# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T11:09:20+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Chemical Communications') AND volume = 52 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
"1542543","12.657","0.004","12.657","0.004","9.296","0.003","90","","90","","120","","1289.7","0.7","117","2","117","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C9 H6.2 N6 O0.1 -","- C9 H6.2001 N6 O0.1 -","- C54 H37.2006 N36 O0.6 -","6","0.166667","","Zhou, Dong-Dong; Xu, Yan-Tong; Lin, Rui-Biao; Mo, Zong-Wen; Zhang, Wei-Xiong; Zhang, Jie-Peng","High-symmetry hydrogen-bonded organic frameworks: air separation and crystal-to-crystal structural transformation.","Chemical communications (Cambridge, England)","2016","52","28","4991","4994","10.1039/c6cc00366d","","","0.71073","MoKα","","0.0801","0.0541","","","0.1335","0.1549","","","","","","1.046","","","","has coordinates","181569","2020-10-21","18:00:00",""
"1542544","12.335","0.004","21.047","0.008","7.89","0.003","90","","90","","90","","2048.4","1.3","253","2","253","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H17 F9 N6 O7 -","- C12 H17 F9 N6 O7 -","- C48 H68 F36 N24 O28 -","4","0.5","","Zhou, Dong-Dong; Xu, Yan-Tong; Lin, Rui-Biao; Mo, Zong-Wen; Zhang, Wei-Xiong; Zhang, Jie-Peng","High-symmetry hydrogen-bonded organic frameworks: air separation and crystal-to-crystal structural transformation.","Chemical communications (Cambridge, England)","2016","52","28","4991","4994","10.1039/c6cc00366d","","","1.54178","CuKα","","0.0551","0.0514","","","0.1247","0.1292","","","","","","1.055","","","","has coordinates,has disorder","181569","2020-10-21","18:00:00",""
"1542545","15.8427","0.0015","15.8427","0.0015","15.8427","0.0015","90","","90","","90","","3976.4","0.7","173","2","173","2","","","","","","","","4","P 41 3 2","P 4bd 2ab 3","213","","","","- C14 H3.5 F10.5 N7 -","- C13.9998 H3.5001 F10.5 N6.9999 -","- C111.998 H28.0008 F84 N55.9992 -","8","0.333333","","Zhou, Dong-Dong; Xu, Yan-Tong; Lin, Rui-Biao; Mo, Zong-Wen; Zhang, Wei-Xiong; Zhang, Jie-Peng","High-symmetry hydrogen-bonded organic frameworks: air separation and crystal-to-crystal structural transformation.","Chemical communications (Cambridge, England)","2016","52","28","4991","4994","10.1039/c6cc00366d","","","1.54178","CuKα","","0.0801","0.0797","","","0.2113","0.2114","","","","","","1.056","","","","has coordinates,has disorder","181569","2020-10-21","18:00:00",""
"7118161","10.1045","0.0005","15.4994","0.0007","10.4754","0.0005","90","","102.207","0.0005","90","","1603.5","0.13","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H15 Dy N2 O14 -","- C9 H15 Dy N2 O14 -","- C36 H60 Dy4 N8 O56 -","4","1","","Liang Qin; Li-Xian Lin; Zhi-Ping Fang; Shui-Ping Yang; Gui-Hua Qiu; Jin-Xiang Chen; Wen-Hua Chen","A water-stable metal-organic framework of a zwitterionic carboxylate with dysprosium: a sensing platform for Ebolavirus RNA sequences","Chem.Commun.","2016","52","","132","","10.1039/C5cc06697B","","","0.71073","MoKα","","0.0204","0.0196","","","0.0512","0.0515","","","","","","1.021","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118162","5.1412","0.0004","26.4969","0.0019","9.2776","0.0007","90","","105.207","0.002","90","","1219.59","0.16","120","2","120.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H16 N2 O4 -","- C12 H16 N2 O4 -","- C48 H64 N8 O16 -","4","2","","Abigail E. Hooper; Stuart R. Kennedy; Christopher D. Jones; Jonathan W. Steed","Gelation by supramolecular dimerization of mono(urea)s","Chem.Commun.","2016","52","","198","","10.1039/c5cc06995E","","","0.71073","MoKα","","0.0635","0.0431","","","0.096","0.1046","","","","","","1.027","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118163","4.6214","0.0008","8.2787","0.0014","14.248","0.002","92.962","0.005","94.351","0.005","95.33","0.005","540.25","0.15","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H14 N2 O4 -","- C11 H14 N2 O4 -","- C22 H28 N4 O8 -","2","1","","Abigail E. Hooper; Stuart R. Kennedy; Christopher D. Jones; Jonathan W. Steed","Gelation by supramolecular dimerization of mono(urea)s","Chem.Commun.","2016","52","","198","","10.1039/c5cc06995E","","","0.71073","MoKα","","0.0838","0.0472","","","0.0942","0.1054","","","","","","1.023","","","","has coordinates","171603","2020-10-21","18:00:00",""
"7118164","4.529","0.0011","9.009","0.003","15.234","0.004","101.869","0.009","93.598","0.009","101.742","0.009","592","0.3","120","2","120.15","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 N2 O4 -","- C12 H16 N2 O4 -","- C24 H32 N4 O8 -","2","1","","Abigail E. Hooper; Stuart R. Kennedy; Christopher D. Jones; Jonathan W. Steed","Gelation by supramolecular dimerization of mono(urea)s","Chem.Commun.","2016","52","","198","","10.1039/c5cc06995E","","","0.71073","MoKα","","0.1119","0.0689","","","0.1547","0.1723","","","","","","1.053","","","","has coordinates","171603","2020-10-21","18:00:00",""
"7118165","19.9441","0.0006","15.7417","0.0006","14.9924","0.0004","90","","90","","90","","4706.9","0.3","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","PCBM-Sc3N@D5h-C80 CS2 solvate","","- C93 H14 N O2 S2 Sc3 -","- C93 H14 N O2 S2 Sc3 -","- C372 H56 N4 O8 S8 Sc12 -","4","1","","Maira R. Ceron; Marta Izquierdo; Nuria Alegret; Juan A. Valdez; Antonio Rodriguez-Fortea; Marilyn M. Olmstead; Alan L. Balch; Josep M. Poblet; Luis Echegoyen","Reactivity differences of Sc3N at C2n (2n = 68 and 80). Synthesis of the first methanofullerene derivatives of Sc3N at D5h-C80","Chem.Commun.","2016","52","","64","","10.1039/C5cc07416A","","","0.7749","synchrotron","","0.1723","0.1649","","","0.3903","0.4","","","","","","1.92","","","","has coordinates","171604","2020-10-21","18:00:00",""
"7118166","16.807","0.007","12.849","0.006","17.795","0.008","90","","114.07","0.006","90","","3509","3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H49 B Fe N4 O2 Si2 -","- C30 H49 B Fe N4 O2 Si2 -","- C120 H196 B4 Fe4 N16 O8 Si8 -","4","1","","Holger Braunschweig; Rian D. Dewhurst; Katharina Ferkinghoff","Carbene-induced synthesis of the first borironium cations using the [(eta^5^-C5Me5)Fe(CO)2]^-^ anion as an unlikely leaving group","Chem.Commun.","2016","52","","183","","10.1039/C5cc07503C","","","0.71073","MoKα","","0.0476","0.0345","","","0.0796","0.0856","","","","","","1.025","","","","has coordinates","171605","2020-10-21","18:00:00",""
"7118167","10.5605","0.0006","17.2867","0.001","20.8645","0.0012","90","","99.455","0.002","90","","3757.2","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H57 B Fe N4 O2 Si2 -","- C34 H57 B Fe N4 O2 Si2 -","- C136 H228 B4 Fe4 N16 O8 Si8 -","4","1","","Holger Braunschweig; Rian D. Dewhurst; Katharina Ferkinghoff","Carbene-induced synthesis of the first borironium cations using the [(eta^5^-C5Me5)Fe(CO)2]^-^ anion as an unlikely leaving group","Chem.Commun.","2016","52","","183","","10.1039/C5cc07503C","","","0.71073","MoKα","","0.0322","0.0282","","","0.0747","0.0774","","","","","","1.033","","","","has coordinates","171605","2020-10-21","18:00:00",""
"7118168","13.4055","0.0007","15.0828","0.0008","29.1775","0.0016","90","","90","","90","","5899.5","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C71 H58 Cl4 N2 S2 -","- C71 H58 Cl4 N2 S2 -","- C284 H232 Cl16 N8 S8 -","4","1","","Ping Chen; Sheng-mei Lu; Wengang Guo; Yan Liu; Can Li","A highly enantioselective thiolation of sulfonyl indoles to access 3-sec-sulfur-substituted indoles in water","Chem.Commun.","2016","52","","96","","10.1039/C5cc07721D","","","0.71073","MoKα","","0.0719","0.0564","","","0.1365","0.1465","","","","","","1.031","","","","has coordinates,has disorder","171606","2020-10-21","18:00:00",""
"7118169","21.41","0.006","9.115","0.003","8.678","0.003","90","","90.827","0.004","90","","1693.4","0.9","293","","293","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C17 H19 Cl O5 -","- C17 H19 Cl O5 -","- C68 H76 Cl4 O20 -","4","1","","Qiang Sha; Hadi Arman; Michael P. Doyle","Asymmetric synthesis of 1H-pyrrol-3(2H)-ones from 2,3-diketoesters by combination of aldol condensation with benzilic acid rearrangement","Chem.Commun.","2016","52","","108","","10.1039/C5cc07780J","","","0.71075","MoKα","","0.0346","0.034","","","0.0917","0.0924","","","","","","1.051","","","","has coordinates","171607","2020-10-21","18:00:00",""
"7118170","9.258","0.002","9.554","0.002","22.789","0.005","90","","90","","90","","2015.7","0.8","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H22 Cl N O3 -","- C23 H22 Cl N O3 -","- C92 H88 Cl4 N4 O12 -","4","1","","Qiang Sha; Hadi Arman; Michael P. Doyle","Asymmetric synthesis of 1H-pyrrol-3(2H)-ones from 2,3-diketoesters by combination of aldol condensation with benzilic acid rearrangement","Chem.Commun.","2016","52","","108","","10.1039/C5cc07780J","","","0.71075","MoKα","","0.0444","0.0421","","","0.1117","0.1149","","","","","","1.062","","","","has coordinates","171607","2020-10-21","18:00:00",""
"7118171","15.7923","0.0002","16.6247","0.0003","21.4456","0.0003","70.8548","0.0014","70.4554","0.0013","71.4233","0.0013","4872.6","0.14","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H104 N7 O Re -","- C96 H104 N7 O Re -","- C192 H208 N14 O2 Re2 -","2","1","","Jan Paulo T. Zaragoza; Maxime A. Siegler; David P. Goldberg","Rhenium(V)-oxo corrolazines: isolating redox-active ligand reactivity","Chem.Commun.","2016","52","","167","","10.1039/C5cc07956J","","","1.54178","CuKα","","0.0578","0.0539","","","0.15","0.1546","","","","","","1.099","","","","has coordinates,has disorder","171608","2020-10-21","18:00:00",""
"7118172","5.79","0.003","10.095","0.005","29.897","0.014","90","","90","","90","","1747.5","1.5","100","2","100","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H26 N3 Ni O2 -","- C18 H26 N3 Ni O2 -","- C72 H104 N12 Ni4 O8 -","4","1","","Jan Wenz; Christoph A. Rettenmeier; Hubert Wadepohl; Lutz H. Gade","Catalytic C-F bond activation of geminal difluorocyclopropanes by nickel(I) complexes via a radical mechanism","Chem.Commun.","2016","52","","202","","10.1039/c5cc08950F","","x-ray","0.71073","MoKα","","0.039","0.0313","","","0.0657","0.0682","","","","","","1.035","","","","has coordinates","171609","2020-10-21","18:00:00",""
"7118173","10.148","0.005","11.913","0.005","17.409","0.008","90","","90","","90","","2104.6","1.7","100","2","100","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H23 F2 N3 Ni O2 -","- C24 H23 F2 N3 Ni O2 -","- C96 H92 F8 N12 Ni4 O8 -","4","1","","Jan Wenz; Christoph A. Rettenmeier; Hubert Wadepohl; Lutz H. Gade","Catalytic C-F bond activation of geminal difluorocyclopropanes by nickel(I) complexes via a radical mechanism","Chem.Commun.","2016","52","","202","","10.1039/c5cc08950F","","x-ray","0.71073","MoKα","","0.0366","0.0305","","","0.0681","0.071","","","","","","1.054","","","","has coordinates","171609","2020-10-21","18:00:00",""
"7118174","10.777","0.008","10.97","0.008","36.58","0.03","90","","90","","90","","4325","6","100","2","100","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21.5 H31 F N3 Ni O2.5 -","- C21.5 H31 F N3 Ni O2.5 -","- C172 H248 F8 N24 Ni8 O20 -","8","2","","Jan Wenz; Christoph A. Rettenmeier; Hubert Wadepohl; Lutz H. Gade","Catalytic C-F bond activation of geminal difluorocyclopropanes by nickel(I) complexes via a radical mechanism","Chem.Commun.","2016","52","","202","","10.1039/c5cc08950F","","x-ray","0.71073","MoKα","","0.0356","0.0297","","","0.064","0.0666","","","","","","1.053","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7118175","24.87","0.015","5.944","0.004","16.266","0.01","90","","107.995","0.007","90","","2287","3","100","2","100","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H12 F2 -","- C15 H12 F2 -","- C120 H96 F16 -","8","1","","Jan Wenz; Christoph A. Rettenmeier; Hubert Wadepohl; Lutz H. Gade","Catalytic C-F bond activation of geminal difluorocyclopropanes by nickel(I) complexes via a radical mechanism","Chem.Commun.","2016","52","","202","","10.1039/c5cc08950F","","x-ray","0.71073","MoKα","","0.0639","0.0466","","","0.1099","0.1185","","","","","","1.067","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118176","7.74284","0.00013","17.2689","0.0002","8.39473","0.00013","90","","91.1751","0.0015","90","","1122.23","0.03","120","1","120","1","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C15 H13 F -","- C15 H13 F -","- C60 H52 F4 -","4","1","","Jan Wenz; Christoph A. Rettenmeier; Hubert Wadepohl; Lutz H. Gade","Catalytic C-F bond activation of geminal difluorocyclopropanes by nickel(I) complexes via a radical mechanism","Chem.Commun.","2016","52","","202","","10.1039/c5cc08950F","","x-ray","1.54184","CuKα","","0.0258","0.0255","","","0.0654","0.0656","","","","","","1.08","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118177","14.0216","0.0005","21.3117","0.0008","6.4976","0.0002","90","","90","","90","","1941.64","0.12","173","2","173","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C20 H26 N2 O6 S -","- C20 H26 N2 O6 S -","- C80 H104 N8 O24 S4 -","4","1","","Pedras, M. S. C.; To, Q. H.; Schatte, G.","Divergent reactivity of an indole glucosinolate yields Lossen or Neber rearrangement products: the phytoalexin rapalexin A or a unique β-d-glucopyranose fused heterocycle.","Chemical communications (Cambridge, England)","2016","52","12","2505","2508","10.1039/c5cc09822j","","","0.68879","synchrotron","","0.0415","0.0409","","","0.1103","0.1121","","","","","","1.077","","","","has coordinates","175866","2020-10-21","18:00:00",""
"7118178","14.8737","0.0004","14.8737","0.0004","24.3175","0.0008","90","","90","","120","","4658.9","0.2","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","[Li(DME)3]2[Th(C6H5)6]","","- C60 H90 Li2 O12 Th -","- C60 H90 Li2 O12 Th -","- C180 H270 Li6 O36 Th3 -","3","0.166667","","Pedrick, Elizabeth A.; Hrobárik, Peter; Seaman, Lani A.; Wu, Guang; Hayton, Trevor W.","Synthesis, structure and bonding of hexaphenyl thorium(iv): observation of a non-octahedral structure.","Chemical communications (Cambridge, England)","2015","52","4","689","692","10.1039/c5cc08265j","","","0.71073","MoKα","","0.0451","0.0338","","","0.0655","0.07","","","","","","1.047","","","","has coordinates","171842","2020-10-21","18:00:00",""
"7118179","16.5641","0.001","16.7043","0.001","21.3854","0.0012","90","","108.682","0.001","90","","5605.4","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Li(12-crown-4)(THF)]2[Th(C6H5)6]","","- C60 H78 Li2 O10 Th -","- C60 H78 Li2 O10 Th -","- C240 H312 Li8 O40 Th4 -","4","1","","Pedrick, Elizabeth A.; Hrobárik, Peter; Seaman, Lani A.; Wu, Guang; Hayton, Trevor W.","Synthesis, structure and bonding of hexaphenyl thorium(iv): observation of a non-octahedral structure.","Chemical communications (Cambridge, England)","2015","52","4","689","692","10.1039/c5cc08265j","","","0.71073","MoKα","","0.0427","0.0297","","","0.0701","0.0756","","","","","","1.007","","","","has coordinates,has disorder","171842","2020-10-21","18:00:00",""
"7118185","9.002","0.002","13.225","0.003","17.293","0.004","90","","90","","90","","2058.8","0.8","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 N O -","- C29 H21 N O -","- C116 H84 N4 O4 -","4","1","","Barsu, Nagaraju; Sen, Malay; Premkumar, J. Richard; Sundararaju, Basker","Cobalt(iii) catalyzed C-8 selective C-H and C-O coupling of quinoline N-oxide with internal alkynes via C-H activation and oxygen atom transfer.","Chemical communications (Cambridge, England)","2016","52","7","1338","1341","10.1039/c5cc08736h","","","0.71073","MoKα","","0.0624","0.0451","","","0.0966","0.1162","","","","","","1.07","","","","has coordinates","175860","2020-10-21","18:00:00",""
"7118186","9.22642","0.00018","9.71725","0.00018","18.0546","0.0004","90","","101.605","0.0019","90","","1585.6","0.06","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N6 O6 -","- C12 H14 N6 O6 -","- C48 H56 N24 O24 -","4","1","","Erhardt, Hellmuth; Mohr, Fabian; Kirsch, Stefan F.","Synthesis of geminal bis- and tristriazoles: exploration of unconventional azide chemistry.","Chemical communications (Cambridge, England)","2016","52","3","545","548","10.1039/c5cc08163g","","x-ray","0.71073","MoKα","","0.0579","0.0445","","","0.1101","0.1201","","","","","","1.024","","","","has coordinates","171846","2020-10-21","18:00:00",""
"7118187","14.6712","0.0004","12.489","0.0008","17.0137","0.0011","90","","106.677","0.004","90","","2986.3","0.3","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H25 N9 O6 -","- C31 H25 N9 O6 -","- C124 H100 N36 O24 -","4","1","","Erhardt, Hellmuth; Mohr, Fabian; Kirsch, Stefan F.","Synthesis of geminal bis- and tristriazoles: exploration of unconventional azide chemistry.","Chemical communications (Cambridge, England)","2016","52","3","545","548","10.1039/c5cc08163g","","x-ray","0.71073","MoKα","","0.0778","0.048","","","0.1126","0.1298","","","","","","1.014","","","","has coordinates","171846","2020-10-21","18:00:00",""
"7118188","10.7622","0.0011","12.8238","0.0012","13.4282","0.0012","114.432","0.003","100.558","0.003","93.044","0.003","1641.4","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H35 Cl2 I N4 O Pd -","- C33 H35 Cl2 I N4 O Pd -","- C66 H70 Cl4 I2 N8 O2 Pd2 -","2","1","","Vicente-Hernández, Inmaculada; Chicote, María-Teresa; Vicente, José; Bautista, Delia","A new type of oxidative addition of an iodoarene to a Pd(ii) complex.","Chemical communications (Cambridge, England)","2016","52","3","594","596","10.1039/c5cc07698f","","","0.71073","MoKα","","0.0369","0.0256","","","0.0519","0.0552","","","","","","1.036","","","","has coordinates","171847","2020-10-21","18:00:00",""
"7118189","11.4766","0.0003","11.4766","0.0003","30.5554","0.0011","90","","90","","90","","4024.5","0.2","130","1","130","1","","","","","","","","6","P 4/n c c","-P 4a 2ac","130","","","","- C40 H38 Cu2 N9 O12 S2 -","- C40 H34 Cu2 N9 O12.02 S2 -","- C160 H136 Cu8 N36 O48.08 S8 -","4","","","Abrahams, C. T.; Abrahams, B. F.; Hudson, T. A.; Robson, R.","Templation of a square grid copper(ii) 4,4'-bipyridine network by a 3D PtS-related Cu(i)-Cu(ii) 4,4'-bipyridine crystal.","Chemical communications (Cambridge, England)","2016","52","3","609","612","10.1039/c5cc08266h","","","1.54184","CuKα","","0.087","0.0667","","","0.2106","0.2238","","","","","","1.11","","","","has coordinates","171848","2020-10-21","18:00:00",""
"7118190","11.5095","0.0005","11.5095","0.0005","15.4286","0.0007","90","","90","","90","","2043.8","0.16","240","2","240","2","","","","","","","","6","P 4/n c c","-P 4a 2ac","130","","","","- C20 H20 Cu N4 O8 S2 -","- C20 H20 Cu N4 O8 S2 -","- C80 H80 Cu4 N16 O32 S8 -","4","","","Abrahams, C. T.; Abrahams, B. F.; Hudson, T. A.; Robson, R.","Templation of a square grid copper(ii) 4,4'-bipyridine network by a 3D PtS-related Cu(i)-Cu(ii) 4,4'-bipyridine crystal.","Chemical communications (Cambridge, England)","2016","52","3","609","612","10.1039/c5cc08266h","","x-ray","1.54184","CuKα","","0.0709","0.0604","","","0.1602","0.166","","","","","","1.171","","","","has coordinates","171848","2020-10-21","18:00:00",""
