54 Li2 N4 Si2 -","- C22 H54 Li2 N4 Si2 -","- C44 H108 Li4 N8 Si4 -","2","1","","Christian Unkelbach; Carsten Strohmann","Low-Temperature Addition of Organolithiums to Functionalized Vinylsilanes under Formation of Secondary α-Lithiated Alkylsilanes","Journal of the American Chemical Society","2009","131","","17044","17045","10.1021/ja9076167","","","0.71073","MoKα","","0.0776","0.0633","","","0.132","0.1404","","","","","","1.011","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105414","8.803","0.005","9.319","0.004","12.224","0.004","82.89","0.04","86.29","0.05","71.87","0.06","945.3","0.8","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H34 Li N3 Si -","- C14 H34 Li N3 Si -","- C28 H68 Li2 N6 Si2 -","2","1","","Christian Unkelbach; Carsten Strohmann","Low-Temperature Addition of Organolithiums to Functionalized Vinylsilanes under Formation of Secondary α-Lithiated Alkylsilanes","Journal of the American Chemical Society","2009","131","","17044","17045","10.1021/ja9076167","","","0.71073","MoKα","","0.0808","0.0639","","","0.1867","0.1983","","","","","","1.089","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105415","5.1754","0.0004","10.9294","0.0008","10.9423","0.0008","118.826","0.004","91.381","0.005","99.872","0.004","530.11","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF22 4-pyridyl-CONH-(CH2)6)-NHCO-(4-pyridyl), succinic acid CHUNKS","","- C22 H28 N4 O6 -","- C22 H28 N4 O6 -","- C22 H28 N4 O6 -","1","0.5","","Christer B. Aakeröy; Safiyyah Forbes; John Desper","Using Cocrystals To Systematically Modulate Aqueous Solubility and Melting Behavior of an Anticancer Drug","Journal of the American Chemical Society","2009","131","","17048","17049","10.1021/ja907674c","","","0.71073","MoKα","","0.0993","0.0605","","","0.1509","0.1761","","","","","","1.063","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105416","5.1412","0.0004","5.2394","0.0004","21.3961","0.0017","95.094","0.005","95.603","0.004","91.076","0.005","571.1","0.08","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF 2 4-pyridyl-CONH-(CH2)6-NHCO-4-pyridyl, HOOC-(CH2)4-COOH","","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","- C24 H32 N4 O6 -","1","0.5","","Christer B. Aakeröy; Safiyyah Forbes; John Desper","Using Cocrystals To Systematically Modulate Aqueous Solubility and Melting Behavior of an Anticancer Drug","Journal of the American Chemical Society","2009","131","","17048","17049","10.1021/ja907674c","","","0.71073","MoKα","","0.0691","0.047","","","0.1167","0.1293","","","","","","1.095","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105417","5.1392","0.0005","5.2412","0.0005","23.145","0.002","94.05","0.003","95.222","0.002","91.277","0.002","619.03","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF21 N,N'-(isonicotinyl)hexanediamine, octanedioic acid","","- C26 H36 N4 O6 -","- C26 H36 N4 O6 -","- C26 H36 N4 O6 -","1","0.5","","Christer B. Aakeröy; Safiyyah Forbes; John Desper","Using Cocrystals To Systematically Modulate Aqueous Solubility and Melting Behavior of an Anticancer Drug","Journal of the American Chemical Society","2009","131","","17048","17049","10.1021/ja907674c","","","0.71073","MoKα","","0.0424","0.0372","","","0.1086","0.1137","","","","","","1.09","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105418","5.1506","0.0004","5.2481","0.0004","24.5206","0.0016","89.647","0.004","87.252","0.004","88.505","0.005","661.82","0.08","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF3 (4-pyridyl)-CONH-(CH2)6-NHCO-(4-pyridyl), HOOC-(CH2)8-COOH","","- C28 H40 N4 O6 -","- C28 H40 N4 O6 -","- C28 H40 N4 O6 -","1","0.5","","Christer B. Aakeröy; Safiyyah Forbes; John Desper","Using Cocrystals To Systematically Modulate Aqueous Solubility and Melting Behavior of an Anticancer Drug","Journal of the American Chemical Society","2009","131","","17048","17049","10.1021/ja907674c","","","0.71073","MoKα","","0.0827","0.0493","","","0.1271","0.142","","","","","","1.057","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105419","5.1519","0.0004","5.2778","0.0005","26.148","0.003","86.023","0.006","89.386","0.006","88.496","0.006","709","0.12","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","SF5 (4-pyridyl)-CONH-(CH2)6-NHCO-(4-pyridyl), HOOC-(CH2)10-COOH","","- C30 H44 N4 O6 -","- C30 H44 N4 O6 -","- C30 H44 N4 O6 -","1","0.5","","Christer B. Aakeröy; Safiyyah Forbes; John Desper","Using Cocrystals To Systematically Modulate Aqueous Solubility and Melting Behavior of an Anticancer Drug","Journal of the American Chemical Society","2009","131","","17048","17049","10.1021/ja907674c","","","0.71073","MoKα","","0.1159","0.065","","","0.1632","0.1937","","","","","","1.042","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105420","6.1709","0.0006","6.1709","0.0006","11.77","0.002","90","","90","","120","","388.15","0.08","173","2","173","2","","","","","","","","4","P 63 c m","P 6c -2","185","","","","- In0.37 Mn0.63 O3 Y -","- In0.37 Mn0.63 O3 Y -","- In2.22 Mn3.78 O18 Y6 -","6","0.5","","Andrew E. Smith; Hiroshi Mizoguchi; Kris Delaney; Nicola A. Spaldin; Arthur W. Sleight; M. A. Subramanian","Mn3+ in Trigonal Bipyramidal Coordination: A New Blue Chromophore","Journal of the American Chemical Society","2009","131","","17084","17086","10.1021/ja9080666","","","0.71073","MoKα","","0.028","0.0211","","","0.0389","0.0421","","","","","","1.149","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105421","10.073","0.001","14.0253","0.0012","26.088","0.003","90","","95.919","0.007","90","","3666","0.6","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H36 O3 -","- C20 H36 O3 -","- C160 H288 O24 -","8","2","","Thomas J. Maimone; Jun Shi; Shinji Ashida; Phil S. Baran","Total Synthesis of Vinigrol","Journal of the American Chemical Society","2009","131","","17066","17067","10.1021/ja908194b","","","","","","","","","","","","","","","","","","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105422","7.882","0.0012","13.881","0.002","31.693","0.005","90","","90","","90","","3467.5","0.9","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H26 Br N O2 -","- C19 H26 Br N O2 -","- C152 H208 Br8 N8 O16 -","8","1","","Thomas J. Maimone; Jun Shi; Shinji Ashida; Phil S. Baran","Total Synthesis of Vinigrol","Journal of the American Chemical Society","2009","131","","17066","17067","10.1021/ja908194b","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105423","8.73624","0.00016","11.8091","0.0002","12.2419","0.0002","90","","90","","90","","1262.96","0.04","98.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N O3 S -","- C13 H15 N O3 S -","- C52 H60 N4 O12 S4 -","4","1","","Tatsuhiko Yoshino; Hiroyuki Morimoto; Gang Lu; Shigeki Matsunaga; Masakatsu Shibasaki","Construction of Contiguous Tetrasubstituted Chiral Carbon Stereocenters via Direct Catalytic Asymmetric Aldol Reaction of α-Isothiocyanato Esters with Ketones","Journal of the American Chemical Society","2009","131","","17082","17083","10.1021/ja908571w","","","1.54187","CuKα","","","0.0384","","","","0.1118","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105424","12.3808","0.0004","12.3808","0.0004","32.558","0.002","90","","90","","90","","4990.6","0.4","150","2","150","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C40 H46 Ag2 F6 N10 O8 S2 -","- C38 H46 Ag2 N10 O2 -","- C152 H184 Ag8 N40 O8 -","4","0.5","","Lei-lei Tian; Chun Wang; Sandipan Dawn; Mark D. Smith; Jeanette A. Krause; Linda S. Shimizu","Macrocycles with Switchable exo/endo Metal Binding Sites","Journal of the American Chemical Society","2009","131","","17620","17629","10.1021/ja906474z","","","0.71073","MoKα","","0.0648","0.0513","","","0.1182","0.1241","","","","","","0.988","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105425","8.4446","0.0005","10.3582","0.0006","13.2736","0.0008","90","","105.44","0.001","90","","1119.15","0.11","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 N8 O2 -","- C26 H24 N8 O2 -","- C52 H48 N16 O4 -","2","0.5","","Lei-lei Tian; Chun Wang; Sandipan Dawn; Mark D. Smith; Jeanette A. Krause; Linda S. Shimizu","Macrocycles with Switchable exo/endo Metal Binding Sites","Journal of the American Chemical Society","2009","131","","17620","17629","10.1021/ja906474z","","","0.71073","MoKα","","0.04","0.0342","","","0.0896","0.093","","","","","","1.057","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105426","11.8857","0.0005","15.0339","0.0007","13.5999","0.0006","90","","101.561","0.001","90","","2380.84","0.18","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H54.6 Cl7.4 N10 O2.3 -","- C42 H53.4 Cl7.4 N10 O2.3 -","- C84 H106.8 Cl14.8 N20 O4.6 -","2","0.5","","Lei-lei Tian; Chun Wang; Sandipan Dawn; Mark D. Smith; Jeanette A. Krause; Linda S. Shimizu","Macrocycles with Switchable exo/endo Metal Binding Sites","Journal of the American Chemical