"7118196","24.3213","0.0016","10.002","0.0005","32.0407","0.0018","90","","111.912","0.007","90","","7231.2","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C77 H100 N4 O10 Pd Si -","- C77 H100 N4 O10 Pd Si -","- C308 H400 N16 O40 Pd4 Si4 -","4","1","","Nisar Ahamed, B.; Duchêne, Roland; Robeyns, Koen; Fustin, Charles-André","Catenane-based mechanically-linked block copolymers.","Chemical communications (Cambridge, England)","2016","52","10","2149","2152","10.1039/c5cc09775d","","","0.71073","MoKα","","0.1373","0.096","","","0.2177","0.2456","","","","","","1.039","","","","has coordinates","175862","2020-10-21","18:00:00",""
"7118197","39.473","0.013","12.053","0.0016","35.42","0.012","90","","114.26","0.04","90","","15364","9","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C75 H96 N4 O10 Pd Si -","- C75 H96 N4 O10 Pd Si -","- C600 H768 N32 O80 Pd8 Si8 -","8","1","","Nisar Ahamed, B.; Duchêne, Roland; Robeyns, Koen; Fustin, Charles-André","Catenane-based mechanically-linked block copolymers.","Chemical communications (Cambridge, England)","2016","52","10","2149","2152","10.1039/c5cc09775d","","","0.71073","MoKα","","0.1694","0.1127","","","0.2238","0.2565","","","","","","1.066","","","","has coordinates","175862","2020-10-21","18:00:00",""
"7118198","37.2375","0.0009","11.7434","0.0002","32.5955","0.0009","90","","101.666","0.003","90","","13959.4","0.6","100","2","100","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C75 H93 N4 O13 Pd -","- C75 H93 N4 O13 Pd -","- C600 H744 N32 O104 Pd8 -","8","1","","Nisar Ahamed, B.; Duchêne, Roland; Robeyns, Koen; Fustin, Charles-André","Catenane-based mechanically-linked block copolymers.","Chemical communications (Cambridge, England)","2016","52","10","2149","2152","10.1039/c5cc09775d","","","0.82103","synchrotron","","0.0771","0.071","","","0.1949","0.2022","","","","","","1.007","","","","has coordinates,has disorder","175862","2020-10-21","18:00:00",""
"7118199","15.6981","0.0004","7.4997","0.0002","16.6619","0.0004","90","","93.155","0.001","90","","1958.65","0.09","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 O P -","- C22 H29 O P -","- C88 H116 O4 P4 -","4","1","","Krupski, Sergei; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cyclopropane formation under frustrated Lewis pair conditions.","Chemical communications (Cambridge, England)","2016","52","13","2695","2697","10.1039/c5cc09585a","","","0.71073","MoKα","","0.1117","0.0729","","","0.144","0.1669","","","","","","1.105","","","","has coordinates,has disorder","177634","2020-10-21","18:00:00",""
"7118200","8.3322","0.0002","8.5865","0.0003","13.0867","0.0004","87.833","0.001","85.945","0.001","86.322","0.001","931.49","0.05","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H29 P -","- C22 H29 P -","- C44 H58 P2 -","2","1","","Krupski, Sergei; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cyclopropane formation under frustrated Lewis pair conditions.","Chemical communications (Cambridge, England)","2016","52","13","2695","2697","10.1039/c5cc09585a","","","1.54178","CuKα","","0.0416","0.0353","","","0.0884","0.0925","","","","","","1.065","","","","has coordinates,has disorder","177634","2020-10-21","18:00:00",""
"7118201","10.8091","0.0002","25.3584","0.0003","16.9567","0.0004","90","","96.133","0.001","90","","4621.25","0.15","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H37 B F15 O P Si -","- C43 H37 B F15 O P Si -","- C172 H148 B4 F60 O4 P4 Si4 -","4","1","","Krupski, Sergei; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cyclopropane formation under frustrated Lewis pair conditions.","Chemical communications (Cambridge, England)","2016","52","13","2695","2697","10.1039/c5cc09585a","","","0.71073","MoKα","","0.0973","0.0704","","","0.18","0.1966","","","","","","1.049","","","","has coordinates","177634","2020-10-21","18:00:00",""
"7118202","9.4516","0.0004","12.1427","0.0005","12.2399","0.0004","110.414","0.001","100.07","0.001","97.111","0.001","1269.99","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H6 B F15 O -","- C25 H6 B F15 O -","- C50 H12 B2 F30 O2 -","2","1","","Krupski, Sergei; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cyclopropane formation under frustrated Lewis pair conditions.","Chemical communications (Cambridge, England)","2016","52","13","2695","2697","10.1039/c5cc09585a","","","0.71073","MoKα","","0.0466","0.036","","","0.0929","0.0979","","","","","","1.06","","","","has coordinates","177634","2020-10-21","18:00:00",""
"7118203","12.01","0.002","13.437","0.003","16.32","0.003","106.161","0.003","102.667","0.003","98.007","0.001","2411","0.8","173.15","","173.15","","","","","","","","","6","P -1","-P 1","2","","","","- C96 H110 F12 N8 O18 P2 -","- C96 H110 F12 N8 O18 P2 -","- C96 H110 F12 N8 O18 P2 -","1","0.5","","Han, Ying; Meng, Zheng; Chen, Chuan-Feng","Acid/base controllable complexation of a triptycene-derived macrotricyclic host and protonated 4,4'-bipyridinium/pyridinium salts.","Chemical communications (Cambridge, England)","2016","52","3","590","593","10.1039/c5cc08166a","","","0.71073","MoKα","","0.0853","0.0815","","","0.1908","0.1939","","","","","","1.158","","","","has coordinates","171854","2020-10-21","18:00:00",""
"7118204","13.799","0.003","15.7","0.003","22.416","0.005","104.6","0.03","96.36","0.03","107.93","0.03","4377","2","173.15","","173.15","","","","","","","","","6","P -1","-P 1","2","","","","- C90 H96 F12 N2 O16 P2 -","- C90 H96 F12 N2 O16 P2 -","- C180 H192 F24 N4 O32 P4 -","2","1","","Han, Ying; Meng, Zheng; Chen, Chuan-Feng","Acid/base controllable complexation of a triptycene-derived macrotricyclic host and protonated 4,4'-bipyridinium/pyridinium salts.","Chemical communications (Cambridge, England)","2016","52","3","590","593","10.1039/c5cc08166a","","","0.71073","MoKα","","0.2537","0.1931","","","0.372","0.4032","","","","","","1.673","","","","has coordinates","171854","2020-10-21","18:00:00",""
"7118205","20.956","0.007","17.451","0.005","24.943","0.008","90","","109.498","0.004","90","","8599","5","173.15","","173.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C80 H88 Cl6 F12 N2 O16 P2 -","- C80 H88 Cl6 F12 N2 O16 P2 -","- C320 H352 Cl24 F48 N8 O64 P8 -","4","0.5","","Han, Ying; Meng, Zheng; Chen, Chuan-Feng","Acid/base controllable complexation of a triptycene-derived macrotricyclic host and protonated 4,4'-bipyridinium/pyridinium salts.","Chemical communications (Cambridge, England)","2016","52","3","590","593","10.1039/c5cc08166a","","","0.71073","MoKα","","0.1618","0.145","","","0.3594","0.3734","","","","","","2.347","","","","has coordinates,has disorder","171854","2020-10-21","18:00:00",""
"7118206","12.778","0.012","12.983","0.014","14.022","0.014","108.815","0.019","93.025","0.012","100.752","0.011","2147","4","173.15","","173.15","","","","","","","","","6","P -1","-P 1","2","","","","- C92 H104 F12 N2 O20 P2 -","- C92 H104 F12 N2 O20 P2 -","- C92 H104 F12 N2 O20 P2 -","1","0.5","","Han, Ying; Meng, Zheng; Chen, Chuan-Feng","Acid/base controllable complexation of a triptycene-derived macrotricyclic host and protonated 4,4'-bipyridinium/pyridinium salts.","Chemical communications (Cambridge, England)","2016","52","3","590","593","10.1039/c5cc08166a","","","0.71073","MoKα","","0.1081","0.095","","","0.2632","0.2738","","","","","","1.525","","","","has coordinates","171854","2020-10-21","18:00:00",""
"7118207","11.62","0.0016","11.0673","0.0014","21.125","0.003","90","","98.311","0.004","90","","2688.2","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","6t","Trans-2,3-di-4-tolyl-4-tosyl-1,2,3,4-tetrahydrocyclopenta[b]indole","","- C32 H29 N O2 S -","- C32 H29 N O2 S -","- C128 H116 N4 O8 S4 -","4","1","","Wang, Zhiming; Xu, Xingzhu; Gu, Zhanshou; Feng, Wei; Qian, Houjun; Li, Zhengyi; Sun, Xiaoqiang; Kwon, Ohyun","Nazarov cyclization of 1,4-pentadien-3-ols: preparation of cyclopenta[b]indoles and spiro[indene-1,4'-quinoline]s.","Chemical communications (Cambridge, England)","2016","52","13","2811","2814","10.1039/c5cc08596a","","","0.71073","MoKα","","0.0965","0.0481","","","0.1195","0.1345","","","","","","1.002","","","","has coordinates","177636","2020-10-21","18:00:00",""
"7118208","13.926","0.002","10.6835","0.0016","14.955","0.002","90","","92.243","0.004","90","","2223.3","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","6v","2,2-Dimethyl-3-phenyl-4-tosyl-1,2,3,4-tetrahydrocyclopenta[b]indole","","- C26 H25 N O2 S -","- C26 H25 N O2 S -","- C104 H100 N4 O8 S4 -","4","1","","Wang, Zhiming; Xu, Xingzhu; Gu, Zhanshou; Feng, Wei; Qian, Houjun; Li, Zhengyi; Sun, Xiaoqiang; Kwon, Ohyun","Nazarov cyclization of 1,4-pentadien-3-ols: preparation of cyclopenta[b]indoles and spiro[indene-1,4'-quinoline]s.","Chemical communications (Cambridge, England)","2016","52","13","2811","2814","10.1039/c5cc08596a","","","0.71073","MoKα","","0.063","0.0467","","","0.1242","0.1329","","","","","","1.076","","","","has coordinates","177636","2020-10-21","18:00:00",""
"7118209","10.4657","0.0014","19.751","0.003","12.477","0.002","90","","114.712","0.003","90","","2342.9","0.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","9","N-(2-(trans-5-ethoxy-3-phenylcyclopent-1-en-1-yl)phenyl)-4-methylbenzenesulfonamide","","- C26 H27 N O3 S -","- C26 H27 N O3 S -","- C104 H108 N4 O12 S4 -","4","1","","Wang, Zhiming; Xu, Xingzhu; Gu, Zhanshou; Feng, Wei; Qian, Houjun; Li, Zhengyi; Sun, Xiaoqiang; Kwon, Ohyun","Nazarov cyclization of 1,4-pentadien-3-ols: preparation of cyclopenta[b]indoles and spiro[indene-1,4'-quinoline]s.","Chemical communications (Cambridge, England)","2016","52","13","2811","2814","10.1039/c5cc08596a","","","0.71073","MoKα","","0.1089","0.0527","","","0.1305","0.157","","","","","","1.003","","","","has coordinates","177636","2020-10-21","18:00:00",""
"7118210","10.6663","0.0011","10.8826","0.0012","18.121","0.002","90","","103.78","0.002","90","","2042.9","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","10","2-Phenyl-4-tosyl-2,3,3a,4-tetrahydrocyclopenta[b]indole","","- C24 H21 N O2 S -","- C24 H21 N O2 S -","- C96 H84 N4 O8 S4 -","4","1","","Wang, Zhiming; Xu, Xingzhu; Gu, Zhanshou; Feng, Wei; Qian, Houjun; Li, Zhengyi; Sun, Xiaoqiang; Kwon, Ohyun","Nazarov cyclization of 1,4-pentadien-3-ols: preparation of cyclopenta[b]indoles and spiro[indene-1,4'-quinoline]s.","Chemical communications (Cambridge, England)","2016","52","13","2811","2814","10.1039/c5cc08596a","","","0.71073","MoKα","","0.0613","0.0434","","","0.123","0.134","","","","","","1.055","","","","has coordinates","177636","2020-10-21","18:00:00",""
"7118211","14.001","0.003","12.335","0.002","11.587","0.003","90","","95.497","0.005","90","","1991.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","8y","1'-(Methylsulfonyl)-3-phenyl-2',3'-dihydro-1'H-spiro[indene-1,4'-quinoline]","","- C24 H21 N O2 S -","- C24 H21 N O2 S -","- C96 H84 N4 O8 S4 -","4","1","","Wang, Zhiming; Xu, Xingzhu; Gu, Zhanshou; Feng, Wei; Qian, Houjun; Li, Zhengyi; Sun, Xiaoqiang; Kwon, Ohyun","Nazarov cyclization of 1,4-pentadien-3-ols: preparation of cyclopenta[b]indoles and spiro[indene-1,4'-quinoline]s.","Chemical communications (Cambridge, England)","2016","52","13","2811","2814","10.1039/c5cc08596a","","","0.71073","MoKα","","0.1133","0.0537","","","0.1144","0.1325","","","","","","0.992","","","","has coordinates","177636","2020-10-21","18:00:00",""
"7118212","8.9249","0.001","9.9995","0.001","22.944","0.0019","90","","107.13","0.004","90","","1956.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","6a","2-Phenyl-4-tosyl-1,2,3,4-tetrahydrocyclopenta[b]indole","","- C24 H21 N O2 S -","- C24 H21 N O2 S -","- C96 H84 N4 O8 S4 -","4","1","","Wang, Zhiming; Xu, Xingzhu; Gu, Zhanshou; Feng, Wei; Qian, Houjun; Li, Zhengyi; Sun, Xiaoqiang; Kwon, Ohyun","Nazarov cyclization of 1,4-pentadien-3-ols: preparation of cyclopenta[b]indoles and spiro[indene-1,4'-quinoline]s.","Chemical communications (Cambridge, England)","2016","52","13","2811","2814","10.1039/c5cc08596a","","","0.71073","MoKα","","0.0577","0.0446","","","0.1237","0.1309","","","","","","1.006","","","","has coordinates","177636","2020-10-21","18:00:00",""
"7118213","13.58","0.003","21.768","0.006","17.29","0.004","90","","111.548","0.004","90","","4754","2","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H58 N3 P2 Rh -","- C54 H58 N3 P2 Rh -","- C216 H232 N12 P8 Rh4 -","4","1","","Hänninen, Mikko M; Zamora, Matthew T.; MacNeil, Connor S.; Knott, Jackson P.; Hayes, Paul G.","Elucidation of the resting state of a rhodium NNN-pincer hydrogenation catalyst that features a remarkably upfield hydride (1)H NMR chemical shift.","Chemical communications (Cambridge, England)","2016","52","3","586","589","10.1039/c5cc08348f","","","0.71073","MoKα","","0.0457","0.0331","","","0.0754","0.0823","","","","","","1.056","","","","has coordinates,has disorder","171856","2020-10-21","18:00:00",""
"7118214","16.185","0.01","18.144","0.011","15.477","0.01","90","","118.406","0.008","90","","3998","4","173","2","173.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H48 N3 P2 Rh -","- C48 H48 N3 P2 Rh -","- C192 H192 N12 P8 Rh4 -","4","1","","Hänninen, Mikko M; Zamora, Matthew T.; MacNeil, Connor S.; Knott, Jackson P.; Hayes, Paul G.","Elucidation of the resting state of a rhodium NNN-pincer hydrogenation catalyst that features a remarkably upfield hydride (1)H NMR chemical shift.","Chemical communications (Cambridge, England)","2016","52","3","586","589","10.1039/c5cc08348f","","","0.71073","MoKα","","0.2886","0.0832","","","0.1122","0.1692","","","","","","0.894","","","","has coordinates","171856","2020-10-21","18:00:00",""
"7118215","13.567","0.004","28.198","0.008","16.293","0.005","90","","109.213","0.006","90","","5886","3","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C72 H66 N3 P2 Rh -","- C72 H66 N3 P2 Rh -","- C288 H264 N12 P8 Rh4 -","4","1","","Hänninen, Mikko M; Zamora, Matthew T.; MacNeil, Connor S.; Knott, Jackson P.; Hayes, Paul G.","Elucidation of the resting state of a rhodium NNN-pincer hydrogenation catalyst that features a remarkably upfield hydride (1)H NMR chemical shift.","Chemical communications (Cambridge, England)","2016","52","3","586","589","10.1039/c5cc08348f","","","0.71073","MoKα","","0.0828","0.0619","","","0.1491","0.1601","","","","","","1.119","","","","has coordinates,has disorder","171856","2020-10-21","18:00:00",""
"7118216","42.986","0.011","17.237","0.004","27.577","0.009","90","","119.527","0.005","90","","17779","8","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C98 H96 N6 P4 Rh2 -","- C98 H96 N6 P4 Rh2 -","- C784 H768 N48 P32 Rh16 -","8","1","","Hänninen, Mikko M; Zamora, Matthew T.; MacNeil, Connor S.; Knott, Jackson P.; Hayes, Paul G.","Elucidation of the resting state of a rhodium NNN-pincer hydrogenation catalyst that features a remarkably upfield hydride (1)H NMR chemical shift.","Chemical communications (Cambridge, England)","2016","52","3","586","589","10.1039/c5cc08348f","","","0.71073","MoKα","","0.0609","0.0412","","","0.1085","0.1168","","","","","","1.077","","","","has coordinates,has disorder","171856","2020-10-21","18:00:00",""
"7118217","13.907","0.007","27.103","0.013","16.593","0.009","90","","112.133","0.011","90","","5793","5","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H56 N3 P2 Rh -","- C60 H56 N3 P2 Rh -","- C240 H224 N12 P8 Rh4 -","4","1","","Hänninen, Mikko M; Zamora, Matthew T.; MacNeil, Connor S.; Knott, Jackson P.; Hayes, Paul G.","Elucidation of the resting state of a rhodium NNN-pincer hydrogenation catalyst that features a remarkably upfield hydride (1)H NMR chemical shift.","Chemical communications (Cambridge, England)","2016","52","3","586","589","10.1039/c5cc08348f","","","0.71073","MoKα","","0.1645","0.0658","","","0.1357","0.1579","","","","","","0.896","","","","has coordinates,has disorder","171856","2020-10-21","18:00:00",""
"7118218","5.6288","0.0011","12.578","0.003","41.669","0.008","90","","90","","90","","2950.1","1.1","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H26 Br2 O4 -","- C36 H26 Br2 O4 -","- C144 H104 Br8 O16 -","4","1","","Wang, Zhan-Yong; Ding, Ya-Li; Wang, Gang; Cheng, Ying","Chiral N-heterocyclic carbene/Lewis acid cooperative catalysis of the reaction of 2-aroylvinylcinnamaldehydes: a switch of the reaction pathway by Lewis acid activation.","Chemical communications (Cambridge, England)","2015","52","4","788","791","10.1039/c5cc08866f","","","0.71073","MoKα","","0.0777","0.0698","","","0.1496","0.1646","","","","","","1.001","","","","has coordinates","171857","2020-10-21","18:00:00",""
"7118219","9.263","0.0012","12.8186","0.0016","22.369","0.003","90","","90","","90","","2656.1","0.6","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C36 H28 O4 -","- C36 H28 O4 -","- C144 H112 O16 -","4","1","","Wang, Zhan-Yong; Ding, Ya-Li; Wang, Gang; Cheng, Ying","Chiral N-heterocyclic carbene/Lewis acid cooperative catalysis of the reaction of 2-aroylvinylcinnamaldehydes: a switch of the reaction pathway by Lewis acid activation.","Chemical communications (Cambridge, England)","2015","52","4","788","791","10.1039/c5cc08866f","","","1.54187","CuKα","","0.0275","0.0269","","","0.0703","0.0707","","","","","","1.045","","","","has coordinates","171857","2020-10-21","18:00:00",""
"7118220","5.5911","0.0018","13.004","0.004","40.623","0.013","90","","90","","90","","2953.6","1.6","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H26 Br2 O4 -","- C36 H26 Br2 O4 -","- C144 H104 Br8 O16 -","4","1","","Wang, Zhan-Yong; Ding, Ya-Li; Wang, Gang; Cheng, Ying","Chiral N-heterocyclic carbene/Lewis acid cooperative catalysis of the reaction of 2-aroylvinylcinnamaldehydes: a switch of the reaction pathway by Lewis acid activation.","Chemical communications (Cambridge, England)","2015","52","4","788","791","10.1039/c5cc08866f","","","0.71075","MoKα","","0.0574","0.0388","","","0.0641","0.0701","","","","","","0.931","","","","has coordinates","171857","2020-10-21","18:00:00",""
"7118221","10.0641","0.0003","11.0425","0.0003","12.1824","0.0003","114.924","0.001","95.055","0.001","111.476","0.001","1094.39","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H11 F N2 -","- C13 H11 F N2 -","- C52 H44 F4 N8 -","4","2","","Dey, Dhananjay; Thomas, Sajesh P.; Spackman, Mark A.; Chopra, Deepak","'Quasi-isostructural polymorphism' in molecular crystals: inputs from interaction hierarchy and energy frameworks.","Chemical communications (Cambridge, England)","2016","52","10","2141","2144","10.1039/c5cc09741j","","","0.71073","MoKα","","0.0361","0.0338","","","0.0813","0.0828","","","","","","1.02","","","","has coordinates,has disorder","288505","2023-12-22","15:12:04",""
"7118222","12.7028","0.0017","8.3775","0.0008","11.5509","0.0012","90","","117.017","0.005","90","","1095.1","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 F2 N2 -","- C13 H10 F2 N2 -","- C52 H40 F8 N8 -","4","1","","Dey, Dhananjay; Thomas, Sajesh P.; Spackman, Mark A.; Chopra, Deepak","'Quasi-isostructural polymorphism' in molecular crystals: inputs from interaction hierarchy and energy frameworks.","Chemical communications (Cambridge, England)","2016","52","10","2141","2144","10.1039/c5cc09741j","","","0.71073","MoKα","","0.0685","0.0503","","","0.1263","0.1379","","","","","","1.026","","","","has coordinates,has disorder","288505","2023-12-22","15:12:04",""
"7118223","11.1829","0.0005","11.5006","0.0005","26.2259","0.0012","90","","92.219","0.003","90","","3370.4","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H33 N3 O6 -","- C41 H33 N3 O6 -","- C164 H132 N12 O24 -","4","1","","Kim, Jeong Gyun; Noh, Tae Hwan; Cho, Yoonjung; Park, Jin Kyoon; Jung, Ok-Sang","A triple-function nanotube as a reactant reservoir, reaction platform, and byproduct scavenger for photo-cyclopropanation.","Chemical communications (Cambridge, England)","2016","52","12","2545","2548","10.1039/c5cc09967f","","","0.71073","MoKα","","0.2677","0.14","","","0.3853","0.4384","","","","","","1.186","","","","has coordinates,has disorder","175874","2020-10-21","18:00:00",""
"7118224","54.6374","0.0005","54.6374","0.0005","8.9458","0.0001","90","","90","","120","","23127.6","0.4","173","2","173","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C41 H33 Cd Cl0 I2 N3 O6 -","- C41 H33 Cd I2 N3 O6 -","- C738 H594 Cd18 I36 N54 O108 -","18","1","","Kim, Jeong Gyun; Noh, Tae Hwan; Cho, Yoonjung; Park, Jin Kyoon; Jung, Ok-Sang","A triple-function nanotube as a reactant reservoir, reaction platform, and byproduct scavenger for photo-cyclopropanation.","Chemical communications (Cambridge, England)","2016","52","12","2545","2548","10.1039/c5cc09967f","","","0.71073","MoKα","","0.0955","0.0465","","","0.1117","0.1236","","","","","","0.889","","","","has coordinates","175874","2020-10-21","18:00:00",""
"7118225","54.5811","0.001","54.5811","0.001","8.9081","0.0002","90","","90","","120","","22982.7","0.8","173","2","173","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C42.17 H36 Br Cd I2 N3 O6.33 -","- C42.1666 H35.9998 Br Cd I2 N3 O6.3333 -","- C758.999 H647.996 Br18 Cd18 I36 N54 O113.999 -","18","1","","Kim, Jeong Gyun; Noh, Tae Hwan; Cho, Yoonjung; Park, Jin Kyoon; Jung, Ok-Sang","A triple-function nanotube as a reactant reservoir, reaction platform, and byproduct scavenger for photo-cyclopropanation.","Chemical communications (Cambridge, England)","2016","52","12","2545","2548","10.1039/c5cc09967f","","","0.71073","MoKα","","0.0998","0.0634","","","0.1916","0.2088","","","","","","1.01","","","","has coordinates","175874","2020-10-21","18:00:00",""
"7118226","54.772","0.0011","54.772","0.0011","8.8733","0.0002","90","","90","","120","","23053.3","0.8","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C42 H35 Cd I4 N3 O6 -","- C42 H35 Cd I4 N3 O6 -","- C756 H630 Cd18 I72 N54 O108 -","18","1","","Kim, Jeong Gyun; Noh, Tae Hwan; Cho, Yoonjung; Park, Jin Kyoon; Jung, Ok-Sang","A triple-function nanotube as a reactant reservoir, reaction platform, and byproduct scavenger for photo-cyclopropanation.","Chemical communications (Cambridge, England)","2016","52","12","2545","2548","10.1039/c5cc09967f","","","0.71073","MoKα","","0.2068","0.111","","","0.3318","0.3636","","","","","","1.09","","","","has coordinates,has disorder","175874","2020-10-21","18:00:00",""
"7118227","54.8819","0.0011","54.8819","0.0011","8.8759","0.0002","90","","90","","120","","23152.7","0.8","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C41 H33 Cd I2 N3 O6 -","- C41 H33 Cd I2 N3 O6 -","- C738 H594 Cd18 I36 N54 O108 -","18","1","","Kim, Jeong Gyun; Noh, Tae Hwan; Cho, Yoonjung; Park, Jin Kyoon; Jung, Ok-Sang","A triple-function nanotube as a reactant reservoir, reaction platform, and byproduct scavenger for photo-cyclopropanation.","Chemical communications (Cambridge, England)","2016","52","12","2545","2548","10.1039/c5cc09967f","","","0.71073","MoKα","","0.1169","0.061","","","0.1412","0.1536","","","","","","0.884","","","","has coordinates","175874","2020-10-21","18:00:00",""
"7118230","13.0622","0.0004","8.2259","0.0002","13.1485","0.0004","90","","106.33","0.001","90","","1355.79","0.07","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H18 Br Cl4 N2 O4 -","- C26 H18 Br Cl4 N2 O4 -","- C52 H36 Br2 Cl8 N4 O8 -","2","1","","Cao, Zhong-Yan; Zhao, Yu-Lei; Zhou, Jian","Sequential Au(i)/chiral tertiary amine catalysis: a tandem C-H functionalization of anisoles or a thiophene/asymmetric Michael addition sequence to quaternary oxindoles.","Chemical communications (Cambridge, England)","2016","52","12","2537","2540","10.1039/c5cc10096h","","","0.71073","MoKα","","0.0305","0.0272","","","0.0639","0.0649","","","","","","1.053","","","","has coordinates","175877","2020-10-21","18:00:00",""
"7118231","12.315","0.0002","13.9146","0.0003","15.2049","0.0003","90","","90","","90","","2605.49","0.09","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H21 Br Cl2 N2 O5 -","- C27 H21 Br Cl2 N2 O5 -","- C108 H84 Br4 Cl8 N8 O20 -","4","1","","Cao, Zhong-Yan; Zhao, Yu-Lei; Zhou, Jian","Sequential Au(i)/chiral tertiary amine catalysis: a tandem C-H functionalization of anisoles or a thiophene/asymmetric Michael addition sequence to quaternary oxindoles.","Chemical communications (Cambridge, England)","2016","52","12","2537","2540","10.1039/c5cc10096h","","","0.71073","MoKα","","0.0282","0.025","","","0.0594","0.0609","","","","","","1.036","","","","has coordinates","175877","2020-10-21","18:00:00",""
"7118232","14.6406","0.0002","9.57209","0.00015","19.5953","0.0003","90","","97.003","0.0014","90","","2725.62","0.07","123.01","0.1","123.01","0.1","","","","","","","","5","I 1 2 1","I 2y","5","","","","- C31 H30 Br N3 O5 -","- C31 H30 Br N3 O5 -","- C124 H120 Br4 N12 O20 -","4","1","","Zhao, Kun; Zhi, Ying; Li, Xinyi; Puttreddy, Rakesh; Rissanen, Kari; Enders, Dieter","Asymmetric synthesis of 3,3'-pyrrolidinyl-dispirooxindoles via a one-pot organocatalytic Mannich/deprotection/aza-Michael sequence.","Chemical communications (Cambridge, England)","2016","52","11","2249","2252","10.1039/c5cc10057g","","x-ray","1.54184","CuKα","","0.0295","0.0279","","","0.0724","0.0738","","","","","","1.046","","","","has coordinates,has disorder","175893","2020-10-21","18:00:00",""
"7118241","28.286","0.004","20.9422","0.0003","27.5862","0.0015","90","","120.798","0.006","90","","14037","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H24 In N2 O8 -","- C40 H24 In N2 O8 -","- C320 H192 In8 N16 O64 -","8","1","","Li, Xingjun; Chen, Xueyuan; Jiang, Feilong; Chen, Lian; Lu, Shan; Chen, Qihui; Wu, Mingyan; Yuan, Daqiang; Hong, Maochun","The dynamic response of a flexible indium based metal-organic framework to gas sorption.","Chemical communications (Cambridge, England)","2016","52","11","2277","2280","10.1039/c5cc09461e","","","1.54184","CuKα","","0.0742","0.0597","","","0.1802","0.1928","","","","","","1.009","","","","has coordinates","175879","2020-10-21","18:00:00",""
"7118242","26.9793","0.0006","21.3293","0.0004","26.4721","0.0005","90","","97.001","0.002","90","","15119.8","0.5","100","2","100","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","","","- C40 H24 In N2 O8 -","- C40 H24 In N2 O8 -","- C320 H192 In8 N16 O64 -","8","1","","Li, Xingjun; Chen, Xueyuan; Jiang, Feilong; Chen, Lian; Lu, Shan; Chen, Qihui; Wu, Mingyan; Yuan, Daqiang; Hong, Maochun","The dynamic response of a flexible indium based metal-organic framework to gas sorption.","Chemical communications (Cambridge, England)","2016","52","11","2277","2280","10.1039/c5cc09461e","","","1.54184","CuKα","","0.0693","0.0587","","","0.1696","0.1792","","","","","","1.071","","","","has coordinates","175879","2020-10-21","18:00:00",""
"7118243","8.352","0.0002","22.5729","0.0006","18.2914","0.0005","90","","100.772","0.002","90","","3387.69","0.15","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","Carbonyl-diiodacetylene-dimethylaminopyridine-hydridotris(3,5-dimethylpyrazolylborato)tungsten(II)-hexafluorophosphate","","- C25 H32 B F6 I2 N8 O P W -","- C25 H32 B F6 I2 N8 O P W -","- C100 H128 B4 F24 I8 N32 O4 P4 W4 -","4","1","","Helmdach, Kai; Rüger, Julia; Villinger, Alexander; Seidel, Wolfram W.","Dual nucleophilic substitution at a W(ii) η(2)-coordinated diiodo acetylene leading to an amidinium carbyne complex.","Chemical communications (Cambridge, England)","2016","52","12","2616","2619","10.1039/c5cc10397e","","","0.71073","MoKα","","0.1608","0.0635","","","0.1022","0.1327","","","","","","1.005","","","","has coordinates,has disorder","175867","2020-10-21","18:00:00",""
"7118244","25.7178","0.0009","11.6201","0.0004","25.7435","0.0008","90","","97.686","0.002","90","","7624.2","0.4","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Di(carbonyl)-N,N'-dibenzylamidiniumcarbyne)-hydridotris(3,5-dimethylpyrazolylborato)tungsten(II)-hexafluorophosphate","","- C33 H38 B F6 N8 O2 P W -","- C33 H38 B F6 N8 O2 P W -","- C264 H304 B8 F48 N64 O16 P8 W8 -","8","2","","Helmdach, Kai; Rüger, Julia; Villinger, Alexander; Seidel, Wolfram W.","Dual nucleophilic substitution at a W(ii) η(2)-coordinated diiodo acetylene leading to an amidinium carbyne complex.","Chemical communications (Cambridge, England)","2016","52","12","2616","2619","10.1039/c5cc10397e","","","0.71073","MoKα","","0.0815","0.0512","","","0.0925","0.1052","","","","","","1.018","","","","has coordinates,has disorder","175867","2020-10-21","18:00:00",""
"7118245","12.3928","0.0005","8.3243","0.0004","18.5364","0.0008","90","","95.888","0.001","90","","1902.15","0.14","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 Br O5 -","- C20 H21 Br O5 -","- C80 H84 Br4 O20 -","4","1","","Yu, Zhunzhun; Qiu, Haile; Liu, Lu; Zhang, Junliang","Gold-catalyzed construction of two adjacent quaternary stereocenters via sequential C-H functionalization and aldol annulation.","Chemical communications (Cambridge, England)","2016","52","11","2257","2260","10.1039/c5cc08880a","","","0.71073","MoKα","","0.0567","0.035","","","0.0827","0.0965","","","","","","1.014","","","","has coordinates","175881","2020-10-21","18:00:00",""
"7118246","9.2166","0.0003","9.0685","0.0003","23.2491","0.0008","90","","99.08","0.001","90","","1918.83","0.11","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 Br O5 -","- C21 H23 Br O5 -","- C84 H92 Br4 O20 -","4","1","","Yu, Zhunzhun; Qiu, Haile; Liu, Lu; Zhang, Junliang","Gold-catalyzed construction of two adjacent quaternary stereocenters via sequential C-H functionalization and aldol annulation.","Chemical communications (Cambridge, England)","2016","52","11","2257","2260","10.1039/c5cc08880a","","","0.71073","MoKα","","0.1123","0.0928","","","0.2416","0.2745","","","","","","1.142","","","","has coordinates","175881","2020-10-21","18:00:00",""
"7118247","10.9476","0.0004","11.03","0.0003","11.0714","0.0003","86.1003","0.0017","64.8281","0.0017","60.6087","0.0015","1037.28","0.06","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H24 N2 O3 -","- C27 H24 N2 O3 -","- C54 H48 N4 O6 -","2","1","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.0537","0.0425","","","0.1187","0.1368","","","","","","1.07","","","","has coordinates","175868","2020-10-21","18:00:00",""
"7118249","9.365","0.0009","11.4265","0.001","11.9971","0.0011","74.104","0.003","80.112","0.003","71.016","0.003","1162.72","0.19","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H24 N2 O2 -","- C31 H24 N2 O2 -","- C62 H48 N4 O4 -","2","1","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.0818","0.0502","","","0.1027","0.1209","","","","","","1.023","","","","has coordinates","175868","2020-10-21","18:00:00",""
"7118250","18.817","0.003","10.53","0.0012","9.5207","0.0015","90","","96.996","0.008","90","","1872.4","0.5","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H20 N3 O -","- C25 H19 N3 O -","- C100 H76 N12 O4 -","4","1","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.1677","0.0749","","","0.2004","0.2439","","","","","","1.039","","","","has coordinates,has disorder","175868","2020-10-21","18:00:00",""
"7118251","9.469","0.0009","10.0316","0.0011","13.1967","0.0013","83.975","0.003","70.468","0.003","85.668","0.003","1173.8","0.2","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H28 Cl N O3 -","- C27 H29 Cl N2 O3 -","- C54 H58 Cl2 N4 O6 -","2","1","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.0874","0.0553","","","0.1342","0.1631","","","","","","1.047","","","","has coordinates","175868","2020-10-21","18:00:00",""
"7118252","8.3566","0.0006","17.7311","0.0014","10.5304","0.0007","90","","101.637","0.005","90","","1528.24","0.19","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 N O4 -","- C19 H15 N O4 -","- C76 H60 N4 O16 -","4","1","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.1519","0.0822","","","0.1787","0.2231","","","","","","0.966","","","","has coordinates","175868","2020-10-21","18:00:00",""
"7118253","8.2128","0.0006","12.0722","0.0009","12.1473","0.001","80.826","0.003","73.356","0.003","74.316","0.002","1106.54","0.15","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H26 N2 O3 -","- C27 H26 N2 O3 -","- C54 H52 N4 O6 -","2","1","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.0881","0.0585","","","0.1351","0.1554","","","","","","1.032","","","","has coordinates","175868","2020-10-21","18:00:00",""
"7118254","15.9415","0.0012","14.8517","0.0012","6.2573","0.0005","90","","90","","90","","1481.5","0.2","103","2","103","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C18 H19 N O3 -","- C18 H19 N O3 -","- C72 H76 N4 O12 -","4","0.5","","Zhu, Xu; Chiba, Shunsuke","Construction of 1-pyrroline skeletons by Lewis acid-mediated conjugate addition of vinyl azides.","Chemical communications (Cambridge, England)","2016","52","12","2473","2476","10.1039/c5cc10299e","","","0.71073","MoKα","","0.1131","0.0485","","","0.1073","0.1308","","","","","","1.022","","","","has coordinates,has disorder","175868","2020-10-21","18:00:00",""
"7118255","9.5866","0.0004","19.5978","0.0006","7.6285","0.0003","90","","111.316","0.005","90","","1335.17","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1,2-dimethyl-3-methylenecyclopropyl)(6-nitrobenzo[d][1,3]dioxol-5-yl)methanol","","- C14 H15 N O5 -","- C14 H15 N O5 -","- C56 H60 N4 O20 -","4","1","","Baumann, A. N.; Music, A.; Karaghiosoff, K.; Didier, D.","Highly diastereoselective approach to methylenecyclopropanes via boron-homologation/allylboration sequences.","Chemical communications (Cambridge, England)","2016","52","12","2529","2532","10.1039/c5cc09904h","","","0.71069","MoKα","","0.0633","0.0462","","","0.1173","0.1252","","","","","","1.07","","","","has coordinates","175869","2020-10-21","18:00:00",""
"7118256","13.9666","0.0003","12.6444","0.0002","21.018","0.0015","90","","95.457","0.007","90","","3694.9","0.3","85","2","85","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Ru(bMepi)(PPh3)(Cl)CO","","- C45 H37 Cl N5 O P Ru -","- C45 H37 Cl N5 O P Ru -","- C180 H148 Cl4 N20 O4 P4 Ru4 -","4","1","","Tseng, Kuei-Nin T; Lin, Steve; Kampf, Jeff W.; Szymczak, Nathaniel K.","Upgrading ethanol to 1-butanol with a homogeneous air-stable ruthenium catalyst.","Chemical communications (Cambridge, England)","2016","52","14","2901","2904","10.1039/c5cc09913g","","","1.54178","CuKα","","0.0362","0.0358","","","0.0922","0.0926","","","","","","1.071","","","","has coordinates","177690","2020-10-21","18:00:00",""
"7118257","16.1333","0.0003","12.495","0.0004","16.9891","0.0005","90","","98.709","0.002","90","","3385.27","0.16","85","2","85","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Ru(b4OMepi)(PPh3)(Cl)(CO)","","- C39 H31 Cl N5 O3 P Ru -","- C39 H31 Cl N5 O3 P Ru -","- C156 H124 Cl4 N20 O12 P4 Ru4 -","4","1","","Tseng, Kuei-Nin T; Lin, Steve; Kampf, Jeff W.; Szymczak, Nathaniel K.","Upgrading ethanol to 1-butanol with a homogeneous air-stable ruthenium catalyst.","Chemical communications (Cambridge, England)","2016","52","14","2901","2904","10.1039/c5cc09913g","","","1.54178","CuKα","","0.096","0.0841","","","0.2275","0.2443","","","","","","1.107","","","","has coordinates","177690","2020-10-21","18:00:00",""
"7118258","8.2153","0.0008","11.1662","0.001","11.5343","0.0011","85.272","0.003","84.43","0.003","77.543","0.003","1026.24","0.17","290","","290","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H42 Cl6 Cu2 N6 -","- C38 H42 Cl6 Cu2 N6 -","- C38 H42 Cl6 Cu2 N6 -","1","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0467","0.0337","","","0.0973","0.1175","","","","","","1.161","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118259","8.1887","0.0006","10.9691","0.0007","11.3579","0.0008","85.0163","0.0015","85.1738","0.0016","77.5551","0.0015","990.21","0.12","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H42 Cl6 Cu2 N6 -","- C38 H42 Cl6 Cu2 N6 -","- C38 H42 Cl6 Cu2 N6 -","1","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0256","0.0237","","","0.0606","0.0618","","","","","","1.04","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118260","8.3056","0.0014","11.1055","0.0019","11.873","0.002","86.315","0.006","89.284","0.006","77.72","0.006","1067.9","0.3","290","","290","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H46 Cl6 Cu2 N6 -","- C40 H46 Cl6 Cu2 N6 -","- C40 H46 Cl6 Cu2 N6 -","1","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0823","0.0451","","","0.1163","0.1458","","","","","","1.045","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118261","8.3293","0.0013","10.9929","0.0017","11.7343","0.0018","86.079","0.005","89.732","0.006","77.869","0.005","1047.9","0.3","102","","102","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H46 Cl6 Cu2 N6 -","- C40 H46 Cl6 Cu2 N6 -","- C40 H46 Cl6 Cu2 N6 -","1","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0491","0.0363","","","0.1043","0.1225","","","","","","1.146","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118262","8.253","0.003","10.948","0.003","11.802","0.004","85.792","0.009","89.721","0.009","78.477","0.009","1042","0.6","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H40 Cl8 Cu2 N6 -","- C38 H40 Cl8 Cu2 N6 -","- C38 H40 Cl8 Cu2 N6 -","1","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0295","0.0256","","","0.0808","0.0952","","","","","","1.186","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118263","8.292","0.002","10.995","0.003","12.277","0.004","84.743","0.009","86.68","0.008","78.394","0.008","1090.9","0.5","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H46 Cl6 Cu2 N6 O2 -","- C40 H46 Cl6 Cu2 N6 O2 -","- C40 H46 Cl6 Cu2 N6 O2 -","1","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.041","0.0347","","","0.1015","0.1153","","","","","","1.208","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118264","9.0636","0.0013","9.6375","0.0013","20.925","0.003","90","","90","","90","","1827.8","0.4","100","","100","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 Cl Cu N4 O2 -","- C18 H18 Cl Cu N4 O2 -","- C72 H72 Cl4 Cu4 N16 O8 -","4","1","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0246","0.0228","","","0.0597","0.0605","","","","","","1.061","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7118265","9.5545","0.0005","8.8034","0.0005","23.9329","0.0012","90","","96.6239","0.0016","90","","1999.61","0.18","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 Cl Cu N3 -","- C21 H25 Cl Cu N3 -","- C84 H100 Cl4 Cu4 N12 -","4","1","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.0343","0.0296","","","0.072","0.0744","","","","","","1.058","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118266","10.0169","0.0004","15.969","0.0006","10.7209","0.0004","90","","95.056","0.001","90","","1708.24","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H38 Cl2 Cu2 N6 -","- C36 H38 Cl2 Cu2 N6 -","- C72 H76 Cl4 Cu4 N12 -","2","0.5","","Nitsch, Jörn; Lacemon, Frederick; Lorbach, Andreas; Eichhorn, Antonius; Cisnetti, Federico; Steffen, Andreas","Cuprophilic interactions in highly luminescent dicopper(i)-NHC-picolyl complexes - fast phosphorescence or TADF?","Chemical communications (Cambridge, England)","2016","52","14","2932","2935","10.1039/c5cc09659f","","","0.71073","MoKα","","0.023","0.021","","","0.0532","0.0541","","","","","","1.043","","","","has coordinates","177691","2020-10-21","18:00:00",""