Society","2009","131","","17620","17629","10.1021/ja906474z","","","0.71073","MoKα","","0.0503","0.0448","","","0.1165","0.1218","","","","","","1.027","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105427","9.443","0.0008","21.3341","0.0018","27.253","0.002","90","","90","","90","","5490.3","0.8","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H26 Cd N10 O9 -","- C26 H26 Cd N10 O9 -","- C208 H208 Cd8 N80 O72 -","8","1","","Lei-lei Tian; Chun Wang; Sandipan Dawn; Mark D. Smith; Jeanette A. Krause; Linda S. Shimizu","Macrocycles with Switchable exo/endo Metal Binding Sites","Journal of the American Chemical Society","2009","131","","17620","17629","10.1021/ja906474z","","","0.7749","synchrotron","","0.0645","0.0379","","","0.0906","0.1042","","","","","","1.017","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4105428","13.443","0.002","16.074","0.002","21.5","0.003","100.01","0.002","97.933","0.002","91.626","0.002","4524.7","1.1","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C94 H85 B2 Cl2 Co F30 N O4 U -","- C93 H71 B2 Cl2 Co F30 N O4 U -","- C186 H142 B4 Cl4 Co2 F60 N2 O8 U2 -","2","1","","David D. Schnaars; Guang Wu; Trevor W. Hayton","Reduction of Pentavalent Uranyl to U(IV) Facilitated by Oxo Functionalization","Journal of the American Chemical Society","2009","131","","17532","17533","10.1021/ja906880d","","","0.71073","MoKα","","0.141","0.064","","","0.1553","0.1868","","","","","","0.887","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105429","12.9855","0.0013","22.378","0.002","18.4525","0.0019","90","","90.33","0.002","90","","5362","0.9","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C62 H52 B Co F15 N O -","- C62 H52 B Co F15 N O -","- C248 H208 B4 Co4 F60 N4 O4 -","4","1","","David D. Schnaars; Guang Wu; Trevor W. Hayton","Reduction of Pentavalent Uranyl to U(IV) Facilitated by Oxo Functionalization","Journal of the American Chemical Society","2009","131","","17532","17533","10.1021/ja906880d","","","0.71073","MoKα","","0.1394","0.0915","","","0.1742","0.1929","","","","","","1.136","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105430","23.4675","0.0019","21.2867","0.0016","21.1016","0.0018","90","","104.552","0.003","90","","10203.1","1.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H54 B F15 N2 O2.5 -","- C56 H50 B F15 N2 O2.5 -","- C448 H400 B8 F120 N16 O20 -","8","1","","David D. Schnaars; Guang Wu; Trevor W. Hayton","Reduction of Pentavalent Uranyl to U(IV) Facilitated by Oxo Functionalization","Journal of the American Chemical Society","2009","131","","17532","17533","10.1021/ja906880d","","","0.71073","MoKα","","0.1347","0.0664","","","0.1547","0.1872","","","","","","0.923","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105431","13.618","0.001","25.451","0.002","19.3451","0.0016","90","","98.491","0.002","90","","6631.4","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>incar</i>(mu~3~nitridotriscandium)-1,3,7,17,28,39,41,45,47,51,54,62,65,70- Tetradecakis(trifluoromethyl)-1,3,7,17,28,39,41,45,47,51,54,62,65,70- tetradecahydro(C~80~-<i>I~h~</i>(7))[5,6])fullerene","","- C98 H5 F42 N Sc3 -","- C98 H5 F42 N Sc3 -","- C392 H20 F168 N4 Sc12 -","4","1","","Natalia B. Shustova; Yu-Sheng Chen; Mary A. Mackey; Curtis E. Coumbe; J. Paige Phillips; Steven Stevenson; Alexey A. Popov; Olga V. Boltalina; Steven H. Strauss","Sc3N@(C80-Ih(7))(CF3)14 and Sc3N@(C80-Ih(7))(CF3)16. Endohedral Metallofullerene Derivatives with Exohedral Addends on Four and Eight Triple-Hexagon Junctions. Does the Sc3N Cluster Control the Addition Pattern or Vice Versa?","Journal of the American Chemical Society","2009","131","","17630","17637","10.1021/ja9069216","","","0.4428","synchrotron","","0.1157","0.0661","","","0.1599","0.1894","","","","","","1.071","","","","has coordinates,has disorder","194623","2020-10-21","18:00:00",""
"4105432","13.8756","0.0006","15.3985","0.0007","16.7884","0.0007","73.911","0.003","88.258","0.003","74.257","0.003","3313.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","incar(mu~3~nitridotriscandium)-2,4,10,16,20,23,25,34,46,53,57,62,65,68,71,74- Hexadecakis(trifluoromethyl)- 2,4,10,16,20,23,25,34,46,53,57,62,65,68,71,74- hexadecahydro(C~80~-<i>I~h~</i>(7))[5,6])fullerene","","- C96 F48 N Sc3 -","- C96 F48 N Sc3 -","- C192 F96 N2 Sc6 -","2","1","","Natalia B. Shustova; Yu-Sheng Chen; Mary A. Mackey; Curtis E. Coumbe; J. Paige Phillips; Steven Stevenson; Alexey A. Popov; Olga V. Boltalina; Steven H. Strauss","Sc3N@(C80-Ih(7))(CF3)14 and Sc3N@(C80-Ih(7))(CF3)16. Endohedral Metallofullerene Derivatives with Exohedral Addends on Four and Eight Triple-Hexagon Junctions. Does the Sc3N Cluster Control the Addition Pattern or Vice Versa?","Journal of the American Chemical Society","2009","131","","17630","17637","10.1021/ja9069216","","","0.7749","synchrotron","","0.0629","0.0437","","","0.1133","0.1253","","","","","","1.01","","","","has coordinates,has disorder","194623","2020-10-21","18:00:00",""
"4105433","9.9261","0.0001","21.6927","0.0003","23.8136","0.0003","87.5427","0.0005","84.6721","0.0005","81.838","0.0005","5051.47","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H51.81 B33 I33 O23.15 -","- C3 H51.816 B33 I33 O23.158 -","- C6 H103.632 B66 I66 O46.316 -","2","1","","Evgenii S. Stoyanov; Irina V. Stoyanova; Fook S. Tham; Christopher A. Reed","Haq+ Structures in Proton Wires inside Nanotubes","Journal of the American Chemical Society","2009","131","","17540","17541","10.1021/ja907708g","","","0.71073","MoKα","","0.0295","0.026","","","0.0588","0.0601","","","","","","1.137","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105434","25.976","0.005","25.976","0.005","25.976","0.005","90","","90","","90","","17527","6","100","2","100","2","","","","","","","","5","F m -3","-F 2 2 3","202","","","","- C91.76 H60 N55.92 O59.2 Zn12 -","- C91.76 H60 N55.92 O59.2 Zn12.0002 -","- C367.04 H240 N223.68 O236.8 Zn48.0008 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0925","0.0794","","","0.1881","0.1953","","","","","","1.169","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105435","23.1553","0.0015","23.1553","0.0015","23.1553","0.0015","90","","90","","90","","12415.1","1.4","100","2","100","2","","","","","","","","6","F m -3","-F 2 2 3","202","","","","- C76.2 H16.8 K8 N29.4 O65.08 Zn8 -","- C76.2 H16.8 K8 N29.4 O65.08 Zn8 -","- C304.8 H67.2 K32 N117.6 O260.32 Zn32 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0869","0.0795","","","0.2277","0.2351","","","","","","1.141","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105436","40.637","0.005","40.637","0.005","39.063","0.007","90","","90","","120","","55865","14","100","2","100","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- C70.4 H50 Cd8 N28 Na8 O90.32 -","- C70.4 H50 Cd8 N28 Na8 O91.92 -","- C633.6 H450 Cd72 N252 Na72 O827.28 -","9","0.25","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.1238","0.0983","","","0.2308","0.2463","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105437","23.7179","0.0019","23.7179","0.0019","23.7179","0.0019","90","","90","","90","","13342.2","1.9","100","2","100","2","","","","","","","","6","F m -3","-F 2 2 3","202","","","","- C60 H24 Cd8 K8 N24 O68.52 -","- C60 H24 Cd8 K8 N24 O68.52 -","- C240 H96 Cd32 K32 N96 O274.08 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0964","0.088","","","0.2242","0.2298","","","","","","1.155","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105438","24.593","0.002","24.593","0.002","24.593","0.002","90","","90","","90","","14874","2","100","2","100","2","","","","","","","","6","F m -3","-F 2 2 3","202","","","","- C72 H48 Cd8 Cs8 N28 O60 -","- C71.9999 H47.9998 Cd8 Cs7.9992 N28 O60.0001 -","- C288 H191.999 Cd32 Cs31.9968 N112 O240 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0891","0.0794","","","0.2001","0.2091","","","","","","1.072","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105439","26.291","0.006","26.291","0.006","26.291","0.006","90","","90","","90","","18173","7","100","2","100","2","","","","","","","","5","F m -3","-F 2 2 3","202","","","","- C86.24 H60 Mn12 N55.92 O60.16 -","- C86.24 H60 Mn12.0002 N55.92 O60.16 -","- C344.96 H240 Mn48.0008 N223.68 O240.64 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0952","0.0841","","","0.232","0.2416","","","","","","1.208","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105440","25.928","0.003","25.928","0.003","25.928","0.003","90","","90","","90","","17430","3","100","2","100","2","","","","","","","","5","F m -3","-F 2 2 3","202","","","","- C91.76 H60 Co12 N55.92 O57 -","- C91.76 H60 Co12.0002 N55.92 O57 -","- C367.04 H240 Co48.0008 N223.68 O228 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0815","0.0671","","","0.1849","0.1949","","","","","","1.099","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105441","26.123","0.004","26.123","0.004","26.123","0.004","90","","90","","90","","17827","5","100","2","100","2","","","","","","","","5","F m -3","-F 2 2 