"7118267","10.7137","0.0003","38.3822","0.0015","14.7478","0.0004","90","","90.909","0.001","90","","6063.8","0.3","150","2","150","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C43.5 H37 Al Au Cl F36 N2 O4 P4 -","- C43.5 H37 Al Au Cl F36 N2 O4 P4 -","- C174 H148 Al4 Au4 Cl4 F144 N8 O16 P16 -","4","1","","Borger, Jaap E.; Bakker, Martijn S.; Ehlers, Andreas W.; Lutz, Martin; Chris Slootweg, J.; Lammertsma, Koop","Functionalization of P4 in the coordination sphere of coinage metal cations.","Chemical communications (Cambridge, England)","2016","52","16","3284","3287","10.1039/c5cc10037b","","","0.71073","MoKα","","0.054","0.0485","","","0.121","0.123","","","","","","1.184","","","","has coordinates,has disorder","177667","2020-10-21","18:00:00",""
"7118268","39.9091","0.0008","25.1072","0.0006","22.5843","0.0004","90","","100.38","0.001","90","","22259.3","0.8","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C94 H97 Al Au2 F36 N4 O4 P4 -","- C94 H97 Al Au2 F36 N4 O4 P4 -","- C752 H776 Al8 Au16 F288 N32 O32 P32 -","8","1","","Borger, Jaap E.; Bakker, Martijn S.; Ehlers, Andreas W.; Lutz, Martin; Chris Slootweg, J.; Lammertsma, Koop","Functionalization of P4 in the coordination sphere of coinage metal cations.","Chemical communications (Cambridge, England)","2016","52","16","3284","3287","10.1039/c5cc10037b","","","0.71073","MoKα","","0.0323","0.0272","","","0.069","0.0719","","","","","","1.034","","","","has coordinates,has disorder","177667","2020-10-21","18:00:00",""
"7118269","8.8669","0.0005","14.7074","0.0007","17.9059","0.0009","90","","90","","90","","2335.1","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 Br N O3 -","- C27 H24 Br N O3 -","- C108 H96 Br4 N4 O12 -","4","1","","Li, Mingfeng; Guo, Xin; Jin, Weifeng; Zheng, Qing; Liu, Shunying; Hu, Wenhao","An enantioselective three-component reaction of diazoacetates with indoles and enals by iridium/iminium co-catalysis.","Chemical communications (Cambridge, England)","2016","52","13","2736","2739","10.1039/c5cc09918h","","","0.71073","MoKα","","0.0728","0.0397","","","0.0832","0.0949","","","","","","1.012","","","","has coordinates","177637","2020-10-21","18:00:00",""
"7118270","29.017","0.004","11.4978","0.0017","12.6967","0.0016","90","","111.472","0.008","90","","3942","1","90","0.5","90","0.5","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 O3 Si -","- C18 H32 O3 Si -","- C144 H256 O24 Si8 -","8","1","","Stepherson, Jacob R.; Fronczek, Frank R.; Kartika, Rendy","An expedient synthesis of functionalized 1,4-diketone-derived compounds via silyloxyallyl cation intermediates.","Chemical communications (Cambridge, England)","2016","52","11","2300","2303","10.1039/c5cc09763k","","","0.71073","MoKα","","0.1345","0.0686","","","0.1192","0.1452","","","","","","1.067","","","","has coordinates","175887","2020-10-21","18:00:00",""
"7118271","9.4533","0.0019","18.614","0.004","19.976","0.004","68.27","0.03","82.61","0.03","82.18","0.03","3223.2","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H44 N2 O20 Zn3 -","- C52 H44 N2 O20 Zn3 -","- C104 H88 N4 O40 Zn6 -","2","1","","Chakraborty, Anindita; Bhattacharyya, Sohini; Hazra, Arpan; Ghosh, Ashta Chandra; Maji, Tapas Kumar","Post-synthetic metalation in an anionic MOF for efficient catalytic activity and removal of heavy metal ions from aqueous solution.","Chemical communications (Cambridge, England)","2016","52","13","2831","2834","10.1039/c5cc09814a","","","0.71073","MoKα","","0.166","0.1105","","","0.2956","0.3304","","","","","","1.06","","","","has coordinates,has disorder","177638","2020-10-21","18:00:00",""
"7118272","13.1669","0.0001","12.7572","0.0001","20.0394","0.0002","90","","90","","90","","3366.07","0.05","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H26 Cl N W -","- C15 H26 Cl N W -","- C120 H208 Cl8 N8 W8 -","8","2","","Wright, Christopher M. R.; Turner, Zoë R; Buffet, Jean-Charles; O'Hare, Dermot","Tungsten imido catalysts for selective ethylene dimerisation.","Chemical communications (Cambridge, England)","2016","52","13","2850","2853","10.1039/c5cc09386d","","","0.71073","MoKα","","0.0354","0.0298","","","0.0694","0.0728","","","","","","0.963","","","","has coordinates","177639","2020-10-21","18:00:00",""
"7118273","8.5941","0.0001","14.1186","0.0002","17.4478","0.0003","95.806","0.001","98.562","0.001","97.484","0.001","2059.88","0.05","150","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H25 Cl4 N O W -","- C16 H25 Cl4 N O W -","- C64 H100 Cl16 N4 O4 W4 -","4","2","","Wright, Christopher M. R.; Turner, Zoë R; Buffet, Jean-Charles; O'Hare, Dermot","Tungsten imido catalysts for selective ethylene dimerisation.","Chemical communications (Cambridge, England)","2016","52","13","2850","2853","10.1039/c5cc09386d","","","0.71073","MoKα","","0.0371","0.0287","","","0.0651","0.0688","","","","","","1.097","","","","has coordinates,has disorder","177639","2020-10-21","18:00:00",""
"7118274","11.0068","0.0012","18.8343","0.0018","19.829","0.002","72.08","0.006","89.811","0.007","77.711","0.007","3813.1","0.7","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 N O4 -","- C22 H21 N O4 -","- C176 H168 N8 O32 -","8","4","","Xiao, Jun-An; Xia, Peng-Ju; Zhang, Xing-Yu; Chen, Xiao-Qing; Ou, Guang-Chuan; Yang, Hua","Amide-assisted intramolecular [3+2] annulation of cyclopropane ring-opening: a facile and diastereoselective access to the tricyclic core of (±)-scandine.","Chemical communications (Cambridge, England)","2016","52","10","2177","2180","10.1039/c5cc07485a","","","0.71073","MoKα","","0.1295","0.0534","","","0.1271","0.172","","","","","","0.994","","","","has coordinates","175864","2020-10-21","18:00:00",""
"7118275","9.035","0.002","13.258","0.003","16.686","0.004","90.402","0.003","103.495","0.003","105.139","0.003","1871.2","0.7","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 N O4 -","- C22 H21 N O4 -","- C88 H84 N4 O16 -","4","2","","Xiao, Jun-An; Xia, Peng-Ju; Zhang, Xing-Yu; Chen, Xiao-Qing; Ou, Guang-Chuan; Yang, Hua","Amide-assisted intramolecular [3+2] annulation of cyclopropane ring-opening: a facile and diastereoselective access to the tricyclic core of (±)-scandine.","Chemical communications (Cambridge, England)","2016","52","10","2177","2180","10.1039/c5cc07485a","","","0.71073","MoKα","","0.0644","0.044","","","0.1098","0.1214","","","","","","1.036","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7118276","44.225","0.002","11.0988","0.0005","15.9916","0.0007","90","","99.538","0.002","90","","7740.9","0.6","296","2","296.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H27 N O3 -","- C24 H27 N O3 -","- C384 H432 N16 O48 -","16","2","","Xiao, Jun-An; Xia, Peng-Ju; Zhang, Xing-Yu; Chen, Xiao-Qing; Ou, Guang-Chuan; Yang, Hua","Amide-assisted intramolecular [3+2] annulation of cyclopropane ring-opening: a facile and diastereoselective access to the tricyclic core of (±)-scandine.","Chemical communications (Cambridge, England)","2016","52","10","2177","2180","10.1039/c5cc07485a","","","0.71073","MoKα","","0.0643","0.0416","","","0.0976","0.1081","","","","","","1.026","","","","has coordinates","175864","2020-10-21","18:00:00",""
"7118277","15.517","0.003","9.825","0.002","21.953","0.004","90","","90.05","0.03","90","","3346.8","1.1","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C90 H187 O100 -","- C90 H187 O100 -","- C90 H187 O100 -","1","0.5","","Rutenberg, R.; Leitus, G.; Fallik, E.; Poverenov, E.","Discovery of a non classic host guest complexation mode in a β-cyclodextrin/propionic acid model.","Chemical communications (Cambridge, England)","2016","52","12","2565","2568","10.1039/c5cc09676f","","","0.71073","MoKα","","0.0729","0.0669","","","0.1716","0.1768","","","","","","1.052","","","","has coordinates,has disorder","175875","2020-10-21","18:00:00",""
"7118278","5.552","0.003","17.133","0.008","13.413","0.006","90","","93.446","0.007","90","","1273.6","1.1","296","2","296.15","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H25 F N2 O3 S -","- C30 H25 F N2 O3 S -","- C60 H50 F2 N4 O6 S2 -","2","1","","Sun, Xiao-Xue; Zhang, Hong-Hao; Li, Guo-Hao; Meng, Li; Shi, Feng","Diastereo- and enantioselective construction of an indole-based 2,3-dihydrobenzofuran scaffold via catalytic asymmetric [3+2] cyclizations of quinone monoimides with 3-vinylindoles.","Chemical communications (Cambridge, England)","2016","52","14","2968","2971","10.1039/c5cc09145d","","","0.71073","MoKα","","0.1099","0.0785","","","0.2076","0.2371","","","","","","1.067","","","","has coordinates","177697","2020-10-21","18:00:00",""
"7118279","6.9693","0.0002","12.1404","0.0003","19.3065","0.0005","90","","90.623","0.001","90","","1633.43","0.07","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(tert-butyl)-N,N-bis(2-hydroxyethyl)-2-hydroxyisophtalamide","","- C16 H24 N2 O5 -","- C16 H24 N2 O5 -","- C64 H96 N8 O20 -","4","1","","Eckshtain-Levi, Meital; Lavi, Ronit; Yufit, Dmitry S.; Daniel, Bareket; Green, Omer; Fleker, Ohad; Richman, Michal; Rahimipour, Shai; Gruzman, Arie; Benisvy, Laurent","A versatile water-soluble chelating and radical scavenging platform.","Chemical communications (Cambridge, England)","2016","52","11","2350","2353","10.1039/c5cc08198j","","x-ray","0.71073","MOKα","K-L~3~","0.0811","0.0661","","","0.1856","0.2006","","","","","","1.07","","","","has coordinates,has disorder","175878","2020-10-21","18:00:00",""
"7118280","20.6006","0.0006","12.5488","0.0003","27.283","0.0007","90","","92.36","0.03","90","","7047","0.4","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(tert-butyl)-N,N-bis(2-hydroxyethyl)-2-hydroxyisophtalamide terabutyl ammonium dichloromethane semi-solvate","","- C32.5 H60 Cl N3 O5 -","- C32.5 H60 Cl N3 O5 -","- C260 H480 Cl8 N24 O40 -","8","2","","Eckshtain-Levi, Meital; Lavi, Ronit; Yufit, Dmitry S.; Daniel, Bareket; Green, Omer; Fleker, Ohad; Richman, Michal; Rahimipour, Shai; Gruzman, Arie; Benisvy, Laurent","A versatile water-soluble chelating and radical scavenging platform.","Chemical communications (Cambridge, England)","2016","52","11","2350","2353","10.1039/c5cc08198j","","x-ray","0.71073","MoKα","K-L~3~","0.1505","0.0786","","","0.1518","0.1778","","","","","","1.036","","","","has coordinates","175878","2020-10-21","18:00:00",""
"7118281","13.96","0.0006","14.092","0.0006","18.3587","0.0007","89.637","0.001","83.246","0.001","85.326","0.001","3574.6","0.3","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H49 Cu N4 O11.5 -","- C32 H49 Cu N4 O11.5 -","- C128 H196 Cu4 N16 O46 -","4","2","","Eckshtain-Levi, Meital; Lavi, Ronit; Yufit, Dmitry S.; Daniel, Bareket; Green, Omer; Fleker, Ohad; Richman, Michal; Rahimipour, Shai; Gruzman, Arie; Benisvy, Laurent","A versatile water-soluble chelating and radical scavenging platform.","Chemical communications (Cambridge, England)","2016","52","11","2350","2353","10.1039/c5cc08198j","","x-ray","0.71073","MoKα","K-L~3~","0.0925","0.0555","","","0.1437","0.1682","","","","","","1.026","","","","has coordinates,has disorder","175878","2020-10-21","18:00:00",""
"7118282","14.438","0.006","15.006","0.007","16.156","0.007","104.214","0.008","92.043","0.006","94.227","0.007","3379","3","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C151 H146 Cl6 N8 O12 -","- C151 H146 Cl6 N8 O12 -","- C151 H146 Cl6 N8 O12 -","1","0.5","","Katoono, Ryo; Suzuki, Takanori","Planar chiral desymmetrization of a two-layered cyclophane and control of dynamic helicity through the arrangement of two nonstereogenic centers.","Chemical communications (Cambridge, England)","2016","52","5","1029","1031","10.1039/c5cc09069e","","","0.71075","MoKα","","","0.0794","","","","0.23","","","","","","1.269","","","","has coordinates","173511","2020-10-21","18:00:00",""
"7118283","18.7438","0.0012","5.9398","0.0004","19.1345","0.0014","90","","92.094","0.006","90","","2128.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 O3 -","- C27 H24 O3 -","- C108 H96 O12 -","4","1","","Kumar, Atul; Maurya, Shivam; Pratap, Kemant; Srivastava, Suman","Betaine mediated synthesis of annulated dihydrofurans from oxobis(methylthio)ketene acetals and N-butyl-N'-methyl ethane-1,2-diamine as precursors via NHC elimination.","Chemical communications (Cambridge, England)","2016","52","13","2795","2798","10.1039/c5cc09509c","","","0.71073","MoKα","","0.1223","0.0739","","","0.1674","0.1987","","","","","","1.022","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7118284","7.5489","0.0004","7.2995","0.0003","8.3759","0.0008","90","","97.935","0.006","90","","457.12","0.05","173.05","0.1","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,1,2,2-Tetranitratoethane","1,1,2,2-Tetranitratoethane","","- C2 H2 N4 O12 -","- C2 H2 N4 O12 -","- C4 H4 N8 O24 -","2","0.5","","Fischer, Dennis; Klapötke, Thomas M; Stierstorfer, Jörg","Tetranitratoethane.","Chemical communications (Cambridge, England)","2016","52","5","916","918","10.1039/c5cc09010e","","","0.71073","MoKα","","0.0395","0.0274","","","0.0641","0.0675","","","","","","0.945","","","","has coordinates","173513","2020-10-21","18:00:00",""
"7118285","14.7481","0.0015","33.056","0.003","25.607","0.003","90","","104.153","0.002","90","","12105","2","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C110 H108 Dy7 N24 O39 P3 -","- C110 H108 Dy7 N24 O39 P3 -","- C440 H432 Dy28 N96 O156 P12 -","4","1","","Tian, Haiquan; Bao, Song-Song; Zheng, Li-Min","Cyclic single-molecule magnets: from the odd-numbered heptanuclear to a dimer of heptanuclear dysprosium clusters.","Chemical communications (Cambridge, England)","2016","52","11","2314","2317","10.1039/c5cc08740f","","","0.71073","MoKα","","0.1325","0.0796","","","0.18","0.2131","","","","","","1.064","","","","has coordinates","175880","2020-10-21","18:00:00",""
"7118286","22.068","0.002","25.118","0.003","44.977","0.005","90","","101.477","0.002","90","","24432","5","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C212 H176 Dy14 N48 O70 P10 -","- C212 H176 Dy14 N48 O70 P10 -","- C848 H704 Dy56 N192 O280 P40 -","4","0.5","","Tian, Haiquan; Bao, Song-Song; Zheng, Li-Min","Cyclic single-molecule magnets: from the odd-numbered heptanuclear to a dimer of heptanuclear dysprosium clusters.","Chemical communications (Cambridge, England)","2016","52","11","2314","2317","10.1039/c5cc08740f","","","0.71073","MoKα","","0.2588","0.1576","","","0.316","0.3752","","","","","","1.063","","","","has coordinates","175880","2020-10-21","18:00:00",""
"7118287","18.6729","0.0002","11.0827","0.0001","33.857","0.0004","90","","90","","90","","7006.58","0.13","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C40 H32 Br4 N2 -","- C40 H32 Br4 N2 -","- C320 H256 Br32 N16 -","8","1","","Greulich, Tobias W.; Suzuki, Naoya; Daniliuc, Constantin G.; Fukazawa, Aiko; Yamaguchi, Eriko; Studer, Armido; Yamaguchi, Shigehiro","A biphenyl containing two electron-donating and two electron-accepting moieties: a rigid and small donor-acceptor-donor ladder system.","Chemical communications (Cambridge, England)","2016","52","11","2374","2377","10.1039/c5cc03063c","","","0.71073","MoKα","","0.0724","0.0491","","","0.0785","0.0885","","","","","","1.143","","","","has coordinates","175882","2020-10-21","18:00:00",""
"7118288","28.1262","0.0005","8.5442","0.0002","20.5029","0.0004","90","","109.719","0.001","90","","4638.24","0.17","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H42 N2 O2 P2 -","- C52 H42 N2 O2 P2 -","- C208 H168 N8 O8 P8 -","4","0.5","","Greulich, Tobias W.; Suzuki, Naoya; Daniliuc, Constantin G.; Fukazawa, Aiko; Yamaguchi, Eriko; Studer, Armido; Yamaguchi, Shigehiro","A biphenyl containing two electron-donating and two electron-accepting moieties: a rigid and small donor-acceptor-donor ladder system.","Chemical communications (Cambridge, England)","2016","52","11","2374","2377","10.1039/c5cc03063c","","","0.71073","MoKα","","0.0967","0.076","","","0.1963","0.2121","","","","","","1.075","","","","has coordinates","175882","2020-10-21","18:00:00",""
"7118289","11.0372","0.0006","12.6734","0.0007","13.6066","0.0007","87.925","0.002","67.674","0.002","66.578","0.002","1600.69","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H34 Br2 N2 -","- C40 H34 Br2 N2 -","- C80 H68 Br4 N4 -","2","1","","Greulich, Tobias W.; Suzuki, Naoya; Daniliuc, Constantin G.; Fukazawa, Aiko; Yamaguchi, Eriko; Studer, Armido; Yamaguchi, Shigehiro","A biphenyl containing two electron-donating and two electron-accepting moieties: a rigid and small donor-acceptor-donor ladder system.","Chemical communications (Cambridge, England)","2016","52","11","2374","2377","10.1039/c5cc03063c","","","1.54178","CuKα","","0.0282","0.0265","","","0.0663","0.0674","","","","","","1.03","","","","has coordinates,has disorder","175882","2020-10-21","18:00:00",""
"7118290","10.7866","0.0011","32.189","0.003","10.4301","0.001","90","","99.194","0.006","90","","3574.9","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H39 N2 O P -","- C46 H39 N2 O P -","- C184 H156 N8 O4 P4 -","4","1","","Greulich, Tobias W.; Suzuki, Naoya; Daniliuc, Constantin G.; Fukazawa, Aiko; Yamaguchi, Eriko; Studer, Armido; Yamaguchi, Shigehiro","A biphenyl containing two electron-donating and two electron-accepting moieties: a rigid and small donor-acceptor-donor ladder system.","Chemical communications (Cambridge, England)","2016","52","11","2374","2377","10.1039/c5cc03063c","","","1.54178","CuKα","","0.2504","0.1989","","","0.3847","0.4087","","","","","","1.218","","","","has coordinates,has disorder","175882","2020-10-21","18:00:00",""
"7118291","29.5733","0.0017","8.868","0.0006","20.0015","0.0011","90","","109.81","0.002","90","","4935.1","0.5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H66 N2 O2 P2 -","- C56 H66 N2 O2 P2 -","- C224 H264 N8 O8 P8 -","4","0.5","","Greulich, Tobias W.; Suzuki, Naoya; Daniliuc, Constantin G.; Fukazawa, Aiko; Yamaguchi, Eriko; Studer, Armido; Yamaguchi, Shigehiro","A biphenyl containing two electron-donating and two electron-accepting moieties: a rigid and small donor-acceptor-donor ladder system.","Chemical communications (Cambridge, England)","2016","52","11","2374","2377","10.1039/c5cc03063c","","","0.71073","MoKα","","0.0878","0.062","","","0.1516","0.1627","","","","","","1.035","","","","has coordinates,has disorder","175882","2020-10-21","18:00:00",""
"7118292","14.6684","0.0002","16.1503","0.0003","16.8665","0.0003","109.87","0.0015","99.8419","0.0014","95.2508","0.0014","3653.9","0.12","180","","180","","","","101","","","","","5","P -1","-P 1","2","","","","- C40 H47 Cl Hg O4 -","- C40 H47 Cl Hg O4 -","- C160 H188 Cl4 Hg4 O16 -","4","2","","Slavík, Petr; Kohout, Michal; Böhm, Stanislav; Eigner, Václav; Lhoták, Pavel","Synthesis of inherently chiral calixarenes via direct mercuration of the partial cone conformation.","Chemical communications (Cambridge, England)","2016","52","11","2366","2369","10.1039/c5cc09388k","","","1.5418","CuKα","","0.0492","0.0462","","0.0913","0.0881","0.0913","","","","","","0.9853","","","","has coordinates,has disorder","175883","2020-10-21","18:00:00",""