3","202","","","","- C75.92 H91.68 In8 N51.96 O70.6 -","- C75.92 H91.68 In8 N51.96 O70.6 -","- C303.68 H366.72 In32 N207.84 O282.4 -","4","0.0416667","","Mohamed H. Alkordi; Jacilynn A. Brant; Lukasz Wojtas; Victor Ch. Kravtsov; Amy J. Cairns; Mohamed Eddaoudi","Zeolite-likeMetal-Organic Frameworks (ZMOFs) Based on the Directed Assembly of Finite Metal-Organic Cubes (MOCs)","Journal of the American Chemical Society","2009","131","","17753","17755","10.1021/ja905557z","","","0.71073","MoKα","","0.0781","0.0602","","","0.1789","0.194","","","","","","1.11","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105442","10.9903","0.0002","12.2569","0.0003","10.5191","0.0002","90","","90","","90","","1417","0.05","223","2","223","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C12 H23 N2 P -","- C12 H23 N2 P -","- C48 H92 N8 P4 -","4","0.5","","Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Remarkable Product Diversity in the ""Self-Organized"" Reaction of Deprotonated Acetonitrile with Chlorophosphines","Journal of the American Chemical Society","2009","131","","17836","17842","10.1021/ja905676a","","","1.54178","CuKα","","0.0302","0.0299","","","0.0771","0.0774","","","","","","1.073","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105443","10.8532","0.0001","10.8128","0.0001","11.7494","0.0001","111.657","0.001","98.605","0.001","110.65","0.001","1135.43","0.03","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H44 P2 -","- C24 H44 P2 -","- C48 H88 P4 -","2","1","","Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Remarkable Product Diversity in the ""Self-Organized"" Reaction of Deprotonated Acetonitrile with Chlorophosphines","Journal of the American Chemical Society","2009","131","","17836","17842","10.1021/ja905676a","","","1.54178","CuKα","","0.0452","0.0424","","","0.1145","0.1174","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105444","8.7518","0.0004","15.1375","0.0005","15.6376","0.0007","97.622","0.002","91.057","0.002","97.509","0.002","2034.41","0.15","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H74 N2 P4 -","- C36 H74 N2 P4 -","- C72 H148 N4 P8 -","2","1","","Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Remarkable Product Diversity in the ""Self-Organized"" Reaction of Deprotonated Acetonitrile with Chlorophosphines","Journal of the American Chemical Society","2009","131","","17836","17842","10.1021/ja905676a","","","1.54178","CuKα","","0.0526","0.0513","","","0.1356","0.137","","","","","","1.026","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105445","30.2865","0.0002","30.2865","0.0002","14.7582","0.0002","90","","90","","90","","13537.3","0.2","223","2","223","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C38 H45 N P2 -","- C38 H45 N P2 -","- C608 H720 N16 P32 -","16","1","","Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Remarkable Product Diversity in the ""Self-Organized"" Reaction of Deprotonated Acetonitrile with Chlorophosphines","Journal of the American Chemical Society","2009","131","","17836","17842","10.1021/ja905676a","","","0.71073","MoKα","","0.099","0.0489","","","0.1157","0.1356","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105446","18.0863","0.0005","9.8117","0.0003","21.5144","0.0007","90","","95.016","0.002","90","","3803.3","0.2","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H66 N P3 -","- C38 H66 N P3 -","- C152 H264 N4 P12 -","4","1","","Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker","Remarkable Product Diversity in the ""Self-Organized"" Reaction of Deprotonated Acetonitrile with Chlorophosphines","Journal of the American Chemical Society","2009","131","","17836","17842","10.1021/ja905676a","","","1.54178","CuKα","","0.0461","0.0432","","","0.1169","0.1198","","","","","","1.039","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105447","34.173","0.005","6.704","0.002","16.712","0.004","90","","102.82","0.02","90","","3733.2","1.6","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C27 H20 O2 -","- C27 H20 O2 -","- C216 H160 O16 -","8","1","","Lutz F. Tietze; Alexander Düfert; Florian Lotz; Lars Sölter; Kawon Oum; Thomas Lenzer; Tobias Beck; Regine Herbst-Irmer","Synthesis of Chiroptical Molecular Switches by Pd-Catalyzed Domino Reactions","Journal of the American Chemical Society","2009","131","","17879","17884","10.1021/ja906260x","","","1.54178","CuKα","","0.0349","0.0332","","","0.0839","0.0853","","","","","","1.038","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105448","34.633","0.005","6.646","0.002","16.353","0.004","90","","106.62","0.03","90","","3606.7","1.6","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 O3 -","- C26 H18 O3 -","- C208 H144 O24 -","8","1","","Lutz F. Tietze; Alexander Düfert; Florian Lotz; Lars Sölter; Kawon Oum; Thomas Lenzer; Tobias Beck; Regine Herbst-Irmer","Synthesis of Chiroptical Molecular Switches by Pd-Catalyzed Domino Reactions","Journal of the American Chemical Society","2009","131","","17879","17884","10.1021/ja906260x","","","1.54178","CuKα","","0.0523","0.0344","","","0.0804","0.0894","","","","","","1.017","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105449","18.491","0.009","9.143","0.009","19.97","0.005","90","","104.27","0.05","90","","3272","4","123.1","","123.1","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H44 Cl5 Ga P4 -","- C24 H44 Cl5 Ga P4 -","- C96 H176 Cl20 Ga4 P16 -","4","1","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.7107","MoKα","","","0.059","","","","0.0589","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105450","17.807","0.0004","17.9537","0.0003","31.5222","0.0008","90","","90","","90","","10077.7","0.4","123.1","","123.1","0.2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H44 Cl16 Ga4 P4 -","- C24 H44 Cl16 Ga4 P4 -","- C192 H352 Cl128 Ga32 P32 -","8","1","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.7107","MoKα","","","0.0478","","","","0.0593","","","","","","0.97","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105451","10.1235","0.0002","10.1235","0.0002","12.411","0.0005","90","","90","","90","","1271.94","0.06","153","2","153","1","","","","","","","","3","P -4 21 c","P -4 2n","114","","","","- C24 H44 P4 -","- C24 H44 P4 -","- C48 H88 P8 -","2","0.25","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.71073","MoKα","","0.0222","0.0213","","","0.0573","0.0583","","","","","","1.112","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105452","9.74","0.002","12.396","0.003","28.66","0.007","90","","90.19","0.01","90","","3460.3","1.4","123.1","","123.1","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H40 Cl8 Ga2 P4 -","- C18 H40 Cl8 Ga2 P4 -","- C72 H160 Cl32 Ga8 P16 -","4","1","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.71069","MoKα","","","0.0662","","","","0.1876","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105453","8.783","0.002","13.74","0.003","26.015","0.01","90","","91.964","0.016","90","","3137.6","1.6","123.1","","123.1","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 Cl7 Ga P -","- C6 H11 Cl7 Ga P -","- C48 H88 Cl56 Ga8 P8 -","8","2","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.7107","MoKα","","","0.0386","","","","0.0427","","","","","","1.114","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105454","12.2913","0.0004","14.8034","0.0005","14.9881","0.0006","90","","90","","90","","2727.13","0.17","153","2","153","1","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C12 H27 Cl8 Ga2 P3 -","- C12 H27 Cl8 Ga2 P3 -","- C48 H108 Cl32 Ga8 P12 -","4","1","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.71073","MoKα","","0.0298","0.0259","","","0.0562","0.0579","","","","","","1.026","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105455","10.5502","0.0003","13.5437","0.0005","13.9971","0.0005","101.395","0.0017","93.704","0.0012","99.35","0.0016","1924.86","0.11","123.1","","123.1","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C24.5 H45 Cl Ga I5 P4 -","- C24.5 H45 Cl Ga I5 P4 -","- C49 H90 Cl2 Ga2 I10 P8 -","2","1","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.7107","MoKα","","","0.0258","","","","0.0305","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105456","6.1146","0.0003","13.5142","0.001","13.7921","0.001","90","","90","","90","","1139.7","0.13","123.1","","123.1","0.2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Cl8 Ga P -","- Cl8 Ga P -","- Cl32 Ga4 P4 -","4","0.5","","Jan J. Weigand; Neil Burford; Reagan J. Davidson; T. Stanley Cameron; Patrick Seelheim","New Synthetic Procedures to Catena-Phosphorus Cations: Preparation and Dissociation of the First cyclo-Phosphino-halophosphonium Salts","Journal of the American Chemical Society","2009","131","","17943","17953","10.1021/ja907693f","","","0.7107","MoKα","","","0.0338","","","","0.0376","","","","","","1.098","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105457","8.3711","0.0008","10.574","0.001","12.9188","0.0013","66.405","0.009","71.879","0.009","85.019","0.008","995.01","0.19","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H18 F6 N2 O7 S2 -","- C12 H18 F6 N2 O7 S2 -","- C24 H36 F12 N4 O14 S4 -","2","1","","Michael J. Corr; Mark D. Roydhouse; Kirsty F. Gibson; Sheng-ze Zhou; Alan R. Kennedy; John A. Murphy","Amidine Dications as Superelectrophiles","Journal of the American Chemical Society","2009","131","","17980","17985","10.1021/ja908191k","","","1.5418","CuKα","","0.0728","0.0668","","","0.2089","0.2175","","","","","","1.117","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105458","10.6076","0.0003","14.4559","0.0004","18.4307","0.0006","90","","93.899","0.003","90","","2819.67","0.14","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 F9 N4 O9 S3 -","- C19 H29 F9 N4 O9 S3 -","- C76 H116 F36 N16 O36 S12 -","4","1","","Michael J. Corr; Mark D. Roydhouse; Kirsty F. Gibson; Sheng-ze Zhou; Alan R. Kennedy; John A. Murphy","Amidine Dications as Superelectrophiles","Journal of the American Chemical Society","2009","131","","17980","17985","10.1021/ja908191k","","","0.71073","MoKα","","0.1024","0.049","","","0.0958","0.1039","","","","","","0.833","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105459","17.171","0.003","13.684","0.002","19.16","0.004","90","","91.517","0.003","90","","4500.4","1.