"7118293","36.8232","0.0011","9.7905","0.0003","26.7317","0.0009","90","","131.016","0.004","90","","7271.6","0.6","120","0.1","120","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H47 Cl Hg O4 -","- C40 H47 Cl Hg O4 -","- C320 H376 Cl8 Hg8 O32 -","8","1","","Slavík, Petr; Kohout, Michal; Böhm, Stanislav; Eigner, Václav; Lhoták, Pavel","Synthesis of inherently chiral calixarenes via direct mercuration of the partial cone conformation.","Chemical communications (Cambridge, England)","2016","52","11","2366","2369","10.1039/c5cc09388k","","x-ray","1.54184","CuKα","","0.0323","0.0291","","","0.0808","0.084","","","","1.38","1.38","1.37","","","","has coordinates,has disorder","175883","2020-10-21","18:00:00",""
"7118294","10.5111","0.0004","17.7963","0.0005","19.3271","0.0007","110.342","0.003","96.592","0.003","101.212","0.002","3259.1","0.2","120","","120","","","","101","","","","","3","P -1","-P 1","2","","","","- C40 H46 O4 -","- C40 H46 O4 -","- C160 H184 O16 -","4","2","","Slavík, Petr; Kohout, Michal; Böhm, Stanislav; Eigner, Václav; Lhoták, Pavel","Synthesis of inherently chiral calixarenes via direct mercuration of the partial cone conformation.","Chemical communications (Cambridge, England)","2016","52","11","2366","2369","10.1039/c5cc09388k","","","1.5418","CuKα","","0.0541","0.0427","","0.1068","0.0951","0.1067","","","","","","0.9412","","","","has coordinates,has disorder","175883","2020-10-21","18:00:00",""
"7118295","29.189","0.003","26.117","0.003","20.479","0.002","90","","124.572","0.002","90","","12855","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C106 H135 Fe6 N6 O50 Tb3 -","- C106 H111 Fe6 N6 O50 Tb3 -","- C424 H444 Fe24 N24 O200 Tb12 -","4","0.5","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.0679","0.0476","","","0.1259","0.1373","","","","","","1.035","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118296","29.2726","0.0009","26.0163","0.0008","20.8386","0.0006","90","","125.139","0.001","90","","12977.8","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C109 H143 Dy3 Fe6 N6 O51 -","- C101 H107 Dy3 Fe6 N6 O43 -","- C404 H428 Dy12 Fe24 N24 O172 -","4","0.5","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.8","synchrotron","","0.0816","0.064","","","0.1926","0.2114","","","","","","1.549","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118297","29.211","0.002","25.894","0.002","20.7929","0.0016","90","","124.97","0.005","90","","12888","1.8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C109 H143 Fe6 Ho3 N6 O51 -","- C101 H111 Fe6 Ho3 N6 O43 -","- C404 H444 Fe24 Ho12 N24 O172 -","4","0.5","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.098","0.0669","","","0.1628","0.1768","","","","","","1.015","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118298","29.069","0.004","25.935","0.004","20.683","0.003","90","","124.822","0.002","90","","12801","3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C108 H139 Fe6 N6 O50 Tm3 -","- C108 H111 Fe6 N6 O50 Tm3 -","- C432 H444 Fe24 N24 O200 Tm12 -","4","0.5","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.0992","0.0626","","","0.1427","0.1595","","","","","","1.037","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118299","19.6191","0.0015","22.3573","0.0017","31.163","0.003","77.52","0.002","80.86","0.002","71.74","0.001","12612.6","1.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C112 H151 Fe6 N6 O52 Yb3 -","- C101.375 H108.5 Fe6 N6 O41.375 Yb3 -","- C405.5 H434 Fe24 N24 O165.5 Yb12 -","4","2","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.1406","0.0848","","","0.185","0.213","","","","","","1.105","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118300","29.1226","0.0016","25.811","0.002","20.8572","0.0012","90","","125.126","0.004","90","","12822.9","1.6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C109 H143 Fe6 Lu3 N6 O51 -","- C101 H107 Fe6 Lu3 N6 O43 -","- C404 H428 Fe24 Lu12 N24 O172 -","4","0.5","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.0879","0.0664","","","0.1627","0.1728","","","","","","1.073","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118301","29.172","0.004","25.835","0.003","20.884","0.003","90","","125.552","0.009","90","","12805","3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C108 H139 Fe6 N6 O50 Y3 -","- C101 H107 Fe6 N6 O43 Y3 -","- C404 H428 Fe24 N24 O172 Y12 -","4","0.5","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.1215","0.0716","","","0.1724","0.1918","","","","","","0.965","","","","has coordinates,has disorder","173518","2020-10-21","18:00:00",""
"7118302","23.721","0.002","20.6579","0.0018","26.078","0.002","90","","100.61","0.002","90","","12560.4","1.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C107 H125 Cl6 Fe6 Gd3 N6 O47 -","- C107 H125 Cl6 Fe6 Gd3 N6 O47 -","- C428 H500 Cl24 Fe24 Gd12 N24 O188 -","4","1","","Kühne, Irina A; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K.","Nine members of a family of nine-membered cyclic coordination clusters; Fe6Ln3 wheels (Ln = Gd to Lu and Y).","Chemical communications (Cambridge, England)","2016","52","5","1021","1024","10.1039/c5cc08887a","","","0.71073","MoKα","","0.0402","0.0313","","","0.0719","0.0761","","","","","","1.056","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7118303","13.3984","0.0011","13.3984","0.0011","27.542","0.002","90","","90","","120","","4281.9","0.6","130","2","130","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C24 H38 B N6 S3 Zn -","- C24 H38 B N6 S3 Zn -","- C144 H228 B6 N36 S18 Zn6 -","6","0.333333","","Kreider-Mueller, Ava; Quinlivan, Patrick J.; Rauch, Michael; Owen, Jonathan S.; Parkin, Gerard","Synthesis, structure and reactivity of [Tm(Bu(t))]ZnH, a monomeric terminal zinc hydride compound in a sulfur-rich coordination environment: access to a heterobimetallic compound.","Chemical communications (Cambridge, England)","2016","52","11","2358","2361","10.1039/c5cc08915h","","","0.71073","MoKα","","0.0651","0.0373","","","0.0739","0.0799","","","","","","1.005","","","","has coordinates","211691","2020-10-21","18:00:00",""
"7118304","13.473","0.0014","13.473","0.0014","67.359","0.007","90","","90","","120","","10589","1.9","296","2","296","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C41 H57 B N6 S3 Zn -","- C22.9998 H38.9995 B N6 S3 Zn -","- C275.998 H467.994 B12 N72 S36 Zn12 -","12","0.333333","","Kreider-Mueller, Ava; Quinlivan, Patrick J.; Rauch, Michael; Owen, Jonathan S.; Parkin, Gerard","Synthesis, structure and reactivity of [Tm(Bu(t))]ZnH, a monomeric terminal zinc hydride compound in a sulfur-rich coordination environment: access to a heterobimetallic compound.","Chemical communications (Cambridge, England)","2016","52","11","2358","2361","10.1039/c5cc08915h","","","0.71073","MoKα","","0.0496","0.0411","","","0.1274","0.1322","","","","","","1.037","","","","has coordinates,has disorder","175884","2020-10-21","18:00:00",""
"7118305","10.3568","0.0008","19.5721","0.0015","10.5278","0.0011","90","","119.424","0.001","90","","1858.8","0.3","130","2","130","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C34 H47 B N6 O2 S3 Zn -","- C34 H47 B N6 O2 S3 Zn -","- C68 H94 B2 N12 O4 S6 Zn2 -","2","1","","Kreider-Mueller, Ava; Quinlivan, Patrick J.; Rauch, Michael; Owen, Jonathan S.; Parkin, Gerard","Synthesis, structure and reactivity of [Tm(Bu(t))]ZnH, a monomeric terminal zinc hydride compound in a sulfur-rich coordination environment: access to a heterobimetallic compound.","Chemical communications (Cambridge, England)","2016","52","11","2358","2361","10.1039/c5cc08915h","","","0.71073","MoKα","","0.0694","0.0467","","","0.0785","0.0858","","","","","","1.007","","","","has coordinates","175884","2020-10-21","18:00:00",""
"7118306","10.2866","0.001","12.0489","0.0012","19.226","0.0019","92.635","0.001","93.904","0.001","114.888","0.001","2149.3","0.4","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C41 H51 B Mo N6 O3 S3 Zn -","- C41 H51 B Mo N6 O3 S3 Zn -","- C82 H102 B2 Mo2 N12 O6 S6 Zn2 -","2","1","","Kreider-Mueller, Ava; Quinlivan, Patrick J.; Rauch, Michael; Owen, Jonathan S.; Parkin, Gerard","Synthesis, structure and reactivity of [Tm(Bu(t))]ZnH, a monomeric terminal zinc hydride compound in a sulfur-rich coordination environment: access to a heterobimetallic compound.","Chemical communications (Cambridge, England)","2016","52","11","2358","2361","10.1039/c5cc08915h","","","0.71073","MoKα","","0.0607","0.0398","","","0.0871","0.0965","","","","","","1.033","","","","has coordinates","175884","2020-10-21","18:00:00",""
"7118307","13.199","0.005","17.979","0.006","13.504","0.005","90","","92.785","0.005","90","","3201","2","130","2","130","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 B F N6 S4 Zn -","- C27 H38 B F N6 S4 Zn -","- C108 H152 B4 F4 N24 S16 Zn4 -","4","1","","Kreider-Mueller, Ava; Quinlivan, Patrick J.; Rauch, Michael; Owen, Jonathan S.; Parkin, Gerard","Synthesis, structure and reactivity of [Tm(Bu(t))]ZnH, a monomeric terminal zinc hydride compound in a sulfur-rich coordination environment: access to a heterobimetallic compound.","Chemical communications (Cambridge, England)","2016","52","11","2358","2361","10.1039/c5cc08915h","","","0.71073","MoKα","","0.1651","0.068","","","0.1182","0.1524","","","","","","1.006","","","","has coordinates","175884","2020-10-21","18:00:00",""
"7118308","14.5199","0.0004","25.6135","0.0007","27.6975","0.0008","94.512","0.002","99.078","0.002","93.145","0.002","10116.6","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- Co6 H224 Li14 Na9 O250 P5 W36 -","- Co6 Na4.53 O174.9 P5 W36 -","- Co12 Na9.06 O349.8 P10 W72 -","2","1","","Martin-Sabi, Mercè; Winter, Ross Stuart; Lydon, Claire; Cameron, Jamie M.; Long, De-Liang; Cronin, Leroy","Rearrangement of {α-P2W15} to {PW6} moieties during the assembly of transition-metal-linked polyoxometalate clusters.","Chemical communications (Cambridge, England)","2016","52","5","919","921","10.1039/c5cc08486e","","","0.71073","MoKα","","0.1339","0.0492","","","0.1068","0.121","","","","","","0.802","","","","has coordinates","173520","2020-10-21","18:00:00",""
"7118309","14.0471","0.0002","21.9582","0.0004","30.7558","0.0004","87.466","0.002","88.627","0.002","86.131","0.002","9453.6","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- H120 Li12 Mn6 Na11 O198 P5 W36 -","- Mn6 Na3.8 O177.35 P5 W36 -","- Mn12 Na7.6 O354.7 P10 W72 -","2","1","","Martin-Sabi, Mercè; Winter, Ross Stuart; Lydon, Claire; Cameron, Jamie M.; Long, De-Liang; Cronin, Leroy","Rearrangement of {α-P2W15} to {PW6} moieties during the assembly of transition-metal-linked polyoxometalate clusters.","Chemical communications (Cambridge, England)","2016","52","5","919","921","10.1039/c5cc08486e","","","0.71073","MoKα","","0.1203","0.0614","","","0.1616","0.1774","","","","","","0.963","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7118310","14.0535","0.0008","29.6184","0.0016","31.8218","0.0016","74.118","0.005","81.242","0.004","89.716","0.004","12582","1.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- H137 Li20 Mn9 Na5 O245 P8 W45 -","- Mn9 Na2.2 O203 P7.5 W45 -","- Mn18 Na4.4 O406 P15 W90 -","2","1","","Martin-Sabi, Mercè; Winter, Ross Stuart; Lydon, Claire; Cameron, Jamie M.; Long, De-Liang; Cronin, Leroy","Rearrangement of {α-P2W15} to {PW6} moieties during the assembly of transition-metal-linked polyoxometalate clusters.","Chemical communications (Cambridge, England)","2016","52","5","919","921","10.1039/c5cc08486e","","","1.54184","CuKα","","0.1857","0.0886","","","0.2096","0.2476","","","","","","0.882","","","","has coordinates","173520","2020-10-21","18:00:00",""
"7118311","16.314","0.0013","15.3614","0.0006","18.1903","0.0008","90","","92.867","0.007","90","","4552.9","0.5","101","2","101","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C68 H162 Br Cr Mo6 N5 O26 -","- C68 H157.818 Br Cr Mo6 N5 O25.409 -","- C136 H315.636 Br2 Cr2 Mo12 N10 O50.818 -","2","1","","Zhang, Jiangwei; Li, Qi; Zeng, Mengyan; Huang, Yichao; Zhang, Jin; Hao, Jian; Wei, Yongge","The proton-controlled synthesis of unprecedented diol functionalized Anderson-type POMs.","Chemical communications (Cambridge, England)","2016","52","11","2378","2381","10.1039/c5cc10071b","","","0.71073","MoKα","","0.0465","0.0359","","","0.0861","0.0933","","","","","","1.03","","","","has coordinates,has disorder","175885","2020-10-21","18:00:00",""
"7118312","13.554","0.0014","13.7899","0.001","21.0955","0.0018","86.768","0.007","88.944","0.008","63.016","0.009","3508","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H109 Cr Mo6 N6 O29 -","- C45 H108.4 Cr Mo6 N6 O28.7 -","- C90 H216.8 Cr2 Mo12 N12 O57.4 -","2","1","","Zhang, Jiangwei; Li, Qi; Zeng, Mengyan; Huang, Yichao; Zhang, Jin; Hao, Jian; Wei, Yongge","The proton-controlled synthesis of unprecedented diol functionalized Anderson-type POMs.","Chemical communications (Cambridge, England)","2016","52","11","2378","2381","10.1039/c5cc10071b","","","0.7107","MoKα","","0.0442","0.0339","","","0.0614","0.0737","","","","","","1.05","","","","has coordinates","175885","2020-10-21","18:00:00",""
"7118313","13.6865","0.0008","13.7366","0.0008","21.5248","0.0009","86.727","0.004","83.692","0.004","62.304","0.006","3561.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H108 Cr Mo6 N5 O28 -","- C46 H108 Cr Mo6 N5 O29 -","- C92 H216 Cr2 Mo12 N10 O58 -","2","1","","Zhang, Jiangwei; Li, Qi; Zeng, Mengyan; Huang, Yichao; Zhang, Jin; Hao, Jian; Wei, Yongge","The proton-controlled synthesis of unprecedented diol functionalized Anderson-type POMs.","Chemical communications (Cambridge, England)","2016","52","11","2378","2381","10.1039/c5cc10071b","","","0.71073","MoKα","","0.0489","0.0374","","","0.0755","0.0807","","","","","","1.06","","","","has coordinates,has disorder","175885","2020-10-21","18:00:00",""
"7118314","23.7911","0.0005","15.3677","0.0004","28.4337","0.0007","90","","96.193","0.002","90","","10335.1","0.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C68 H177 Br3 Cr Mo6 N6 O32.5 -","- C68 H170.5 Br3 Cr Mo6 N6 O32.5 -","- C272 H682 Br12 Cr4 Mo24 N24 O130 -","4","2","","Zhang, Jiangwei; Li, Qi; Zeng, Mengyan; Huang, Yichao; Zhang, Jin; Hao, Jian; Wei, Yongge","The proton-controlled synthesis of unprecedented diol functionalized Anderson-type POMs.","Chemical communications (Cambridge, England)","2016","52","11","2378","2381","10.1039/c5cc10071b","","","0.71073","MoKα","","0.0814","0.0472","","","0.1047","0.123","","","","","","1.019","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118315","24.0231","0.0005","15.1457","0.0004","28.6632","0.0007","90","","95.967","0.002","90","","10372.5","0.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C68 H176 Br3 Cr Mo6 N6 O31 -","- C69 H170 Br3 Cr Mo6 N6 O31 -","- C276 H680 Br12 Cr4 Mo24 N24 O124 -","4","2","","Zhang, Jiangwei; Li, Qi; Zeng, Mengyan; Huang, Yichao; Zhang, Jin; Hao, Jian; Wei, Yongge","The proton-controlled synthesis of unprecedented diol functionalized Anderson-type POMs.","Chemical communications (Cambridge, England)","2016","52","11","2378","2381","10.1039/c5cc10071b","","","0.71073","MoKα","","0.0628","0.0455","","","0.0927","0.1087","","","","","","1.018","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118316","16.5248","0.0013","15.1876","0.0006","18.3785","0.0008","90","","93.071","0.007","90","","4605.9","0.5","100","","100","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C67 H161 Br Cr Mo6 N4 O28 -","- C67 H158 Br Cr Mo6 N4 O27 -","- C134 H316 Br2 Cr2 Mo12 N8 O54 -","2","1","","Zhang, Jiangwei; Li, Qi; Zeng, Mengyan; Huang, Yichao; Zhang, Jin; Hao, Jian; Wei, Yongge","The proton-controlled synthesis of unprecedented diol functionalized Anderson-type POMs.","Chemical communications (Cambridge, England)","2016","52","11","2378","2381","10.1039/c5cc10071b","","","0.71073","MoKα","","0.0575","0.0465","","","0.0968","0.1046","","","","","","1.034","","","","has coordinates,has disorder","175885","2020-10-21","18:00:00",""
"7118317","7","0.0007","7.1645","0.0008","13.4574","0.0016","94.095","0.004","93.302","0.004","105.223","0.004","647.52","0.12","296","2","296","2","","","","","","","","4","P 1","P 1","1","","","","- C11 H12 N6 O2 -","- C11 H12 N6 O2 -","- C22 H24 N12 O4 -","2","2","","Pathigoolla, Atchutarao; Sureshan, Kana M.","The topochemical synthesis of triazole-linked homobasic DNA.","Chemical communications (Cambridge, England)","2016","52","5","886","888","10.1039/c5cc08834h","","","0.71073","MoKα","","0.0853","0.0603","","","0.1639","0.191","","","","","","0.927","","","","has coordinates,has disorder","173522","2020-10-21","18:00:00",""
"7118318","14.965","0.005","24.298","0.008","15.796","0.005","90","","110.07","0.005","90","","5395","3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H53 Br3 Co2 N3 O P -","- C37 H53 Br3 Co2 N3 O P -","- C148 H212 Br12 Co8 N12 O4 P4 -","4","1","","Simler, Thomas; Braunstein, Pierre; Danopoulos, Andreas A.","Cobalt PNC(NHC) 'pincers': ligand dearomatisation, formation of dinuclear and N2 complexes and promotion of C-H activation.","Chemical communications (Cambridge, England)","2016","52","13","2717","2720","10.1039/c5cc10121b","","","0.71073","MoKα","","0.235","0.0846","","","0.2019","0.2428","","","","","","0.825","","","","has coordinates","177635","2020-10-21","18:00:00",""
"7118319","12.8384","0.0008","17.0917","0.0012","16.7231","0.0008","90","","116.587","0.004","90","","3281.5","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H45 Br Co N3 P -","- C33 H45 Br Co N3 P -","- C132 H180 Br4 Co4 N12 P4 -","4","1","","Simler, Thomas; Braunstein, Pierre; Danopoulos, Andreas A.","Cobalt PNC(NHC) 'pincers': ligand dearomatisation, formation of dinuclear and N2 complexes and promotion of C-H activation.","Chemical communications (Cambridge, England)","2016","52","13","2717","2720","10.1039/c5cc10121b","","","0.71073","MoKα","","0.1037","0.0456","","","0.0747","0.0884","","","","","","1.002","","","","has coordinates","177635","2020-10-21","18:00:00",""
"7118320","14.852","0.0012","16.6741","0.0013","18.3766","0.0015","66.34","0.002","84.429","0.002","66.37","0.002","3807.8","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H90 Co2 N8 P2 -","- C66 H90 Co2 N8 P2 -","- C132 H180 Co4 N16 P4 -","2","1","","Simler, Thomas; Braunstein, Pierre; Danopoulos, Andreas A.","Cobalt PNC(NHC) 'pincers': ligand dearomatisation, formation of dinuclear and N2 complexes and promotion of C-H activation.","Chemical communications (Cambridge, England)","2016","52","13","2717","2720","10.1039/c5cc10121b","","","0.71073","MoKα","","0.167","0.0796","","","0.1847","0.2122","","","","","","0.882","","","","has coordinates","177635","2020-10-21","18:00:00",""