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","{[Me2NN]Ni}2(m-h2:h2-ONAr)","","","- C50 H59 N5 Ni2 O -","- C50 H59 N5 Ni2 O -","- C200 H236 N20 Ni8 O4 -","4","1","","Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren","Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts","Journal of the American Chemical Society","2009","131","","18105","18111","10.1021/ja903550n","","","0.71073","MoKα","","0.1097","0.0547","","","0.1168","0.1289","","","","","","0.991","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105460","35.714","0.011","11.67","0.002","23.333","0.005","90","","93.64","0.02","90","","9705","4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","{[Me2NN]Cu}2(m-h2:h1-ONAr) + 0.5 ether","","","- C52 H64 Cu2 N5 O1.5 -","- C52 H64 Cu2 N5 O1.5 -","- C416 H512 Cu16 N40 O12 -","8","1","","Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren","Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts","Journal of the American Chemical Society","2009","131","","18105","18111","10.1021/ja903550n","","","0.71073","MoKα","","0.1281","0.0832","","","0.1881","0.2053","","","","","","1.083","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105461","16.0009","0.0014","11.3762","0.001","23.591","0.002","90","","90.729","0.001","90","","4293.9","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{[Me2NN]Cu}2(m-h2:h1-ONPh)","","","- C48 H55 Cu2 N5 O -","- C48 H55 Cu2 N5 O -","- C192 H220 Cu8 N20 O4 -","4","1","","Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren","Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts","Journal of the American Chemical Society","2009","131","","18105","18111","10.1021/ja903550n","","","0.71073","MoKα","","0.0458","0.0374","","","0.0973","0.1047","","","","","","1.119","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105462","11.992","0.004","14.491","0.005","15.118","0.005","90","","90","","90","","2627.1","1.5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","[Me2NN]Cu(h2-ONAr)","","","- C29 H34 Cu N3 O -","- C29 H34 Cu N3 O -","- C116 H136 Cu4 N12 O4 -","4","1","","Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren","Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts","Journal of the American Chemical Society","2009","131","","18105","18111","10.1021/ja903550n","","","0.71073","MoKα","","0.1016","0.0518","","","0.1076","0.1211","","","","","","0.989","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105463","11.752","0.002","33.35","0.006","12.6","0.002","90","","101.014","0.002","90","","4847.3","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Me2NN]Cu(h2-ONPh)","","","- C27 H30 Cu N3 O -","- C27 H30 Cu N3 O -","- C216 H240 Cu8 N24 O8 -","8","2","","Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren","Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts","Journal of the American Chemical Society","2009","131","","18105","18111","10.1021/ja903550n","","","0.71073","MoKα","","0.087","0.063","","","0.1621","0.1713","","","","","","1.063","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105464","7.175","0.002","12.144","0.004","15.621","0.005","98.327","0.01","99.958","0.012","91.137","0.01","1325.1","0.7","173","2","273","2","","","","","","","","5","P -1","-P 1","2","[Me2NN]Cu(k2-O2N2Ar)","","","- C29 H34 Cu N4 O2 -","- C29 H34 Cu N4 O2 -","- C58 H68 Cu2 N8 O4 -","2","1","","Stefan Wiese; Pooja Kapoor; Kamille D. Williams; Timothy H. Warren","Nitric Oxide Oxidatively Nitrosylates Ni(I) and Cu(I) C-Organonitroso Adducts","Journal of the American Chemical Society","2009","131","","18105","18111","10.1021/ja903550n","","","0.71073","MoKα","","0.1047","0.0532","","","0.1145","0.1262","","","","","","0.965","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105465","9.4955","0.0017","8.512","0.0015","17.129","0.003","90","","98.142","0.003","90","","1370.5","0.4","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C11 H22 O6 -","- C11 H22 O6 -","- C44 H88 O24 -","4","2","","Karla Ramírez-Gualito; Rosa Alonso-Ríos; Beatriz Quiroz-García; Aarón Rojas-Aguilar; Dolores Díaz; Jesús Jiménez-Barbero; Gabriel Cuevas","Enthalpic Nature of the CH/π Interaction Involved in the Recognition of Carbohydrates by Aromatic Compounds, Confirmed by a Novel Interplay of NMR, Calorimetry, and Theoretical Calculations","Journal of the American Chemical Society","2009","131","","18129","18138","10.1021/ja903950t","","","0.71073","MoKα","","0.0977","0.0551","","","0.1161","0.1339","","","","","","0.982","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105466","7.151","0.0001","22.716","0.0002","10.1132","0.0002","90","","100.7","0.5","90","","1614","3","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 La Na O12 P4 -","- C8 H6 La Na O12.5 P4 -","- C32 H24 La4 Na4 O50 P16 -","4","1","","Monika Plabst; Lynne B. McCusker; Thomas Bein","Exceptional Ion-Exchange Selectivity in a Flexible Open Framework Lanthanum(III) tetrakisphosphonate","Journal of the American Chemical Society","2009","131","","18112","18118","10.1021/ja904636y","powder diffraction","","","","","0.055","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105467","10.601","0.007","11.556","0.008","13.229","0.009","102.846","0.009","104.607","0.01","97.276","0.005","1500","1.8","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H33 Br -","- C40 H33 Br -","- C80 H66 Br2 -","2","1","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.0853","0.0585","","","0.1351","0.1529","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105468","10.426","0.003","10.58","0.004","13.082","0.004","106.334","0.004","92.053","0.002","108.086","0.004","1304.3","0.7","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C56 H90 Br2 Cu4 -","- C56 H90 Br2 Cu4 -","- C56 H90 Br2 Cu4 -","1","0.5","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.0739","0.0498","","","0.1104","0.1443","","","","","","1.19","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105469","10.8203","0.0015","13.1963","0.0019","16.471","0.002","93.367","0.002","93.257","0.002","102.391","0.002","2287.3","0.5","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H62 Cu Li O2 Si -","- C53 H62 Cu Li O2 Si -","- C106 H124 Cu2 Li2 O4 Si2 -","2","1","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.0685","0.059","","","0.1655","0.1752","","","","","","1.072","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105470","10.5552","0.0018","11.339","0.002","15.234","0.003","83.017","0.007","73.241","0.006","70.01","0.006","1640.1","0.5","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C66 H108 Cu4 Si2 -","- C66 H108 Cu4 Si2 -","- C66 H108 Cu4 Si2 -","1","0.5","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.0428","0.0331","","","0.0816","0.0872","","","","","","1.047","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105471","9.985","0.003","20.779","0.005","18.111","0.005","90","","102.684","0.003","90","","3665.9","1.7","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C45 H46 Si -","- C45 H46 Si -","- C180 H184 Si4 -","4","1","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.1102","0.075","","","0.1802","0.2047","","","","","","1.071","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105472","11.8068","0.0017","13.634","0.002","14.852","0.002","78.014","0.005","75.492","0.006","73.742","0.005","2197.5","0.5","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H57 Br Cu Li O3 -","- C52 H57 Br Cu Li O3 -","- C104 H114 Br2 Cu2 Li2 O6 -","2","1","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.0935","0.0659","","","0.1663","0.1848","","","","","","1.069","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105473","10.464","0.002","28.373","0.005","15.696","0.003","90","","104.088","0.003","90","","4519.9","1.5","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H61 Br Cu Li O3 -","- C52 H61 Br Cu Li O3 -","- C208 H244 Br4 Cu4 Li4 O12 -","4","1","","Mikinao Ito; Daisuke Hashizume; Takeo Fukunaga; Tsukasa Matsuo; Kohei Tamao","Isolated Monomeric and Dimeric Mixed Diorganocuprates Based on the Size-Controllable Bulky ""Rind"" Ligands","Journal of the American Chemical Society","2009","131","","18024","18025","10.1021/ja9071964","","","0.71073","MoKα","","0.1","0.0721","","","0.1845","0.2092","","","","","","1.058","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105474","11.6336","0.0006","18.5857","0.0008","18.3671","0.0009","90","","92.772","0.002","90","","3966.7","0.3","150","2","150","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C35 H58 F3 N O3 P2 Pt Ru2 S -","- C35 H58 F3 N O3 P2 Pt Ru2 S -","- C140 H232 F12 N4 O12 P8 Pt4 Ru8 S4 -","4","1","","Shin Takemoto; Hidenobu Morita; Kenji Karitani; Hideki Fujiwara; Hiroyuki Matsuzaka","A Bimetallic Ru2Pt Complex Containing a Trigonal-Planar μ3-Carbido Ligand: Formation, Structure, and Reactivity Relevant to the Fischer-Tropsch Process","Journal of the American Chemical Society","2009","131","","18026","18027","10.1021/ja907387w","","","0.71075","MoKα","","0.0442","0.0342","","","0.081","0.0907","","","","","","1.073","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105475","8.9775","0.0003","22.5389","0.0008","10.0483","0.0004","90","","97.942","0.001","90","","2013.7","0.13","296","2","296","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C35 H58 F3 N O3 P2 Pt Ru2 S -","- C35 H57 F3 N O3 P2 Pt Ru2 S -","- C70 H114 F6 N2 O6 P4 Pt2 Ru4 S2 -","2","1","","Shin Takemoto; Hidenobu Morita; Kenji Karitani; Hideki Fujiwara; Hiroyuki Matsuzaka","A Bimetallic Ru2Pt Complex Containing a Trigonal-Planar μ3-Carbido Ligand: Formation, Structure, and Reactivity Relevant to the Fischer-Tropsch Process","Journal of the American Chemical Society","2009","131","","18026","18027","10.1021/ja907387w","","","0.71075","MoKα","","0.0367","0.0345","","","0.0774","0.0905","","","","","","1.037","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105476","12.3348","0.0006","12.4787","0.0005","15.2195","0.0006","88.359","0.001","77.721","0.001","87.216","0.001","2285.93","0.17","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H60 B N O2 Ru2 -","- C54 H60 B N O2 Ru2 -","- C108 H120 B2 N2 O4 Ru4 -","2","1","","Shin Takemoto; Hidenobu Morita; Kenji Karitani; Hideki Fujiwara; Hiroyuki Matsuzaka","A Bimetallic Ru2Pt Complex Containing a Trigonal-Planar μ3-Carbido Ligand: Formation, Structure, and Reactivity Relevant to the Fischer-Tropsch Process","Journal of the American Chemical Society","2009","131","","18026","18027","10.1021/ja907387w","","","0.71075","MoKα","","0.041","0.0307","","","0.0932","0.1114","","","","","","1.111","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105477","10.7624","0.0005","7.9949","0.0002","10.9354","0.0004","90","","118.459","0.005","90","","827.23","0.07","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H19 N3 O -","- C20 H19 N3 O -","- C40 H38 N6 O2 -","2","1","","Danny C. Hsu; Polo C.-H. Lam; Carla Slebodnick; Paul R. Carlier","Complete Mapping of the Stereochemical Course of Retentive Deprotonation/Alkylation of 1H-Benzo[e][1,4]diazepin-2(3H)-ones","Journal of the American Chemical Society","2009","131","","18168","18176","10.1021/ja907507j","","x-ray","1.54178","CuKα","","0.0345","0.0338","","","0.089","0.09","","","","","","1.038","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105478","11.0406","0.0004","10.7876","0.0004","13.5147","0.0005","90","","102.36","0.004","90","","1572.31","0.1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H20 N2 O -","- C19 H20 N2 O -","- C76 H80 N8 O4 -","4","2","","Danny C. Hsu; Polo C.-H. Lam; Carla Slebodnick; Paul R. Carlier","Complete Mapping of the Stereochemical Course of Retentive Deprotonation/Alkylation of 1H-Benzo[e][1,4]diazepin-2(3H)-ones","Journal of the American Chemical Society","2009","131","","18168","18176","10.1021/ja907507j","","x-ray","0.71073","MoKα","","0.0532","0.0388","","","0.0822","0.0865","","","","","","0.944","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105479","10.4607","0.0005","14.0476","0.0005","16.0488","0.0006","90","","90","","90","","2358.33","0.17","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H34 N2 O Si -","- C25 H34 N2 O Si -","- C100 H136 N8 O4 Si4 -","4","1","","Danny C. Hsu; Polo C.-H. Lam; Carla Slebodnick; Paul R. Carlier","Complete Mapping of the Stereochemical Course of Retentive Deprotonation/Alkylation of 1H-Benzo[e][1,4]diazepin-2(3H)-ones","Journal of the American Chemical Society","2009","131","","18168","18176","10.1021/ja907507j","","x-ray","1.54178","CuKα","","0.047","0.0329","","","0.0646","0.0714","","","","","","0.915","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105480","5.4264","0.0005","8.6712","0.0007","32.044","0.003","90","","90","","90","","1507.8","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H19 N O2 S -","- C17 H19 N O2 S -","- C68 H76 N4 O8 S4 -","4","1","","Stepan Chuprakov; Sen Wai Kwok; Li Zhang; Lukas Lercher; Valery V. Fokin","Rhodium-Catalyzed Enantioselective Cyclopropanation of Olefins with N-Sulfonyl 1,2,3-Triazoles","Journal of the American Chemical Society","2009","131","","18034","18035","10.1021/ja908075u","","","1.54178","CuKα","","0.0278","0.0254","","","0.0641","0.0652","","","","","","1.047","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105481","17.401","0.004","31.951","0.009","9.613","0.002","90","","95.45","0.02","90","","5320","2","299","","299","","","","","","","","Local laboratory","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H50 Fe N7 O10 P2 -","- C57 H50 Fe N7 O10 P2 -","- C228 H200 Fe4 N28 O40 P8 -","4","1","","William Chadwick Ellis; Camly T. Tran; Matthew A. Denardo; Andreas Fischer; Alexander D. Ryabov; Terrence J. Collins","Design of More Powerful Iron-TAML Peroxidase Enzyme Mimics","Journal of the American Chemical Society","2009","131","","18052","18053","10.1021/ja9086837","","","0.71073","MoKα","","0.0779","0.0488","","","0.0942","0.1069","","","","","","1.086","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105482","43.572","0.004","5.0329","0.0005","12.2533","0.0011","90","","105.356","0.002","90","","2591.1","0.4","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Zn(C6H5-CN4-C6H4CO2)2(H2O)2","","","- C28 H22 N8 O6 Zn -","- C28 H22 N8 O6 Zn -","- C112 H88 N32 O24 Zn4 -","4","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0399","0.0312","","","0.0778","0.0828","","","","","","1.104","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105483","17.751","0.007","6.019","0.002","23.625","0.009","90","","90.99","0.01","90","","2523.8","1.6","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Zn(CO2C6H5-CN4-C6H4NH2)2","","","- C28 H20 N10 O4 Zn -","- C28 H20 N10 O4 Zn -","- C112 H80 N40 O16 Zn4 -","4","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.2136","0.0649","","","0.1382","0.2104","","","","","","0.975","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105484","16.3473","0.001","6.2913","0.0004","7.0714","0.0004","90","","95.929","0.002","90","","723.37","0.08","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Zn(CO2C6H5-CN4-C6H4CO2)(H2O)2","","","- C15 H10 N4 O5 Zn -","- C15 H10 N4 O5 Zn -","- C30 H20 N8 O10 Zn2 -","2","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0321","0.0264","","","0.0693","0.072","","","","","","1.104","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105485","16.3448","0.0017","6.3194","0.0007","7.1439","0.0007","90","","96.469","0.003","90","","733.19","0.13","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C15 H10 N3.89 O5 Zn -","- C15 H10 N3.894 O5 Zn -","- C30 H20 N7.788 O10 Zn2 -","2","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0582","0.0437","","","0.1087","0.1167","","","","","","1.129","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105486","6.0952","0.0011","10.4482","0.0019","25.943","0.005","90","","102.915","0.004","90","","1610.4","0.5","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Zn(CO2C6H5-CN4-C6H4CO2)(NH3)2","","","- C15 H14 N6 O4 Zn -","- C15 H14 N6 O4 Zn -","- C60 H56 N24 O16 Zn4 -","4","1","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0706","0.0413","","","0.0843","0.0953","","","","","","1.05","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105487","12.4251","0.0009","5.2084","0.0004","19.7678","0.0014","90","","106.999","0.002","90","","1223.38","0.16","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zn(CO2-C6H4-CN4-C6H4-OH2)2(H2O)4(CH3OH)2","","","- C18 H26 N8 O12 Zn -","- C18 H26 N8 O12 Zn -","- C36 H52 N16 O24 Zn2 -","2","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.0302","0.0248","","","0.0593","0.0616","","","","","","1.057","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105488","7.2682","0.0004","7.2725","0.0004","12.8156","0.0007","86.806","0.001","84.082","0.001","63.867","0.001","604.88","0.06","90","2","90","2","","","","","","","","5","P -1","-P 1","2","[NH4][Zn(CO2-CN4-C6H4-CO2)(H2O)2]","","","- C18 H24 N10 O12 Zn -","- C18 H24 N10 O12 Zn -","- C18 H24 N10 O12 Zn -","1","0.5","","Shao-Liang Zheng; Yizhong Wang; Zhipeng Yu; Qing Lin; Philip Coppens","Direct Observation of a Photoinduced Nonstabilized Nitrile Imine Structure in the Solid State","Journal of the American Chemical Society","2009","131","","18036","18037","10.1021/ja9094523","","x-ray","0.71073","MoKα","","0.024","0.0229","","","0.0619","0.0626","","","","","","1.089","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105489","12.674","0.003","13.515","0.003","16.916","0.004","93.453","0.016","104.094","0.016","113.797","0.013","2530","1.1","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H68 Co N6 O8 -","- C50 H68 Co N6 O8 -","- C100 H136 Co2 N12 O16 -","2","1","","Martin L. Kirk; David A. Shultz; Robert D. Schmidt; Diana Habel-Rodriguez; Hyoyoung Lee; Junghyun Lee","Ferromagnetic Nanoscale Electron Correlation Promoted by Organic Spin-Dependent Delocalization","Journal of the American Chemical Society","2009","131","","18304","18313","10.1021/ja904648r","","","1.5418","CuKα","","0.287","0.0829","","","0.1661","0.2306","","","","","","0.665","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105490","8.5888","0.0011","13.3339","0.0016","15.1952","0.0019","83.7898","0.0018","84.083","0.002","81.527","0.002","1704.4","0.4","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C64.32 H80.65 Cl4.65 Co N6 O8 -","- C64.324 H80.648 Cl4.648 Co N6 O8 -","- C64.324 H80.648 Cl4.648 Co N6 O8 -","1","0.5","","Martin L. Kirk; David A. Shultz; Robert D. Schmidt; Diana Habel-Rodriguez; Hyoyoung Lee; Junghyun Lee","Ferromagnetic Nanoscale Electron Correlation Promoted by Organic Spin-Dependent Delocalization","Journal of the American Chemical Society","2009","131","","18304","18313","10.1021/ja904648r","","","0.71073","MoKα","","0.1163","0.0798","","","0.226","0.261","","","","","","1.045","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105491","10.102","0.01","5.802","0.006","15.213","0.015","90","","103.938","0.017","90","","865.4","1.5","168","","168","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H24 O -","- C23 H24 O -","- C46 H48 O2 -","2","1","","Barry M. Trost; Jiayi Xu; Thomas Schmidt","Palladium-Catalyzed Decarboxylative Asymmetric Allylic Alkylation of Enol Carbonates","Journal of the American Chemical Society","2009","131","","18343","18357","10.1021/ja9053948","","","0.71073","MoKα","","0.0686","0.0446","","","0.0929","0.1024","","","","","","1.037","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105492","10.0657","0.0004","25.801","0.0011","17.638","0.0007","90","","90.139","0.004","90","","4580.7","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C61 H52 P2 Ru -","- C61 H52 P2 Ru -","- C244 H208 P8 Ru4 -","4","1","","Chia-Pei Chung; Chien-Chih Chen; Ying-Chih Lin; Yi-Hong Liu; Yu Wang","Reactions of Ruthenium Cp Phosphine Complex with 4,4-Disubstituted-1,6-Enynes: Effect of Methyl Substituents in the Olefinic Fraction","Journal of the American Chemical Society","2009","131","","18366","18375","10.1021/ja906745j","","","0.71073","MoKα","","0.049","0.0329","","","0.0807","0.0847","","","","","","1.03","","","","has coordinates,has disorder","178800","2020-10-21","18:00:00",""
"4105493","11.282","0.002","21.112","0.004","22.568","0.005","90","","91.06","0.03","90","","5374.5","1.8","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60.5 H53 F6 O0.5 P3 Ru -","- C60.5 H53 F6 O0.5 P3 Ru -","- C242 H212 F24 O2 P12 Ru4 -","4","1","","Chia-Pei Chung; Chien-Chih Chen; Ying-Chih Lin; Yi-Hong Liu; Yu Wang","Reactions of Ruthenium Cp Phosphine Complex with 4,4-Disubstituted-1,6-Enynes: Effect of Methyl Substituents in the Olefinic Fraction","Journal of the American Chemical Society","2009","131","","18366","18375","10.1021/ja906745j","","","0.71073","MoKα","","0.0667","0.0414","","","0.1176","0.1335","","","","","","1.074","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105494","13.9207","0.0003","13.9477","0.0004","22.7647","0.0007","85.489","0.002","75.201","0.002","82.549","0.002","4232.5","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H47 F6 O1.5 P2 Ru -","- C47 H47 F6 O1.5 P2 Ru -","- C188 H188 F24 O6 P8 Ru4 -","4","2","","Chia-Pei Chung; Chien-Chih Chen; Ying-Chih Lin; Yi-Hong Liu; Yu Wang","Reactions of Ruthenium Cp Phosphine Complex with 4,4-Disubstituted-1,6-Enynes: Effect of Methyl Substituents in the Olefinic Fraction","Journal of the American Chemical Society","2009","131","","18366","18375","10.1021/ja906745j","","","0.71073","MoKα","","0.1066","0.0518","","","0.1219","0.1385","","","","","","0.902","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105495","9.957","0.0002","36.5312","0.0008","13.9075","0.0003","90","","105.754","0.002","90","","4868.71","0.19","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C61 H56 O P2 Ru -","- C61 H56 O P2 Ru -","- C244 H224 O4 P8 Ru4 -","4","1","","Chia-Pei Chung; Chien-Chih Chen; Ying-Chih Lin; Yi-Hong Liu; Yu Wang","Reactions of Ruthenium Cp Phosphine Complex with 4,4-Disubstituted-1,6-Enynes: Effect of Methyl Substituents in the Olefinic Fraction","Journal of the American Chemical Society","2009","131","","18366","18375","10.1021/ja906745j","","","0.71073","MoKα","","0.0712","0.0536","","","0.1076","0.1124","","","","","","1.12","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105496","10.0106","0.0002","13.8053","0.0003","20.7787","0.0004","72.634","0.001","81.477","0.002","74.846","0.001","2637.72","0.09","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H57 F6 P3 Ru -","- C62 H57 F6 P3 Ru -","- C124 H114 F12 P6 Ru2 -","2","1","","Chia-Pei Chung; Chien-Chih Chen; Ying-Chih Lin; Yi-Hong Liu; Yu Wang","Reactions of Ruthenium Cp Phosphine Complex with 4,4-Disubstituted-1,6-Enynes: Effect of Methyl Substituents in the Olefinic Fraction","Journal of the American Chemical Society","2009","131","","18366","18375","10.1021/ja906745j","","","0.71073","MoKα","","0.1015","0.0671","","","0.1681","0.1873","","","","","","1.113","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105497","9.4519","0.0019","14.714","0.003","15.772","0.003","62.46","0.03","78.78","0.02","82.1","0.03","1904.9","0.8","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H66 Cd3 Cl4 N4 O8 S8 -","- C76 H66 Cd3 Cl4 N4 O8 S8 -","- C76 H66 Cd3 Cl4 N4 O8 S8 -","1","0.5","","Michelle L. Mejía; Kyriacos Agapiou; Xiaoping Yang; Bradley J. Holliday","Seeded Growth of CdS Nanoparticles within a Conducting Metallopolymer Matrix","Journal of the American Chemical Society","2009","131","","18196","18197","10.1021/ja906773g","","","0.71073","MoKα","","0.0649","0.0455","","","0.1161","0.1351","","","","","","1.048","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105498","13.987","0.0012","16.1923","0.0012","14.2982","0.0011","90","","95.248","0.003","90","","3224.7","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H57 N7 O2 Zr -","- C25 H57 N7 O2 Zr -","- C100 H228 N28 O8 Zr4 -","4","1","","David C. Leitch; Philippa R. Payne; Christine R. Dunbar; Laurel L. Schafer","Broadening the Scope of Group 4 Hydroamination Catalysis Using a Tethered Ureate Ligand","Journal of the American Chemical Society","2009","131","","18246","18247","10.1021/ja906955b","","","0.71073","MoKα","","0.0456","0.0334","","","0.0877","0.0943","","","","","","1.033","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4105499","7.873","0.003","26.978","0.01","10.642","0.004","90","","109.945","0.004","90","","2124.8","1.4","293","","293","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C19 H10 Au2 Cl N7 Pb -","- C19 H10 Au2 Cl N7 Pb -","- C76 H40 Au8 Cl4 N28 Pb4 -","4","1","","Michael J. Katz; Daniel B. Leznoff","Highly Birefringent Cyanoaurate Coordination Polymers: The Effect of Polarizable C-X Bonds (X = Cl, Br)","Journal of the American Chemical Society","2009","131","","18435","18444","10.1021/ja907519c","","","0.71073","MoKα","","0.1053","0.0747","","0.5973","0.0822","0.0819","","","","","","3.505","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105500","8.768","0.0003","23.6668","0.0007","11.2028","0.0003","90","","111.505","0.002","90","","2162.87","0.12","150","","150","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C19 H11.48 Au2 Br N7 O0.74 Pb -","- C19 H11.4798 Au2 Br N7 O0.7399 Pb -","- C76 H45.9192 Au8 Br4 N28 O2.9596 Pb4 -","4","1","","Michael J. Katz; Daniel B. Leznoff","Highly Birefringent Cyanoaurate Coordination Polymers: The Effect of Polarizable C-X Bonds (X = Cl, Br)","Journal of the American Chemical