"7118321","25.681","0.009","15.695","0.005","18.634","0.007","90","","113.151","0.008","90","","6906","4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H45 Co N5 P -","- C33 H45 Co N5 P -","- C264 H360 Co8 N40 P8 -","8","1","","Simler, Thomas; Braunstein, Pierre; Danopoulos, Andreas A.","Cobalt PNC(NHC) 'pincers': ligand dearomatisation, formation of dinuclear and N2 complexes and promotion of C-H activation.","Chemical communications (Cambridge, England)","2016","52","13","2717","2720","10.1039/c5cc10121b","","","0.71073","MoKα","","0.1186","0.0569","","","0.123","0.1398","","","","","","0.982","","","","has coordinates","177635","2020-10-21","18:00:00",""
"7118322","8.154","0.0016","11.633","0.002","12.467","0.003","67.55","0.03","76.11","0.03","76.47","0.03","1047.6","0.4","170","","170","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H9 I N2 O3 -","- C9 H9 I N2 O3 -","- C36 H36 I4 N8 O12 -","4","2","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","","0.71073","MoKα","","0.021","0.0187","","","0.0415","0.0425","","","","","","1.043","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118323","9.7294","0.0019","11.427","0.002","11.566","0.002","90.02","0.03","110.88","0.03","93.06","0.03","1199.5","0.4","170","","170","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H12 I N2 O3.5 -","- C10 H12 I N2 O3.5 -","- C40 H48 I4 N8 O14 -","4","2","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","","0.71073","MoKα","","0.0273","0.0229","","","0.0479","0.0494","","","","","","1.044","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118324","5.7923","0.0012","8.4216","0.0017","29.71","0.006","90","","90","","90","","1449.3","0.5","170","","170","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 I N2 O3 -","- C15 H13 I N2 O3 -","- C60 H52 I4 N8 O12 -","4","1","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","","0.71073","MoKα","","0.0396","0.0383","","","0.1368","0.1375","","","","","","1.163","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118325","7.137","0.0014","22.707","0.005","8.8248","0.0018","90","","90.68","0.03","90","","1430","0.5","170","","170","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 I N2 O4 S -","- C12 H9 I N2 O4 S -","- C48 H36 I4 N8 O16 S4 -","4","1","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","","0.71073","MoKα","","0.0891","0.0614","","","0.1111","0.1217","","","","","","1.048","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118326","7.2705","0.0015","8.7631","0.0018","12.765","0.003","109.12","0.03","99.97","0.03","90.54","0.03","754.9","0.3","170","","170","","","","","","","","","6","P -1","-P 1","2","","","","- C13 H11 I N2 O4 S -","- C13 H11 I N2 O4 S -","- C26 H22 I2 N4 O8 S2 -","2","1","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","","0.71073","MoKα","","0.0307","0.0264","","","0.0593","0.0606","","","","","","1.063","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118327","12.277","0.003","10.283","0.002","14.972","0.003","90","","106.71","0.03","90","","1810.3","0.7","170","","170","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H13 I N2 O4 S -","- C18 H13 I N2 O4 S -","- C72 H52 I4 N8 O16 S4 -","4","1","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","","0.71073","MoKα","","0.0785","0.0392","","","0.0637","0.0734","","","","","","1.01","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118328","6.8571","0.0004","8.4482","0.0005","11.3117","0.0006","98.755","0.005","106.766","0.005","93.582","0.005","616.19","0.06","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H10 N2 O4 S -","- C12 H10 N2 O4 S -","- C24 H20 N4 O8 S2 -","2","1","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","x-ray","0.71073","MoKα","","0.0434","0.0374","","","0.0969","0.1015","","","","","","1.163","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118329","14.1204","0.001","6.8482","0.0004","14.7897","0.0013","90","","112.86","0.01","90","","1317.83","0.19","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N2 O4 S -","- C13 H12 N2 O4 S -","- C52 H48 N8 O16 S4 -","4","1","","Puttreddy, Rakesh; Jurček, Ondřej; Bhowmik, Sandip; Mäkelä, Toni; Rissanen, Kari","Very strong (-)N-X(+)(-)O-N(+) halogen bonds.","Chemical communications (Cambridge, England)","2016","52","11","2338","2341","10.1039/c5cc09487a","","x-ray","0.71073","MoKα","","0.0779","0.0527","","","0.1302","0.1483","","","","","","1.067","","","","has coordinates","175886","2020-10-21","18:00:00",""
"7118330","5.79637","0.00017","13.3106","0.0003","25.2934","0.0006","90","","90","","90","","1951.47","0.09","123","0.1","123","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 Cl N O6 -","- C21 H20 Cl N O6 -","- C84 H80 Cl4 N4 O24 -","4","1","","Shu, Tao; Ni, Qijian; Song, Xiaoxiao; Zhao, Kun; Wu, Tianyu; Puttreddy, Rakesh; Rissanen, Kari; Enders, Dieter","Asymmetric synthesis of cyclopentanes bearing four contiguous stereocenters via an NHC-catalyzed Michael/Michael/esterification domino reaction.","Chemical communications (Cambridge, England)","2016","52","12","2609","2611","10.1039/c5cc09581f","","x-ray","1.54184","CuKα","","0.037","0.0295","","","0.0659","0.0697","","","","","","1.061","","","","has coordinates","175871","2020-10-21","18:00:00",""
"7118331","8.6216","0.0013","9.7362","0.0015","13.104","0.002","91.924","0.002","104.975","0.002","108.523","0.002","999.5","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H23 N O7 -","- C21 H23 N O7 -","- C42 H46 N2 O14 -","2","1","","Gao, Qian; Hao, Wen-Juan; Liu, Feng; Tu, Shu-Jiang; Wang, Shu-Liang; Li, Guigen; Jiang, Bo","Unexpected isocyanide-based three-component bicyclization for the stereoselective synthesis of densely functionalized pyrano[3,4-c]pyrroles.","Chemical communications (Cambridge, England)","2016","52","5","900","903","10.1039/c5cc08071a","","","0.71073","MoKα","","0.0602","0.0468","","","0.121","0.1311","","","","","","1.03","","","","has coordinates","173526","2020-10-21","18:00:00",""
"7118332","12.0045","0.0011","10.8025","0.0009","11.0878","0.001","90","","90","","90","","1437.9","0.2","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C16 H12 N6 S -","- C16 H12 N6 S -","- C64 H48 N24 S4 -","4","0.5","","Wang, Ying; Yi, Jin-Min; Zhang, Meng-Yuan; Xu, Ping; Zhao, Xiao-Jun","I2-induced SC-SC transformation within two-dimensional Zn(ii)-triazole framework: an ideal detector of cyano-containing molecules.","Chemical communications (Cambridge, England)","2016","52","15","3099","3102","10.1039/c5cc09279e","","","0.71073","MoKα","","0.0455","0.0395","","","0.1027","0.108","","","","","","1.045","","","","has coordinates","177658","2020-10-21","18:00:00",""
"7118333","9.0152","0.0005","12.4589","0.0006","13.9479","0.0007","105.422","0.001","91.756","0.001","94.9","0.001","1502.37","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C28.5 H30 N7.5 O6.5 S Zn -","- C28.5 H26 N7.5 O6.5 S Zn -","- C57 H52 N15 O13 S2 Zn2 -","2","1","","Wang, Ying; Yi, Jin-Min; Zhang, Meng-Yuan; Xu, Ping; Zhao, Xiao-Jun","I2-induced SC-SC transformation within two-dimensional Zn(ii)-triazole framework: an ideal detector of cyano-containing molecules.","Chemical communications (Cambridge, England)","2016","52","15","3099","3102","10.1039/c5cc09279e","","","0.71073","MoKα","","0.0464","0.0399","","","0.1013","0.1054","","","","","","1.047","","","","has coordinates,has disorder","177658","2020-10-21","18:00:00",""
"7118334","8.94","0.002","15.624","0.004","18.684","0.006","65.286","0.003","84.924","0.005","74.295","0.004","2281.3","1.1","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H33 I N12 O7.5 S2 Zn2 -","- C44 H32 I N12 O7.5 S2 Zn2 -","- C88 H64 I2 N24 O15 S4 Zn4 -","2","1","","Wang, Ying; Yi, Jin-Min; Zhang, Meng-Yuan; Xu, Ping; Zhao, Xiao-Jun","I2-induced SC-SC transformation within two-dimensional Zn(ii)-triazole framework: an ideal detector of cyano-containing molecules.","Chemical communications (Cambridge, England)","2016","52","15","3099","3102","10.1039/c5cc09279e","","","0.71073","MoKα","","0.1184","0.1091","","","0.4248","0.4389","","","","","","1.081","","","","has coordinates","177658","2020-10-21","18:00:00",""
"7118335","17.8685","0.0002","23.0557","0.0002","18.5326","0.0002","90","","90","","90","","7634.89","0.14","173","2","173","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","7?AcOH","","- C70 H68 N4 O7 Zn2 -","- C70 H68 N4 O7 Zn2 -","- C280 H272 N16 O28 Zn8 -","4","0.5","","He, Shixiong; Wang, Fuli; Tong, Wah-Leung; Yiu, Shek-Man; Chan, Michael C. W.","Topologically diverse shape-persistent bis-(Zn-salphen) catalysts: efficient cyclic carbonate formation under mild conditions.","Chemical communications (Cambridge, England)","2016","52","5","1017","1020","10.1039/c5cc08794e","","","1.54178","CuKα","","0.0678","0.0537","","","0.1558","0.1671","","","","","","1.043","","","","has coordinates,has disorder","173528","2020-10-21","18:00:00",""
"7118336","13.163","0.0009","9.4788","0.0007","25.5497","0.0018","90","","96.7832","0.001","90","","3165.5","0.4","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H36 N2 O S -","- C39 H36 N2 O S -","- C156 H144 N8 O4 S4 -","4","1","","Ikezawa, Takahiro; Mutoh, Katsuya; Kobayashi, Yoichi; Abe, Jiro","Thiophene-substituted phenoxyl-imidazolyl radical complexes with high photosensitivity.","Chemical communications (Cambridge, England)","2016","52","12","2465","2468","10.1039/c5cc10133f","","","0.71073","MoKα","","0.0556","0.0388","","","0.0894","0.0977","","","","","","1.018","","","","has coordinates","175872","2020-10-21","18:00:00",""
"7118337","11.58","0.006","14.496","0.008","18.428","0.01","67.834","0.007","89.295","0.008","70.014","0.008","2668","2","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H32 N2 O S -","- C33 H32 N2 O S -","- C132 H128 N8 O4 S4 -","4","2","","Ikezawa, Takahiro; Mutoh, Katsuya; Kobayashi, Yoichi; Abe, Jiro","Thiophene-substituted phenoxyl-imidazolyl radical complexes with high photosensitivity.","Chemical communications (Cambridge, England)","2016","52","12","2465","2468","10.1039/c5cc10133f","","","0.71073","MoKα","","0.1298","0.0873","","","0.227","0.2555","","","","","","1.011","","","","has coordinates","175872","2020-10-21","18:00:00",""
"7118338","12.934","0.0008","9.3801","0.0005","26.147","0.0015","90","","97.1867","0.0008","90","","3147.3","0.3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H36 N2 O S -","- C39 H36 N2 O S -","- C156 H144 N8 O4 S4 -","4","1","","Ikezawa, Takahiro; Mutoh, Katsuya; Kobayashi, Yoichi; Abe, Jiro","Thiophene-substituted phenoxyl-imidazolyl radical complexes with high photosensitivity.","Chemical communications (Cambridge, England)","2016","52","12","2465","2468","10.1039/c5cc10133f","","","0.71073","MoKα","","0.0465","0.0361","","","0.0809","0.0862","","","","","","0.962","","","","has coordinates","175872","2020-10-21","18:00:00",""
"7118340","10.6073","0.0004","9.8229","0.0004","14.4413","0.0006","90","","107.283","0.002","90","","1436.76","0.1","296","2","296","2","","","","","","","Synthezied","5","P 1 21 1","P 2yb","4","spirooxindole dihydropyranone","tert-butyl (S)-(2-(1-benzyl-5-bromo-4'-methyl-2,6'-dioxo-3',6'-dihydrospiro[indoline-3,2'-pyran]-5'-yl)phenyl)carbamate","","- C31 H29 Br N2 O5 -","- C31 H29 Br N2 O5 -","- C62 H58 Br2 N4 O10 -","2","1","","Han, Jeng-Liang; Chang, Chia-Hao","An asymmetric assembly of spirooxindole dihydropyranones through a direct enantioselective organocatalytic vinylogous aldol-cyclization cascade reaction of 3-alkylidene oxindoles with isatins.","Chemical communications (Cambridge, England)","2016","52","11","2322","2325","10.1039/c5cc08883f","","","0.71073","MoKα","","0.049","0.0358","","","0.0903","0.0956","","","","","","1.049","","","","has coordinates","175889","2020-10-21","18:00:00",""
"7118341","5.6982","0.0003","18.9135","0.001","13.0889","0.0007","90","","95.097","0.005","90","","1405.05","0.13","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C16 H22 O -","- C16 H22 O -","- C64 H88 O4 -","4","2","","Pan, Jin-Long; Chen, Tao; Zhang, Zhi-Qiang; Li, Yi-Fan; Zhang, Xiao-Ming; Zhang, Fu-Min","A Cu-mediated one-pot Michael addition/α-arylation strategy using a diaryliodonium salt: a direct and efficient approach to α-aryl-β-substituted cyclic ketone scaffolds.","Chemical communications (Cambridge, England)","2016","52","11","2382","2385","10.1039/c5cc09837h","","","1.54184","CuKα","","0.0608","0.0529","","","0.1454","0.1596","","","","","","1.038","","","","has coordinates","276353","2022-06-28","16:43:03",""
"7118342","11.473","0.004","13.299","0.005","13.766","0.005","85.201","0.005","86.909","0.005","86.437","0.005","2086.5","1.3","296.15","","296.15","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H58 N2 O4.5 P Si -","- C42 H58 N2 O4.5 P Si -","- C84 H116 N4 O9 P2 Si2 -","2","1","","Lin, Chao-Yang; Ma, Peng-Ju; Sun, Zhao; Lu, Chong-Dao; Xu, Yan-Jun","Carbamoyl anion-initiated cascade reaction for stereoselective synthesis of substituted α-hydroxy-β-amino amides.","Chemical communications (Cambridge, England)","2016","52","5","912","915","10.1039/c5cc08118a","","","0.71073","MoKα","","0.1755","0.075","","","0.1911","0.2528","","","","","","0.911","","","","has coordinates","173533","2020-10-21","18:00:00",""
"7118343","9.891","0.013","16.14","0.02","16.21","0.02","90","","90","","90","","2588","6","296","2","296.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 Br N2 O3 S -","- C24 H31 Br N2 O3 S -","- C96 H124 Br4 N8 O12 S4 -","4","1","","Lin, Chao-Yang; Ma, Peng-Ju; Sun, Zhao; Lu, Chong-Dao; Xu, Yan-Jun","Carbamoyl anion-initiated cascade reaction for stereoselective synthesis of substituted α-hydroxy-β-amino amides.","Chemical communications (Cambridge, England)","2016","52","5","912","915","10.1039/c5cc08118a","","","0.71073","MoKα","","0.186","0.0672","","","0.1683","0.226","","","","","","0.906","","","","has coordinates","173533","2020-10-21","18:00:00",""
"7118344","23.1209","0.0012","23.1209","0.0012","27.281","0.002","90","","90","","120","","12629.9","1.3","100","2","99.99","","","","","","","","","7","R -3","-R 3","148","","","","- C184 H162 Co6 Mn6 N24 O32 S8 -","- C168 H120 Co6 Mn6 N24 O24 -","- C504 H360 Co18 Mn18 N72 O72 -","3","","","Jeon, Ie-Rang; David Harris, T.","An S = 12 semiquinoid radical-bridged Mn6 wheel complex assembled from an asymmetric redox-active bridging ligand.","Chemical communications (Cambridge, England)","2016","52","5","1006","1008","10.1039/c5cc08482b","","","1.54178","CuKα","","0.1767","0.0905","","","0.2452","0.2923","","","","","","0.843","","","","has coordinates,has disorder","173534","2020-10-21","18:00:00",""
"7118345","11.3578","0.0019","9.9307","0.0013","22.539","0.005","90","","102.838","0.013","90","","2478.6","0.8","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","PKM-VAN-1","","- C29 H33 N2 P -","- C29 H33 N2 P -","- C116 H132 N8 P4 -","4","1","","Majhi, Paresh Kumar; Chow, Keith C. F.; Hsieh, Tom H. H.; Bowes, Eric G.; Schnakenburg, Gregor; Kennepohl, Pierre; Streubel, Rainer; Gates, Derek P.","Even the normal is abnormal: N-heterocyclic carbene C(2) binding to a phosphaalkene without breaking the P[double bond, length as m-dash]C π-bond.","Chemical communications (Cambridge, England)","2016","52","5","998","1001","10.1039/c5cc08181e","","","0.71073","MoKα","","0.0909","0.0462","","","0.1023","0.1218","","","","","","1.006","","","","has coordinates","173535","2020-10-21","18:00:00",""
"7118346","25.984","0.002","9.734","0.001","21.55","0.002","90","","108.32","0.01","90","","5174.3","0.9","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H72 B2 N4 O P2 -","- C58 H72 B2 N4 O P2 -","- C232 H288 B8 N16 O4 P8 -","4","0.5","","Majhi, Paresh Kumar; Chow, Keith C. F.; Hsieh, Tom H. H.; Bowes, Eric G.; Schnakenburg, Gregor; Kennepohl, Pierre; Streubel, Rainer; Gates, Derek P.","Even the normal is abnormal: N-heterocyclic carbene C(2) binding to a phosphaalkene without breaking the P[double bond, length as m-dash]C π-bond.","Chemical communications (Cambridge, England)","2016","52","5","998","1001","10.1039/c5cc08181e","","","0.71073","MoKα","","0.2228","0.0776","","","0.1453","0.1936","","","","","","0.754","","","","has coordinates,has disorder","173535","2020-10-21","18:00:00",""
"7118347","9.223","0.0001","7.1694","0.0001","13.3259","0.0001","90","","92.731","0.001","90","","880.153","0.017","100","2","100","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","dimethyl (3S,5S)-3-(2,6-dimethoxyphenyl)-5-methylpyrrolidine- 2,2-dicarboxylate","","- C17 H23 N O6 -","- C17 H23 N O6 -","- C34 H46 N2 O12 -","2","1","","Riaño, Iker; Díaz, Estibaliz; Uria, Uxue; Reyes, Efraím; Carrillo, Luisa; Vicario, Jose L.","Organocatalytic enantio- and diastereoselective synthesis of 3,5-disubstituted prolines.","Chemical communications (Cambridge, England)","2016","52","11","2330","2333","10.1039/c5cc09329e","","x-ray","1.54184","CuKα","","0.0297","0.0293","","","0.0769","0.0775","","","","","","1.033","","","","has coordinates","175891","2020-10-21","18:00:00",""
"7118348","27.0902","0.0013","27.0902","0.0013","30.1891","0.0016","90","","90","","120","","19186.9","1.7","200","2","200","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- C38 H70 Na3 O32 S3 -","- C38 H29 Na2.33333 O20 S3 -","- C456 H348 Na28 O240 S36 -","12","1","","Garnett, Graham A. E.; Daze, Kevin D.; Peña Diaz, Jorge A; Fagen, Noah; Shaurya, Alok; Ma, Manuel C. F.; Collins, Mary S.; Johnson, Darren W.; Zakharov, Lev N.; Hof, Fraser","Attraction by repulsion: compounds with like charges undergo self-assembly in water that improves in high salt and persists in real biological fluids.","Chemical communications (Cambridge, England)","2016","52","13","2768","2771","10.1039/c5cc10527g","","","1.54178","CuKα","","0.0989","0.0794","","","0.2433","0.267","","","","","","1.11","","","","has coordinates","177642","2020-10-21","18:00:00",""
"7118349","12.959","0.0002","7.94026","0.00011","14.0403","0.0002","90","","116.595","0.002","90","","1291.86","0.04","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(R)-5,7-dimethoxy-2,2,4-trimethyl-4-(1-tosyl-1H-indol-3-yl)-1,2,3,4-tetrahydroquinoline","","- C29 H32 N2 O4 S -","- C29 H32 N2 O4 S -","- C58 H64 N4 O8 S2 -","2","1","","Li, Guangxun; Liu, Hongxin; Wang, Yingwei; Zhang, Shiqi; Lai, Shujun; Tang, Ling; Zhao, Jinzhong; Tang, Zhuo","The catalytic enantioselective synthesis of tetrahydroquinolines containing all-carbon quaternary stereocenters via the formation of aza-ortho-xylylene with 1,2-dihydroquinoline as a precursor.","Chemical communications (Cambridge, England)","2016","52","11","2304","2306","10.1039/c5cc07752d","","","1.54184","CuKα","","0.0311","0.0309","","","0.0799","0.0802","","","","","","1.03","","","","has coordinates","175892","2020-10-21","18:00:00",""
"7118350","14.4012","0.0006","10.1201","0.0005","15.5792","0.0007","90","","97.623","0.004","90","","2250.47","0.18","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H23 Br N2 O5 -","- C23 H21 Br N2 O5 -","- C92 H84 Br4 N8 O20 -","4","1","","Zhang, Ya-Jun; Chen, Cheng; Tan, Bin; Cai, Li-Xuan; Yang, Xiao-Dong; Zhang, Jie","A dual-stimuli responsive small molecule organic material with tunable multi-state response showing turn-on luminescence and photocoloration.","Chemical communications (Cambridge, England)","2016","52","13","2835","2838","10.1039/c5cc09799a","","","1.54178","CuKα","","0.0569","0.045","","","0.1247","0.1375","","","","","","1.05","","","","has coordinates","177629","2020-10-21","18:00:00",""
"7118351","27.25","0.05","13.662","0.016","17.3","0.02","90","","110.04","0.018","90","","6051","15","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H58 Br2 N4 O16 -","- C46 H42 Br2 N4 O16 -","- C184 H168 Br8 N16 O64 -","4","0.5","","Zhang, Ya-Jun; Chen, Cheng; Tan, Bin; Cai, Li-Xuan; Yang, Xiao-Dong; Zhang, Jie","A dual-stimuli responsive small molecule organic material with tunable multi-state response showing turn-on luminescence and photocoloration.","Chemical communications (Cambridge, England)","2016","52","13","2835","2838","10.1039/c5cc09799a","","","0.71073","MoKα","","0.2125","0.1069","","","0.3012","0.3734","","","","","","0.929","","","","has coordinates","177629","2020-10-21","18:00:00",""
"7118352","6.821","0.0006","17.801","0.002","19.7701","0.0018","90","","98.215","0.008","90","","2375.9","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 F6 N2 O4 P -","- C23 H21 F6 N2 O4 P -","- C92 H84 F24 N8 O16 P4 -","4","1","","Zhang, Ya-Jun; Chen, Cheng; Tan, Bin; Cai, Li-Xuan; Yang, Xiao-Dong; Zhang, Jie","A dual-stimuli responsive small molecule organic material with tunable multi-state response showing turn-on luminescence and photocoloration.","Chemical communications (Cambridge, England)","2016","52","13","2835","2838","10.1039/c5cc09799a","","","1.54178","CuKα","","0.117","0.0822","","","0.1623","0.1893","","","","","","1.092","","","","has coordinates,has disorder","177629","2020-10-21","18:00:00",""
"7118353","11.3148","0.001","7.1192","0.0005","21.3182","0.0015","90","","93.83","0.008","90","","1713.4","0.2","293.18","0.1","293.18","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Br N2 O2 -","- C20 H18 Br N2 O2 -","- C80 H72 Br4 N8 O8 -","4","1","","Xu, Guo-Qiang; Li, Chen-Guang; Liu, Ming-Qian; Cao, Jian; Luo, Yong-Chun; Xu, Peng-Fei","Dual C-H functionalization of N-aryl tetrahydroisoquinolines: a highly diastereoselective synthesis of dibenzo[a,f]quinolizines via visible-light induced oxidation and inverse electron-demand aza-Diels-Alder reaction.","Chemical communications (Cambridge, England)","2016","52","6","1190","1193","10.1039/c5cc08833j","","x-ray","0.71073","MoKα","","0.2026","0.0716","","","0.1149","0.1642","","","","","","1.003","","","","has coordinates","173620","2020-10-21","18:00:00",""
"7118354","15.9684","0.0005","15.9684","0.0005","33.649","0.004","90","","90","","120","","7430.6","0.9","293","2","293","2","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","UTSA-67","","- C20 H12 N O5.5 Zn -","- C20 H12 N O5.5 Zn -","- C240 H144 N12 O66 Zn12 -","12","1","","Wen, Hui-Min; Li, Bin; Wang, Hailong; Krishna, Rajamani; Chen, Banglin","High acetylene/ethylene separation in a microporous zinc(ii) metal-organic framework with low binding energy.","Chemical communications (Cambridge, England)","2016","52","6","1166","1169","10.1039/c5cc08210b","","","0.71073","MoKα","","0.1616","0.1139","","","0.2978","0.3341","","","","","","1.07","","","","has coordinates,has disorder","173621","2020-10-21","18:00:00",""
"7118355","16.8444","0.001","16.8444","0.001","12.6713","0.0008","90","","90","","120","","3113.6","0.3","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C69 H87 Fe3 N6 S3 -","- C63 H81 Fe3 N6 S3 -","- C126 H162 Fe6 N12 S6 -","2","0.166667","","Lee, Yousoon; Jeon, Ie-Rang; Abboud, Khalil A.; García-Serres, Ricardo; Shearer, Jason; Murray, Leslie J.","A [3Fe-3S](3+) cluster with exclusively μ-sulfide donors.","Chemical communications (Cambridge, England)","2016","52","6","1174","1177","10.1039/c5cc07813j","","","0.71073","MoKα","","0.0591","0.0444","","","0.1218","0.1284","","","","","","1.041","","","","has coordinates","173622","2020-10-21","18:00:00",""
"7118356","12.6261","0.0005","12.6261","0.0005","29.234","0.003","90","","90","","90","","4660.4","0.5","173","2","173","2","","","","","","","","5","P 42/m c m","-P 4c 2c","132","","InOF-14","","- C4.5 H1.5 Eu0.25 In0.25 O4 -","- C4.5 H1.5 Eu0.25 In0.25 O4 -","- C72 H24 Eu4 In4 O64 -","16","1","","Qian, Jinjie; Li, Qipeng; Liang, Linfeng; Yang, Yan; Cao, Zhen; Yu, Panpan; Huang, Shaoming; Hong, Maochun","A photoluminescent indium-organic framework with discrete cages and one-dimensional channels for gas adsorption.","Chemical communications (Cambridge, England)","2016","52","58","9032","9035","10.1039/c5cc10359b","","","1.54184","CuKα","","0.0827","0.0704","","","0.2129","0.2242","","","","","","1.088","","","","has coordinates","185100","2020-10-21","18:00:00",""
"7118357","7.6294","0.0005","12.6995","0.0008","25.8239","0.0017","90","","90","","90","","2502.1","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","rl048-krypto1","","- C14 H7 F5 N2 -","- C14 H7 F5 N2 -","- C112 H56 F40 N16 -","8","2","","Laubenstein, R.; Şerb, M-D; Englert, U.; Raabe, G.; Braun, T.; Braun, B.","Is it all in the hinge? A kryptoracemate and three of its alternative racemic polymorphs of an aminonitrile.","Chemical communications (Cambridge, England)","2016","52","6","1214","1217","10.1039/c5cc08992a","","","1.54178","CuKα","","0.0272","0.0256","","","0.0669","0.0684","","","","","","1.031","","","","has coordinates","173624","2020-10-21","18:00:00",""
"7118358","7.6779","0.0002","23.7528","0.0006","13.8443","0.0003","90","","90.3699","0.0009","90","","2524.75","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H7 F5 N2 -","- C14 H7 F5 N2 -","- C112 H56 F40 N16 -","8","2","","Laubenstein, R.; Şerb, M-D; Englert, U.; Raabe, G.; Braun, T.; Braun, B.","Is it all in the hinge? A kryptoracemate and three of its alternative racemic polymorphs of an aminonitrile.","Chemical communications (Cambridge, England)","2016","52","6","1214","1217","10.1039/c5cc08992a","","","1.54178","CuKα","","0.075","0.0697","","","0.1686","0.174","","","","","","1.093","","","","has coordinates","173624","2020-10-21","18:00:00",""
"7118359","25.3241","0.0016","6.535","0.0005","29.874","0.002","90","","90","","90","","4943.9","0.6","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C14 H7 F5 N2 -","- C14 H7 F5 N2 -","- C224 H112 F80 N32 -","16","4","","Laubenstein, R.; Şerb, M-D; Englert, U.; Raabe, G.; Braun, T.; Braun, B.","Is it all in the hinge? A kryptoracemate and three of its alternative racemic polymorphs of an aminonitrile.","Chemical communications (Cambridge, England)","2016","52","6","1214","1217","10.1039/c5cc08992a","","","1.54178","CuKα","","0.1362","0.0607","","","0.109","0.1381","","","","","","1.014","","","","has coordinates","173624","2020-10-21","18:00:00",""
"7118360","13.9748","0.001","7.4518","0.0005","11.8994","0.0008","90","","104.487","0.002","90","","1199.77","0.14","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H7 F5 N2 -","- C14 H7 F5 N2 -","- C56 H28 F20 N8 -","4","1","","Laubenstein, R.; Şerb, M-D; Englert, U.; Raabe, G.; Braun, T.; Braun, B.","Is it all in the hinge? A kryptoracemate and three of its alternative racemic polymorphs of an aminonitrile.","Chemical communications (Cambridge, England)","2016","52","6","1214","1217","10.1039/c5cc08992a","","","0.71073","MoKα","","0.0468","0.034","","","0.079","0.0854","","","","","","1.007","","","","has coordinates","173624","2020-10-21","18:00:00",""
"7118361","16.295","0.013","14.157","0.018","18.637","0.017","90","","104.42","0.02","90","","4164","7","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H19 O3 P -","- C26 H19 O3 P -","- C208 H152 O24 P8 -","8","1","","Fukazawa, Aiko; Suda, Shinji; Taki, Masayasu; Yamaguchi, Eriko; Grzybowski, Marek; Sato, Yoshikatsu; Higashiyama, Tetsuya; Yamaguchi, Shigehiro","Phospha-fluorescein: a red-emissive fluorescein analogue with high photobleaching resistance.","Chemical communications (Cambridge, England)","2016","52","6","1120","1123","10.1039/c5cc09345g","","","0.71075","MoKα","","0.0458","0.0402","","","0.105","0.1095","","","","","","1.063","","","","has coordinates,has disorder","173625","2020-10-21","18:00:00",""
"7118362","9.1964","0.001","11.7747","0.0012","9.7412","0.001","90","","98.134","0.005","90","","1044.21","0.19","293","2","293.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","acetamide","2,2-dichloro-N-(3-chloro-4-fluorophenyl)acetamide","","- C8 H5 Cl3 F N O -","- C8 H5 Cl3 F N O -","- C32 H20 Cl12 F4 N4 O4 -","4","1","","Ghosh, Monisankar; Saha, Suchandrima; Dutta, Samir Kumar","'Dual hit' metabolic modulator LDCA selectively kills cancer cells by efficient competitive inhibition of LDH-A.","Chemical communications (Cambridge, England)","2016","52","11","2401","2404","10.1039/c5cc09903j","","x-ray","0.71073","MoKα","","0.0596","0.0453","","","0.1191","0.134","","","","","","1.038","","","","has coordinates","175888","2020-10-21","18:00:00",""
"7118363","9.937","0.004","17.673","0.007","10.223","0.004","90","","90","","90","","1795.3","1.2","123","2","123","2","","","","","","","","2","C 2 2 21","C 2c 2","20","","","","- C26 H22 -","- C26 H22 -","- C104 H88 -","4","0.5","","Iwahara, Hideaki; Kushida, Tomokatsu; Yamaguchi, Shigehiro","A planarized 9-phenylanthracene: a simple electron-donating building block for fluorescent materials.","Chemical communications (Cambridge, England)","2016","52","6","1124","1127","10.1039/c5cc08259e","","","0.71075","MoKa","","0.0416","0.0392","","","0.1034","0.1054","","","","","","1.107","","","","has coordinates","173627","2020-10-21","18:00:00",""
"7118364","6.247","0.006","10.259","0.011","10.779","0.011","84.94","0.04","76.39","0.04","77.39","0.04","654.7","1.2","123","2","123","2","","","","","","","","2","P -1","-P 1","2","","","","- C20 H14 -","- C20 H14 -","- C40 H28 -","2","1","","Iwahara, Hideaki; Kushida, Tomokatsu; Yamaguchi, Shigehiro","A planarized 9-phenylanthracene: a simple electron-donating building block for fluorescent materials.","Chemical communications (Cambridge, England)","2016","52","6","1124","1127","10.1039/c5cc08259e","","","0.71075","MoKa","","0.1514","0.1195","","","0.2763","0.2975","","","","","","0.962","","","","has coordinates","173627","2020-10-21","18:00:00",""
"7118365","25.299","0.0012","25.299","0.0012","166.828","0.003","90","","90","","120","","92471","6","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C186 H102 N8 O71 S3 Zn20 -","- C186 H102 N8 O71 S3 Zn20 -","- C1116 H612 N48 O426 S18 Zn120 -","6","0.333333","","Xie, Wei; He, Wen-Wen; Du, Dong-Ying; Li, Shun-Li; Qin, Jun-Sheng; Su, Zhong-Min; Sun, Chun-Yi; Lan, Ya-Qian","A stable Alq3@MOF composite for white-light emission.","Chemical communications (Cambridge, England)","2016","52","16","3288","3291","10.1039/c5cc08703a","","","0.71073","MoKα","","0.1591","0.0726","","","0.1917","0.2151","","","","","","1.029","","","","has coordinates,has disorder","177672","2020-10-21","18:00:00",""
"7118366","7.6832","0.0006","9.6923","0.0007","10.0668","0.0009","89.063","0.006","82.389","0.007","80.144","0.007","732.07","0.1","291","2","291.15","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 N3 O5 P -","- C12 H16 N3 O5 P -","- C24 H32 N6 O10 P2 -","2","1","","Gao, Ming; Li, Yi; Xie, Lijuan; Chauvin, Remi; Cui, Xiuling","Direct phosphonation of quinoxalin-2(1H)-ones under transition-metal-free conditions.","Chemical communications (Cambridge, England)","2016","52","13","2846","2849","10.1039/c5cc08049e","","","1.54184","CuKα","","0.0572","0.0441","","","0.1111","0.1212","","","","","","1.044","","","","has coordinates","177640","2020-10-21","18:00:00",""
"7118367","10.5246","0.0007","7.1824","0.0005","33.424","0.002","90","","94.7154","0.001","90","","2518","0.3","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 2-((3R*,4S*)-3-(1-((tert-butyldimethylsilyl)oxy)cyclohexyl)-2-oxochroman-4-yl)acetate","","- C25 H38 O5 Si -","- C25 H38 O5 Si -","- C100 H152 O20 Si4 -","4","1","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0461","0.0379","","","0.0935","0.0994","","","","","","1.032","","","","has coordinates,has disorder","177674","2020-10-21","18:00:00",""
"7118368","7.1552","0.0008","17.356","0.002","14.5825","0.0017","90","","95.177","0.002","90","","1803.5","0.4","90","","90","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-((3S*,4S*)-6-bromo-2-oxo-3-((S*)-3-oxocycloheptyl)chroman-4-yl)acetate","","- C20 H23 Br O5 -","- C20 H23 Br O5 -","- C80 H92 Br4 O20 -","4","1","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0364","0.0294","","","0.0718","0.0742","","","","","","1.044","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118369","34.732","0.004","13.1317","0.0014","8.2791","0.0009","90","","90","","90","","3776","0.7","90","","90","","","","","","","","","3","P c a 21","P 2c -2ac","29","","Ethyl 2-((2S*,3'R*,4'S*)-2',4-dioxo-[2,3'-bichroman]-4'-yl)acetate","","- C22 H20 O6 -","- C22 H20 O6 -","- C176 H160 O48 -","8","2","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0394","0.033","","","0.0722","0.0754","","","","","","1.003","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118370","12.6704","0.0012","9.7676","0.0009","16.2166","0.0016","90","","97.059","0.001","90","","1991.7","0.3","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 2-((2R*,3R*,3'R*,4'S*)-3-bromo-3-methyl-2',4-dioxo-[2,3'-bichroman]-4'-yl)acetate","","- C23 H21 Br O6 -","- C23 H21 Br O6 -","- C92 H84 Br4 O24 -","4","1","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0411","0.0292","","","0.0594","0.0633","","","","","","1.014","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118371","25.583","0.003","6.8787","0.0008","17.4038","0.0019","90","","90","","90","","3062.7","0.6","90","","90","","","","","","","","","3","P c a 21","P 2c -2ac","29","","Ethyl 2-((3S*,4S*)-2-oxo-3-((R*)-3-oxocyclopentyl)chroman-4-yl)acetate","","- C18 H20 O5 -","- C18 H20 O5 -","- C144 H160 O40 -","8","2","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0371","0.0329","","","0.0773","0.08","","","","","","1.043","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118372","11.3068","0.0019","9.6829","0.0016","24.116","0.004","90","","103.091","0.002","90","","2571.7","0.7","90","","90","","","","","","","","","4","P 1 c 1","P -2yc","7","","Ethyl 2-((3S*,4S*)-6-bromo-2-oxo-3-((R*)-3-oxocyclopentyl)chroman-4-yl)acetate","","- C18 H19 Br O5 -","- C18 H19 Br O5 -","- C108 H114 Br6 O30 -","6","3","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.036","0.029","","","0.0568","0.0589","","","","","","0.963","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118373","15.1059","0.0012","7.0831","0.0006","16.4912","0.0013","90","","114.08","0.001","90","","1610.9","0.2","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-((3S*,4S*)-2-oxo-3-((R*)-3-oxocyclohexyl)chroman-4-yl)acetate","","- C19 H22 O5 -","- C19 H22 O5 -","- C76 H88 O20 -","4","1","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0384","0.0334","","","0.0838","0.0872","","","","","","1.023","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118374","8.854","0.003","14.268","0.004","14.396","0.004","94.289","0.004","102.73","0.004","95.207","0.004","1758.2","0.9","90","","90","","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-((3S*,4S*)-6-bromo-2-oxo-3-((R*)-3-oxocyclohexyl)chroman-4-yl)acetate","","- C19 H21 Br O5 -","- C19 H21 Br O5 -","- C76 H84 Br4 O20 -","4","2","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0882","0.0741","","","0.1936","0.1991","","","","","","1.183","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118375","12.0177","0.0012","6.6196","0.0006","23.898","0.002","90","","93.302","0.001","90","","1898","0.3","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 2-((3S*,4S*)-6-bromo-2-oxo-3-((R*)-3-oxocycloheptyl)chroman-4-yl)acetate","","- C20 H23 Br O5 -","- C20 H23 Br O5 -","- C80 H92 Br4 O20 -","4","1","","Yanai, Hikaru; Kobayashi, Osamu; Takada, Kenji; Isono, Takuya; Satoh, Toshifumi; Matsumoto, Takashi","Sequential Mukaiyama-Michael reaction induced by carbon acids.","Chemical communications (Cambridge, England)","2016","52","16","3280","3283","10.1039/c5cc10115h","","","0.71073","MoKα","","0.0263","0.0225","","","0.0547","0.0561","","","","","","1.06","","","","has coordinates","177674","2020-10-21","18:00:00",""
"7118376","13.7379","0.0004","8.3487","0.0003","13.0277","0.0004","90","","106.235","0.002","90","","1434.61","0.08","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(ethylenediamine)Zincsulfite","","- C2 H10 N2 O12 S4 Zn3 -","- C2 H10 N2 O12 S4 Zn3 -","- C8 H40 N8 O48 S16 Zn12 -","4","0.5","","Tiwari, Ranjay K.; Kumar, Jitendra; Behera, J. N.","The first organically templated open-framework metal-sulfites with layered and three-dimensional diamondoid structures.","Chemical communications (Cambridge, England)","2016","52","6","1282","1285","10.1039/c5cc07874a","","","0.71073","MoKα","","0.0253","0.0225","","","0.0564","0.0576","","","","","","1.095","","","","has coordinates","173631","2020-10-21","18:00:00",""
"7118377","14.4211","0.0013","12.1181","0.0008","14.0692","0.0008","90","","90","","90","","2458.7","0.3","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","(Guanidinium)zincsulfite","","- C2 H12 N6 O6 S2 Zn -","- C2 H12 N6 O6 S2 Zn -","- C16 H96 N48 O48 S16 Zn8 -","8","0.5","","Tiwari, Ranjay K.; Kumar, Jitendra; Behera, J. N.","The first organically templated open-framework metal-sulfites with layered and three-dimensional diamondoid structures.","Chemical communications (Cambridge, England)","2016","52","6","1282","1285","10.1039/c5cc07874a","","","0.71073","MoKα","","0.0531","0.038","","","0.0669","0.0723","","","","","","1.029","","","","has coordinates","173631","2020-10-21","18:00:00",""
"7118378","18.1909","0.0003","19.1754","0.0004","20.759","0.0004","90","","112.85","0.001","90","","6672.9","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[Cu(DMAP)4I]I","","- C28 H40 Cu I2 N8 -","- C28 H40 Cu I2 N8 -","- C224 H320 Cu8 I16 N64 -","8","2","","Roy, Subhasish; Sarma, Manas Jyoti; Kashyap, Bishwapran; Phukan, Prodeep","A quick Chan-Lam C-N and C-S cross coupling at room temperature in the presence of square pyramidal [Cu(DMAP)4I]I as a catalyst.","Chemical communications (Cambridge, England)","2016","52","6","1170","1173","10.1039/c5cc04619j","","","0.71073","MoKα","","0.1122","0.0452","","","0.1283","0.1778","","","","","","0.979","","","","has coordinates","173632","2020-10-21","18:00:00",""
"7118379","9.1413","0.0002","19.4335","0.0007","28.6894","0.0009","90","","98.911","0.001","90","","5035.1","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 B6 Ir2 -","- C20 H36 B6 Ir2 -","- C160 H288 B48 Ir16 -","8","2","","Borthakur, Rosmita; Mondal, Bijan; Nandi, Purbasha; Ghosh, Sundargopal","Hypoelectronic isomeric diiridaboranes [(Cp*Ir)2B6H6]: the ""Rule-Breakers""(Cp* = η(5)-C5Me5).","Chemical communications (Cambridge, England)","2016","52","15","3199","3202","10.1039/c5cc09606e","","","0.71073","MoKα","","0.0714","0.0437","","","0.0858","0.1002","","","","","","1.163","","","","has coordinates","177648","2020-10-21","18:00:00",""
"7118380","9.1768","0.0002","9.2116","0.0002","16.3496","0.0004","99.379","0.001","101.76","0.001","102.741","0.001","1288.09","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H37 B7 Ir2 -","- C20 H37 B7 Ir2 -","- C40 H74 B14 Ir4 -","2","1","","Borthakur, Rosmita; Mondal, Bijan; Nandi, Purbasha; Ghosh, Sundargopal","Hypoelectronic isomeric diiridaboranes [(Cp*Ir)2B6H6]: the ""Rule-Breakers""(Cp* = η(5)-C5Me5).","Chemical communications (Cambridge, England)","2016","52","15","3199","3202","10.1039/c5cc09606e","","","0.71073","MoKα","","0.0427","0.033","","","0.086","0.0952","","","","","","1.062","","","","has coordinates,has disorder","177648","2020-10-21","18:00:00",""