Society","2009","131","","18435","18444","10.1021/ja907519c","","","0.71073","MoKα","","0.099","0.0323","","0.065","0.0366","0.0359","","","","","","0.8448","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105501","13.607","0.003","10.612","0.002","32.64","0.007","90","","98.573","0.003","90","","4660.5","1.7","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 Au2 Cl Mn N7 O0.5 -","- C19 H11 Au2 Cl Mn N7 O0.5 -","- C152 H88 Au16 Cl8 Mn8 N56 O4 -","8","2","","Michael J. Katz; Daniel B. Leznoff","Highly Birefringent Cyanoaurate Coordination Polymers: The Effect of Polarizable C-X Bonds (X = Cl, Br)","Journal of the American Chemical Society","2009","131","","18435","18444","10.1021/ja907519c","","","0.71073","MoKα","","0.1279","0.0556","","0.5445","0.0655","0.0621","","","","","","1.2911","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4105502","9.4193","0.0015","25.448","0.004","9.8955","0.0016","90","","113.855","0.002","90","","2169.3","0.6","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H10 Au2 Br Mn N7 -","- C19 H10 Au2 Br Mn N7 -","- C76 H40 Au8 Br4 Mn4 N28 -","4","1","","Michael J. Katz; Daniel B. Leznoff","Highly Birefringent Cyanoaurate Coordination Polymers: The Effect of Polarizable C-X Bonds (X = Cl, Br)","Journal of the American Chemical Society","2009","131","","18435","18444","10.1021/ja907519c","","","0.71073","MoKα","","0.0442","0.0225","","0.0265","0.0212","0.0205","","","","","","0.6134","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4105503","18.9665","0.0006","22.4906","0.0008","32.4187","0.001","90","","109.313","0.002","90","","13050.6","0.8","290","2","290","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C160 H214 Ag40 F36 O56 V10 -","- C143 H169 Ag40 F25.7 O54 V10 -","- C286 H338 Ag80 F51.4 O108 V20 -","2","0.5","","Guang-Gang Gao; Ping-Shing Cheng; Thomas C. W. Mak","Acid-Induced Surface Functionalization of Polyoxometalate by Enclosure in a Polyhedral Silver-Alkynyl Cage","Journal of the American Chemical Society","2009","131","","18257","18259","10.1021/ja907900b","","","0.71073","MoKα","","0.1321","0.0579","","","0.1525","0.1998","","","","","","0.997","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105504","22.29","0.003","20.47","0.003","27.561","0.004","90","","93.97","0.005","90","","12545","3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C146 H188 Ag40 F36 Mo6 O48 -","- C110.5 H104 Ag40 F19 Mo6 O45 -","- C221 H208 Ag80 F38 Mo12 O90 -","2","0.5","","Guang-Gang Gao; Ping-Shing Cheng; Thomas C. W. Mak","Acid-Induced Surface Functionalization of Polyoxometalate by Enclosure in a Polyhedral Silver-Alkynyl Cage","Journal of the American Chemical Society","2009","131","","18257","18259","10.1021/ja907900b","","","0.71073","MoKα","","0.1127","0.0583","","","0.1536","0.1957","","","","","","1.025","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105505","15.1091","0.0011","15.8098","0.0012","16.8562","0.0012","113.821","0.001","101.141","0.001","105.902","0.001","3324.5","0.4","190","2","190","2","","","","","","","","6","P -1","-P 1","2","","","","- C98 H134 Ag24 F18 O21 V2 -","- C49 H67 Ag12 F9 O10.5 V -","- C98 H134 Ag24 F18 O21 V2 -","2","1","","Guang-Gang Gao; Ping-Shing Cheng; Thomas C. W. Mak","Acid-Induced Surface Functionalization of Polyoxometalate by Enclosure in a Polyhedral Silver-Alkynyl Cage","Journal of the American Chemical Society","2009","131","","18257","18259","10.1021/ja907900b","","","0.71073","MoKα","","0.0427","0.0372","","","0.0923","0.0981","","","","","","0.994","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105506","14.3076","0.0013","15.8713","0.0014","28.861","0.003","91.321","0.002","90.098","0.002","116.607","0.002","5857.6","1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H117 Ag20 F15 Mo O14 -","- C88 H117 Ag20 F15 Mo O14 -","- C176 H234 Ag40 F30 Mo2 O28 -","2","1","","Guang-Gang Gao; Ping-Shing Cheng; Thomas C. W. Mak","Acid-Induced Surface Functionalization of Polyoxometalate by Enclosure in a Polyhedral Silver-Alkynyl Cage","Journal of the American Chemical Society","2009","131","","18257","18259","10.1021/ja907900b","","","0.71073","MoKα","","0.057","0.0454","","","0.1041","0.114","","","","","","1.049","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105507","7.4204","0.0014","13.393","0.002","17.56","0.003","90","","98.428","0.004","90","","1726.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Br N O2 -","- C20 H18 Br N O2 -","- C80 H72 Br4 N4 O8 -","4","1","","Bai-Lin Lei; Chang-Hua Ding; Xiao-Fei Yang; Xiao-Long Wan; Xue-Long Hou","Kinetic Resolution of 2,3-Dihydro-2-substituted 4-Quinolones by Palladium-Catalyzed Asymmetric Allylic Alkylation","Journal of the American Chemical Society","2009","131","","18250","18251","10.1021/ja9082717","","","0.71073","MoKα","","0.0875","0.0442","","","0.0957","0.1041","","","","","","0.826","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105508","9.9194","0.0012","13.9201","0.0017","15.389","0.0019","90","","101.192","0.003","90","","2084.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 N2 O -","- C26 H26 N2 O -","- C104 H104 N8 O4 -","4","1","","Bai-Lin Lei; Chang-Hua Ding; Xiao-Fei Yang; Xiao-Long Wan; Xue-Long Hou","Kinetic Resolution of 2,3-Dihydro-2-substituted 4-Quinolones by Palladium-Catalyzed Asymmetric Allylic Alkylation","Journal of the American Chemical Society","2009","131","","18250","18251","10.1021/ja9082717","","","0.71073","MoKα","","0.0946","0.0575","","","0.135","0.1596","","","","","","0.9","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105509","14.722","0.0005","6.9461","0.0002","18.2613","0.0006","90","","103.471","0.001","90","","1816.03","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H11 N5 O6 -","- C20 H11 N5 O6 -","- C80 H44 N20 O24 -","4","1","","Guillaume Berionni; Pierre-Alexandre Bertelle; Jérome Marrot; Régis Goumont","X-ray Structure of a CT Complex Relevant to Diels-Alder Reactivity of Anthracenes","Journal of the American Chemical Society","2009","131","","18224","18225","10.1021/ja908747j","","","0.71073","MoKα","","0.2022","0.1173","","","0.3543","0.4249","","","","","","1.353","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105510","7.4085","0.0005","7.0086","0.0005","13.4995","0.0009","90","","95.809","0.001","90","","697.34","0.08","295","2","295","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C17 H21 N O -","- C17 H21 N O -","- C34 H42 N2 O2 -","2","0.5","","Ying-Chieh Wong; Kanniyappan Parthasarathy; Chien-Hong Cheng","Cobalt-Catalyzed Regioselective Synthesis of Pyrrolidinone Derivatives by Reductive Coupling of Nitriles and Acrylamides","Journal of the American Chemical Society","2009","131","","18252","18253","10.1021/ja9088296","","","0.71073","MoKα","","0.0631","0.048","","","0.1315","0.1432","","","","","","1.073","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105511","26.0513","0.0016","8.7146","0.0005","17.4785","0.0011","90","","125.185","0.001","90","","3243.1","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H21 N O2 -","- C20 H21 N O2 -","- C160 H168 N8 O16 -","8","1","","Ying-Chieh Wong; Kanniyappan Parthasarathy; Chien-Hong Cheng","Cobalt-Catalyzed Regioselective Synthesis of Pyrrolidinone Derivatives by Reductive Coupling of Nitriles and Acrylamides","Journal of the American Chemical Society","2009","131","","18252","18253","10.1021/ja9088296","","","0.71073","MoKα","","0.0634","0.0443","","","0.1116","0.1253","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105512","15.97","0.0003","15.97","0.0003","19.09","0.0005","90","","90","","120","","4216.44","0.16","173","1","173","1","","","","","","","","7","P 65","P 65","170","","","","- C29 H29 Cl N O5 P S -","- C29 H28 Cl N O5 P S -","- C174 H168 Cl6 N6 O30 P6 S6 -","6","1","","Shuichi Nakamura; Masashi Hayashi; Yuichi Hiramatsu; Norio Shibata; Yasuhiro Funahashi; Takeshi Toru","Catalytic Enantioselective Hydrophosphonylation of Ketimines Using Cinchona Alkaloids","Journal of the American Chemical Society","2009","131","","18240","18241","10.1021/ja908940e","","","0.7107","MoKα","","","0.0523","","","","0.1556","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4105513","32.529","0.004","6.272","0.0008","36.401","0.005","90","","95.816","0.012","90","","7388.4","1.7","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C39 H36 Au Cl N2 S4 -","- C39 H36 Au Cl N2 S4 -","- C312 H288 Au8 Cl8 N16 S32 -","8","1","","Adam B. Powell; Christopher W. Bielawski; Alan H. Cowley","Electropolymerization of an N-Heterocyclic Carbene-Gold(I) Complex","Journal of the American Chemical Society","2009","131","","18232","18233","10.1021/ja908969q","","","0.71075","MoKα","","0.1038","0.0686","","","0.144","0.161","","","","","","1.224","","","","has coordinates","178801","2020-10-21","18:00:00",""
"4105514","19.5674","0.0005","21.3428","0.0005","7.7545","0.0002","90","","90","","90","","3238.46","0.14","296","2","296","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C19 H17 N3 O2 -","- C19 H17 N3 O2 -","- C152 H136 N24 O16 -","8","1","","Shainaz M. Landge; Ivan Aprahamian","A pH Activated Configurational Rotary Switch: Controlling the E/Z Isomerization in Hydrazones","Journal of the American Chemical Society","2009","131","","18269","18271","10.1021/ja909149z","","x-ray","0.71073","MoKα","","0.0733","0.0409","","","0.095","0.1125","","","","","","1.021","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4111668","8.224","0.001","12.397","0.001","12.573","0.001","104.553","0.003","91.723","0.002","95.255","0.003","1233.6","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","dipropargyl 1-((5-dimethylaminonaphthalene-1-sulfonyl)amidomethyl)-7-oxabicyclo[2.2.1]hept-2,5-diene-2,3-dicarboxylate","","- C27 H24 N2 O7 S -","- C27 H24 N2 O7 S -","- C54 H48 N4 O14 S2 -","2","1","","Hong, Vu; Kislukhin, Alexander A; Finn, M G","Thiol-selective fluorogenic probes for labeling and release.","Journal of the American Chemical Society","2009","131","29","9986","9994","10.1021/ja809345d","","","0.71074","MoKα","","0.0803","0.0572","","","0.1427","0.1556","","","","","","1.015","","","","has coordinates","178887","2020-10-21","18:00:00",""
"4119122","12.8108","0.0004","13.4663","0.0004","13.3937","0.0004","90","","100.156","0.002","90","","2274.4","0.12","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H9 B F15 N -","- C25 H9 B F15 N -","- C100 H36 B4 F60 N4 -","4","1","","Geier, Stephen J.; Stephan, Douglas W.","Lutidine/B(C6F5)3: At the Boundary of Classical and Frustrated Lewis Pair Reactivity","Journal of the American Chemical Society","2009","131","10","3476","3477","10.1021/ja900572x","","","0.71073","MoKα","","0.0709","0.0494","","","0.1275","0.1475","","","","","","1.055","","","","has coordinates","178962","2020-10-21","18:00:00",""
"4119123","17.8525","0.0012","9.8407","0.0007","15.2683","0.001","90","","115.01","0.003","90","","2430.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H11 B F15 N -","- C25 H11 B F15 N -","- C100 H44 B4 F60 N4 -","4","1","","Geier, Stephen J.; Stephan, Douglas W.","Lutidine/B(C6F5)3: At the Boundary of Classical and Frustrated Lewis Pair Reactivity","Journal of the American Chemical Society","2009","131","10","3476","3477","10.1021/ja900572x","","","0.71073","MoKα","","0.1085","0.0516","","","0.1311","0.168","","","","","","1.005","","","","has coordinates","178962","2020-10-21","18:00:00",""
"4119124","17.4334","0.0009","10.6793","0.0006","14.4679","0.0008","90","","90","","90","","2693.6","0.3","296","2","296","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C29 H17 B F15 N O -","- C29 H17 B F15 N O -","- C116 H68 B4 F60 N4 O4 -","4","1","","Geier, Stephen J.; Stephan, Douglas W.","Lutidine/B(C6F5)3: At the Boundary of Classical and Frustrated Lewis Pair Reactivity","Journal of the American Chemical Society","2009","131","10","3476","3477","10.1021/ja900572x","","","0.71073","MoKα","","0.0524","0.0389","","","0.1063","0.1146","","","","","","1.046","","","","has coordinates","178962","2020-10-21","18:00:00",""
"4119129","13.713","0.004","14.025","0.004","15.804","0.004","71.542","0.016","68.428","0.015","75.177","0.017","2647.5","1.3","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H45 B N2 P2 -","- C24 H45 B N2 P2 -","- C96 H180 B4 N8 P8 -","4","2","","Segawa, Yasutomo; Yamashita, Makoto; Nozaki, Kyoko","Syntheses of PBP Pincer Iridium Complexes: A Supporting Boryl Ligand","Journal of the American Chemical Society","2009","131","26","9201","9203","10.1021/ja9037092","","","0.7107","MoKα","","0.0653","0.0468","","","0.1104","0.1204","","","","","","1.073","","","","has coordinates,has disorder","178962","2020-10-21","18:00:00",""
"4119130","12.2218","0.0008","14.4999","0.0013","31.323","0.002","90","","90","","90","","5550.9","0.7","103.15","","103","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H45 B Cl Ir N2 P2 -","- C24 H45 B Cl Ir N2 P2 -","- C192 H360 B8 Cl8 Ir8 N16 P16 -","8","1","","Segawa, Yasutomo; Yamashita, Makoto; Nozaki, Kyoko","Syntheses of PBP Pincer Iridium Complexes: A Supporting Boryl Ligand","Journal of the American Chemical Society","2009","131","26","9201","9203","10.1021/ja9037092","","","0.7107","MoKα","","0.041","0.0369","","","0.0714","0.0733","","","","","","1.179","","","","has coordinates,has disorder","178962","2020-10-21","18:00:00",""
"4119131","13.543","0.003","15.306","0.003","16.208","0.004","90","","105.492","0.0007","90","","3237.7","1.2","103.15","","103","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H53 B Cl Ir N2 O2 P2 -","- C29 H52 B Cl Ir N2 O2 P2 -","- C116 H208 B4 Cl4 Ir4 N8 O8 P8 -","4","1","","Segawa, Yasutomo; Yamashita, Makoto; Nozaki, Kyoko","Syntheses of PBP Pincer Iridium Complexes: A Supporting Boryl Ligand","Journal of the American Chemical Society","2009","131","26","9201","9203","10.1021/ja9037092","","","0.7107","MoKα","","0.0361","0.0325","","","0.0774","0.0794","","","","","","1.066","","","","has coordinates","178962","2020-10-21","18:00:00",""
"4119132","16.185","0.006","16.185","0.006","20.335","0.007","90","","90","","120","","4613","3","103.15","","103","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C25 H44 Cl Ir O P2 -","- C25 H43 Cl Ir O P2 -","- C150 H258 Cl6 Ir6 O6 P12 -","6","0.5","","Segawa, Yasutomo; Yamashita, Makoto; Nozaki, Kyoko","Syntheses of PBP Pincer Iridium Complexes: A Supporting Boryl Ligand","Journal of the American Chemical Society","2009","131","26","9201","9203","10.1021/ja9037092","","","0.7107","MoKα","","0.0353","0.0346","","","0.0955","0.0958","","","","","","1.275","","","","has coordinates,has disorder","178962","2020-10-21","18:00:00",""
"4119133","10.65","0.004","19.406","0.006","14.428","0.005","90","","108.517","0.0015","90","","2827.5","1.7","103.15","","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H48 B Ir N2 P2 -","- C26 H48 B Ir N2 P2 -","- C104 H192 B4 Ir4 N8 P8 -","4","1","","Segawa, Yasutomo; Yamashita, Makoto; Nozaki, Kyoko","Syntheses of PBP Pincer Iridium Complexes: A Supporting Boryl Ligand","Journal of the American Chemical Society","2009","131","26","9201","9203","10.1021/ja9037092","","","0.7107","MoKα","","0.0245","0.0214","","","0.0493","0.0505","","","","","","1.016","","","","has coordinates","178962","2020-10-21","18:00:00",""
"4121910","12.43","0.0027","11.2743","0.0012","9.0678","0.0022","90","","109.488","0.014","90","","1198","0.4","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C56 H40 N8 O16 -","- C56 H40 N8 O16 -","- C56 H40 N8 O16 -","1","0.125","","Martins, David M. S.; Middlemiss, Derek S.; Pulham, Colin R.; Wilson, Chick C.; Weller, Mark T.; Henry, Paul F.; Shankland, Norman; Shankland, Kenneth; Marshall, William G.; Ibberson, Richard M.; Knight, Kevin; Moggach, Stephen; Brunelli, Michela; Morrison, Carole A.","Temperature- and pressure-induced proton transfer in the 1:1 adduct formed between squaric acid and 4,4'-bipyridine.","Journal of the American Chemical Society","2009","131","11","3884","3893","10.1021/ja8082973","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4124001","10.0046","","5.75362","","15.1839","","90","","103.27","","90","","850.689","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ba Ir O3 -","- Ba Ir O3 -","- Ba12 Ir12 O36 -","12","1.5","","Cheng Jinguang; Alonso, J.A.; Suard, E.; Goodenough, J.B.; Zhou Jianshi","A new perovskite polytype in the high-pressure sequence of Ba Ir O3","Journal of the American Chemical Society","2009","131","","7461","7469","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124002","9.9554","","5.7434","","13.8049","","90","","119.231","","90","","688.819","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ba Ir O2.94 -","- Ba Ir O2.9384 -","- Ba10 Ir10 O29.384 -","10","1.25","","Cheng Jinguang; Alonso, J.A.; Zhou Jianshi; Suard, E.; Goodenough, J.B.","A new perovskite polytype in the high-pressure sequence of Ba Ir O3","Journal of the American Chemical Society","2009","131","","7461","7469","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124003","5.7483","","9.939","","14.3582","","90","","91.319","","90","","820.1","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Ba Ir O3 -","- Ba Ir O3 -","- Ba12 Ir12 O36 -","12","1.5","","Cheng Jinguang; Alonso, J.A.; Zhou Jianshi; Suard, E.; Goodenough, J.B.","A new perovskite polytype in the high-pressure sequence of Ba Ir O3","Journal of the American Chemical Society","2009","131","","7461","7469","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124004","4.0611","","4.0611","","4.0611","","90","","90","","90","","66.978","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Ba Ir O3 -","- Ba Ir O3 -","- Ba Ir O3 -","1","0.0208333","","Cheng Jinguang; Alonso, J.A.; Suard, E.; Zhou Jianshi; Goodenough, J.B.","A new perovskite polytype in the high-pressure sequence of Ba Ir O3","Journal of the American Chemical Society","2009","131","","7461","7469","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""