"7118381","16.4805","0.0014","19.9995","0.0011","16.6991","0.0014","90","","117.242","0.011","90","","4893.5","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H36 B6 Ir2 -","- C20 H36 B6 Ir2 -","- C160 H288 B48 Ir16 -","8","2","","Borthakur, Rosmita; Mondal, Bijan; Nandi, Purbasha; Ghosh, Sundargopal","Hypoelectronic isomeric diiridaboranes [(Cp*Ir)2B6H6]: the ""Rule-Breakers""(Cp* = η(5)-C5Me5).","Chemical communications (Cambridge, England)","2016","52","15","3199","3202","10.1039/c5cc09606e","","","0.71073","MoKα","","0.1212","0.0831","","","0.2211","0.2706","","","","","","1.077","","","","has coordinates","177648","2020-10-21","18:00:00",""
"7118382","8.6783","0.0002","11.3201","0.0002","12.0032","0.0002","111.032","0.001","94.279","0.001","105.86","0.001","1038.96","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H26 N O3 P -","- C23 H26 N O3 P -","- C46 H52 N2 O6 P2 -","2","1","","Wang, Jieping; Siqueira, Gilberto; Müller, Georgina; Rentsch, Daniel; Huch, Anja; Tingaut, Philippe; Levalois-Grützmacher, Joëlle; Grützmacher, Hansjörg","Synthesis of new bis(acyl)phosphane oxide photoinitiators for the surface functionalization of cellulose nanocrystals.","Chemical communications (Cambridge, England)","2016","52","13","2823","2826","10.1039/c5cc09760f","","","0.71073","MoKα","","0.0556","0.0402","","","0.1012","0.1082","","","","","","1.047","","","","has coordinates","177630","2020-10-21","18:00:00",""
"7118383","9.7059","0.0003","15.7541","0.0004","10.525","0.0003","90","","95.513","0.002","90","","1601.91","0.08","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H15 N3 O -","- C20 H15 N3 O -","- C80 H60 N12 O4 -","4","1","","Sadhu, Pradeep; Punniyamurthy, Tharmalingam","Copper(ii)-mediated regioselective N-arylation of pyrroles, indoles, pyrazoles and carbazole via dehydrogenative coupling.","Chemical communications (Cambridge, England)","2016","52","13","2803","2806","10.1039/c5cc08206d","","","0.71073","MoKα","","0.0466","0.0405","","","0.0961","0.1011","","","","","","1.081","","","","has coordinates","177632","2020-10-21","18:00:00",""
"7118384","10.9284","0.0009","18.6077","0.0014","10.9054","0.0008","90","","118.516","0.002","90","","1948.6","0.3","0","2","0","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H17 F N2 O2 -","- C25 H17 F N2 O2 -","- C100 H68 F4 N8 O8 -","4","1","","Rajkumar, Subramani; Antony Savarimuthu, S.; Senthil Kumaran, Rajendran; Nagaraja, C. M.; Gandhi, Thirumanavelan","Expedient synthesis of new cinnoline diones by Ru-catalyzed regioselective unexpected deoxygenation-oxidative annulation of propargyl alcohols with phthalazinones and pyridazinones.","Chemical communications (Cambridge, England)","2016","52","12","2509","2512","10.1039/c5cc09347c","","","0.71073","MoKα","","0.0761","0.0493","","","0.1159","0.1284","","","","","","1.036","","","","has coordinates","175876","2020-10-21","18:00:00",""
"7118385","22.748","0.006","10.773","0.003","15.613","0.004","90","","102.346","0.008","90","","3737.7","1.7","0","2","0","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H15 N3 O4 -","- C23 H15 N3 O4 -","- C184 H120 N24 O32 -","8","2","","Rajkumar, Subramani; Antony Savarimuthu, S.; Senthil Kumaran, Rajendran; Nagaraja, C. M.; Gandhi, Thirumanavelan","Expedient synthesis of new cinnoline diones by Ru-catalyzed regioselective unexpected deoxygenation-oxidative annulation of propargyl alcohols with phthalazinones and pyridazinones.","Chemical communications (Cambridge, England)","2016","52","12","2509","2512","10.1039/c5cc09347c","","","0.71073","MoKα","","0.2069","0.1076","","","0.2679","0.3199","","","","","","1.034","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7118386","23.952","0.005","5.752","0.001","14.804","0.003","90","","100.445","0.004","90","","2005.8","0.7","173","1","173","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H14 O2 S -","- C11 H14 O2 S -","- C88 H112 O16 S8 -","8","2","","Albarghouti, Ghassan; Kotikalapudi, Ramesh; Lankri, David; Valerio, Viviana; Tsvelikhovsky, Dmitry","Cascade Pd(ii)-catalyzed Wacker lactonization-Heck reaction: rapid assembly of spiranoid lactones.","Chemical communications (Cambridge, England)","2016","52","15","3095","3098","10.1039/c5cc09923d","","","0.71073","MoKα","","0.1249","0.0918","","","0.1685","0.1804","","","","","","1.194","","","","has coordinates","177650","2020-10-21","18:00:00",""
"7118387","18.257","0.011","8.475","0.006","28.615","0.013","90","","129.59","0.03","90","","3412","4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H100 N12 Ni2 O24 -","- C53 H68 N12 Ni2 O24 -","- C106 H136 N24 Ni4 O48 -","2","0.5","","Jiang, Xiang; Kou, Hui-Zhong","Solid state reconstructive phase transition from porous supramolecular network to porous coordination polymer.","Chemical communications (Cambridge, England)","2016","52","14","2952","2955","10.1039/c5cc09808d","","","0.71073","MoKα","","0.1552","0.1032","","","0.2938","0.3237","","","","","","1.067","","","","has coordinates,has disorder","177692","2020-10-21","18:00:00",""
"7118388","27.286","0.007","27.286","0.007","8.343","0.003","90","","90","","90","","6212","3","100","2","100","2","","","","","","","","5","I 41/a","-I 4ad","88","","","","- C57 H92 N12 Ni2 O16 -","- C57 H76 N12 Ni2 O8 -","- C228 H304 N48 Ni8 O32 -","4","","","Jiang, Xiang; Kou, Hui-Zhong","Solid state reconstructive phase transition from porous supramolecular network to porous coordination polymer.","Chemical communications (Cambridge, England)","2016","52","14","2952","2955","10.1039/c5cc09808d","","","0.71073","MoKα","","0.2004","0.1094","","","0.2992","0.3443","","","","","","1.009","","","","has coordinates,has disorder","177692","2020-10-21","18:00:00",""
"7118389","7.5787","0.0002","8.0875","0.0002","9.6138","0.0003","72.4479","0.0015","68.0319","0.0015","85.0439","0.0016","520.8","0.03","200","2","200","2","","","","","","","acetonitrile","5","P -1","-P 1","2","","","","- C20 H28 Cu N2 O4 -","- C20 H28 Cu N2 O4 -","- C20 H28 Cu N2 O4 -","1","0.5","","Paquet, C.; Lacelle, T.; Deore, B.; Kell, A. J.; Liu, X.; Korobkov, I.; Malenfant, P. R. L.","Pyridine-copper(ii) formates for the generation of high conductivity copper films at low temperatures.","Chemical communications (Cambridge, England)","2016","52","12","2605","2608","10.1039/c5cc07737k","","","0.71073","MoKα","","0.0259","0.0251","","","0.0717","0.0722","","","","","","1.052","","","","has coordinates","175870","2020-10-21","18:00:00",""
"7118392","12.7488","0.0004","12.7765","0.0004","25.7791","0.001","92.399","0.002","101.831","0.002","104.172","0.002","3966","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- Cs1.5 H130 Na14.5 Ni7 O180 P4 W30 -","- Cs0.5 Na11.6 Ni7 O160 P4 W30 -","- Cs0.5 Na11.6 Ni7 O160 P4 W30 -","1","0.5","","Bassil, Bassem S.; Xiang, Yixian; Haider, Ali; Hurtado, Jaime; Novitchi, Ghenadie; Powell, Annie K.; Bossoh, A. Martin; Mbomekallé, Israël M; de Oliveira, Pedro; Kortz, Ulrich","Heptanickel(ii) double-cubane core in wells-dawson heteropolytungstate, [Ni7(OH)6(H2O)6(P2W15O56)2](16.).","Chemical communications (Cambridge, England)","2016","52","12","2601","2604","10.1039/c5cc09823h","","","0.71073","MoKα","","0.0891","0.0676","","","0.154","0.1678","","","","","","1.002","","","","has coordinates","175865","2020-10-21","18:00:00",""
"7118393","11.3452","0.0004","17.9768","0.0006","10.1595","0.0004","90","","110.197","0.0012","90","","1944.63","0.12","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H17 N O2 S2 -","- C25 H17 N O2 S2 -","- C100 H68 N4 O8 S8 -","4","1","","Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.","The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.","Chemical communications (Cambridge, England)","2016","52","12","2612","2615","10.1039/c5cc09645f","","x-ray","0.71073","MoKα","","0.056","0.0427","","","0.1005","0.1071","","","","","","1.04","","","","has coordinates","175873","2020-10-21","18:00:00",""
"7118394","20.7971","0.0013","11.4101","0.0007","15.4184","0.001","90","","98.56","0.002","90","","3618","0.4","120","","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C41 H32 Cl2 N2 O2 S3 -","- C41 H32 Cl2 N2 O2 S3 -","- C164 H128 Cl8 N8 O8 S12 -","4","0.5","","Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.","The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.","Chemical communications (Cambridge, England)","2016","52","12","2612","2615","10.1039/c5cc09645f","","x-ray","0.71073","MoKα","","0.0546","0.0445","","","0.1259","0.1332","","","","","","1.048","","","","has coordinates,has disorder","175873","2020-10-21","18:00:00",""
"7118395","12.7719","0.001","13.6832","0.001","19.915","0.002","90","","98.962","0.003","90","","3437.9","0.5","120","","120","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C42 H34 N2 O2 S3 -","- C42 H34 N2 O2 S3 -","- C168 H136 N8 O8 S12 -","4","0.5","","Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.","The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.","Chemical communications (Cambridge, England)","2016","52","12","2612","2615","10.1039/c5cc09645f","","x-ray","0.71073","MoKα","","0.0468","0.04","","","0.1081","0.1123","","","","","","1.048","","","","has coordinates","175873","2020-10-21","18:00:00",""
"7118396","11.6805","0.0003","15.8659","0.0004","19.4344","0.0005","90","","98.323","0.0014","90","","3563.68","0.16","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H34 N2 O3 S3 -","- C38 H26 N2 O2 S3 -","- C152 H104 N8 O8 S12 -","4","1","","Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.","The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.","Chemical communications (Cambridge, England)","2016","52","12","2612","2615","10.1039/c5cc09645f","","x-ray","1.54184","CuKα","","0.1347","0.0856","","","0.1901","0.2149","","","","","","1.033","","","","has coordinates,has disorder","175873","2020-10-21","18:00:00",""
"7118397","11.4913","0.0004","18.0722","0.0007","22.1742","0.0011","90","","90","","90","","4605","0.3","103","2","103","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H26 N2 Ni O6 -","- C26 H26 N2 Ni O6 -","- C208 H208 N16 Ni8 O48 -","8","1","","Shao, Haiyan; Muduli, Subas K.; Tran, Phong D.; Soo, Han Sen","Enhancing electrocatalytic hydrogen evolution by nickel salicylaldimine complexes with alkali metal cations in aqueous media.","Chemical communications (Cambridge, England)","2016","52","14","2948","2951","10.1039/c5cc09456a","","","0.71073","MoKα","","0.0947","0.0444","","","0.1095","0.1583","","","","","","1.065","","","","has coordinates","177696","2020-10-21","18:00:00",""
"7118398","9.4723","0.0005","18.6903","0.001","15.7123","0.0009","90","","96.0152","0.0016","90","","2766.4","0.3","103","2","103","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 F6 K N2 Ni O6 P -","- C26 H26 F6 K N2 Ni O6 P -","- C104 H104 F24 K4 N8 Ni4 O24 P4 -","4","1","","Shao, Haiyan; Muduli, Subas K.; Tran, Phong D.; Soo, Han Sen","Enhancing electrocatalytic hydrogen evolution by nickel salicylaldimine complexes with alkali metal cations in aqueous media.","Chemical communications (Cambridge, England)","2016","52","14","2948","2951","10.1039/c5cc09456a","","","0.71073","MoKα","","0.0732","0.0411","","","0.0725","0.0842","","","","","","1.033","","","","has coordinates,has disorder","177696","2020-10-21","18:00:00",""
"7118399","12.8218","0.0009","15.8756","0.0011","38.6736","0.0018","93.295","0.003","93.991","0.003","102.38","0.003","7649.3","0.8","213","","213","","","","","","","","","3","P -1","-P 1","2","","","","- C160 H112 O34 -","- C160 H112 O34 -","- C320 H224 O68 -","2","1","","Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata","Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration","Chem.Commun.","2016","52","","300","","","","","0.8","synchrotron","","0.1592","0.1075","","","0.3173","0.3604","","","","","","1.257","","","","has coordinates","174376","2020-10-21","18:00:00",""
"7118400","14.5203","0.0001","16.0332","0.0001","18.9168","0.0002","103.209","0.0001","94.7721","0.0004","106.869","0.0005","4049.79","0.06","93","","93","","","","","","","","","4","P -1","-P 1","2","","","","- C80 H72 N4 O18 -","- C80 H72 N4 O18 -","- C160 H144 N8 O36 -","2","1","","Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata","Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration","Chem.Commun.","2016","52","","300","","","","","0.8","synchrotron","","0.1103","0.1074","","","0.3815","0.3972","","","","","","1.37","","","","has coordinates,has disorder","174376","2020-10-21","18:00:00",""
"7118401","15.3014","0.0003","20.3447","0.0005","28.1624","0.0006","101.571","0.002","99.3676","0.0017","103.554","0.0008","8144.6","0.3","213","","213","","","","","","","","","4","P -1","-P 1","2","","","","- C166 H126 N2 O36 -","- C166 H126 N2 O36 -","- C332 H252 N4 O72 -","2","1","","Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata","Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration","Chem.Commun.","2016","52","","300","","","","","0.8","synchrotron","","0.1423","0.1161","","","0.3509","0.3746","","","","","","1.431","","","","has coordinates","174376","2020-10-21","18:00:00",""
"7118402","14.5303","0.0005","14.9461","0.0006","20.2579","0.0008","102.355","0.0018","101.544","0.0016","99.0611","0.0017","4117.4","0.3","153","","153","","","","","","","","","3","P -1","-P 1","2","","","","- C68 H44 O14 -","- C68 H44 O14 -","- C136 H88 O28 -","2","1","","Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata","Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration","Chem.Commun.","2016","52","","300","","","","","1.54187","CuKα","","0.1357","0.091","","","0.2889","0.3257","","","","","","0.987","","","","has coordinates","174376","2020-10-21","18:00:00",""
"7118403","15.4431","0.0003","20.9868","0.0004","28.0527","0.0006","103.362","0.0013","98.9655","0.0011","105.805","0.001","8275.7","0.3","273","","273","","","","","","","","","3","P -1","-P 1","2","","","","- C60 H36 O12 -","- C60 H36 O12 -","- C240 H144 O48 -","4","2","","Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata","Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration","Chem.Commun.","2016","52","","300","","","","","0.8","synchrotron","","0.1538","0.1273","","","0.3619","0.389","","","","","","1.489","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118404","19.1278","0.0002","22.403","0.0002","22.3984","0.0002","60.046","0.0006","87.4093","0.0005","81.0545","0.0004","8209.05","0.14","93","","93","","","","","","","","","3","P -1","-P 1","2","","","","- C68 H44 O14 -","- C68 H44 O14 -","- C272 H176 O56 -","4","2","","Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata","Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration","Chem.Commun.","2016","52","","300","","","","","0.8","synchrotron","","0.134","0.1248","","","0.426","0.4451","","","","","","1.687","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118405","7.7787","0.0001","22.469","0.0004","9.7911","0.0002","90","","104.593","0.0014","90","","1656.08","0.05","180","","180","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C33 H39 Cl3 N2 O3 Ru S -","- C33 H39 Cl3 N2 O3 Ru S -","- C66 H78 Cl6 N4 O6 Ru2 S2 -","2","1","","B. Vilhanova; J. Vaclavik; P. Sot; J. Pechacek; J. Zapal; R. Pazout; J. Maixner; M. Kuzmac; P. Kacer","Enantioselective hydrogenation of cyclic imines catalysed by Noyori-Ikariya half-sandwich complexes and their analogues","Chem.Commun.","2016","52","","362","","","","x-ray","1.5418","CuKα","","0.0297","0.0291","","","0.0404","0.0405","","","","2.65","2.65","2.64","","","","has coordinates","174379","2020-10-21","18:00:00",""
"7118406","35.409","0.018","30.501","0.012","31.789","0.013","90","","115.52","0.05","90","","30983","3","85","2","85","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C200 H274 Dy18 N18 O135 Zn12 -","- C200 H260 Dy18 N18 O135 Zn12 -","- C800 H1040 Dy72 N72 O540 Zn48 -","4","0.5","","Nikoleta Stavgianoudaki; Milosz Siczek; Tadeusz Lis; Ross Inglis; Constantinos J. Milios","A triacontanuclear [Zn12Dy18] cluster: a ring of [Dy4] cubes","Chem.Commun.","2016","52","","343","","","","","0.71073","MoKα","","0.1614","0.0784","","","0.1614","0.2209","","","","","","1.218","","","","has coordinates,has disorder","174380","2020-10-21","18:00:00",""
"7118407","16.7246","0.0015","7.1468","0.0007","20.102","0.0019","90","","90","","90","","2402.7","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C16 H13 N -","- C16 H13 N -","- C128 H104 N8 -","8","1","","Kai Chen; Zi-Zhong Zhu; Jia-Xin Liu; Xiang-Ying Tang; Yin Wei; Min Shi","Substrate-controlled Rh(II)-catalyzed single-electron-transfer (SET): divergent synthesis of fused indoles","Chem.Commun.","2016","52","","350","","","","","0.71073","MoKα","","0.0743","0.0457","","","0.1231","0.1409","","","","","","1.049","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118408","9.2535","0.0019","14.994","0.003","10.714","0.002","90","","101.697","0.004","90","","1455.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H17 N O -","- C19 H17 N O -","- C76 H68 N4 O4 -","4","1","","Kai Chen; Zi-Zhong Zhu; Jia-Xin Liu; Xiang-Ying Tang; Yin Wei; Min Shi","Substrate-controlled Rh(II)-catalyzed single-electron-transfer (SET): divergent synthesis of fused indoles","Chem.Commun.","2016","52","","350","","","","","0.71073","MoKα","","0.0798","0.0591","","","0.1604","0.182","","","","","","1.089","","","","has coordinates","174383","2020-10-21","18:00:00",""
"7118409","14.4652","0.0008","17.501","0.001","23.3205","0.0014","90","","91.874","0.002","90","","5900.6","0.6","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H49 N6 O8 Tl -","- C66 H49 N6 O8 Tl -","- C264 H196 N24 O32 Tl4 -","4","1","","Victoria Ndoyom; Luca Fusaro; Thierry Roisnel; Stephane Le Gac; Bernard Boitrel","Spontaneous Tl(I)-to-Tl(III) oxidation in dynamic heterobimetallic Hg(II)/Tl(I) porphyrin complexes","Chem.Commun.","2016","52","","517","","","","x-ray","0.71073","MoKα","","0.0987","0.0515","","","0.1188","0.1304","","","","","","0.983","","","","has coordinates,has disorder","174388","2020-10-21","18:00:00",""
"7118410","31.6051","0.0011","13.3823","0.0005","24.6753","0.0007","90","","90.155","0.003","90","","10436.4","0.6","171.9","","171.9","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C95.5 H129.25 F12 N3.75 O24 P2 -","- C92 H124 F12 N2 O24 P2 -","- C368 H496 F48 N8 O96 P8 -","4","1","","Danyu Xia; Peifa Wei; Bingbing Shi; Feihe Huang","A pillar[6]arene-based [2]pseudorotaxane in solution and in the solid state and its photo-responsive self-assembly behavior in solution","Chem.Commun.","2016","52","","513","","","","","0.71073","MoKα","","0.0683","0.058","","","0.1495","0.161","","","","","","1.027","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7118411","9.7675","0.0009","7.1607","0.0006","15.8901","0.0019","90","","107.9","","90","","1057.59","0.18","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H18 Eu N3 O10 -","- C19 H18 Eu N3 O10 -","- C38 H36 Eu2 N6 O20 -","2","1","","Hai-Yang Li; Hong Xu; Shuang-Quan Zang; Thomas C. W. Mak","A viologen-functionalized chiral Eu-MOF as a platform for multifunctional switchable material","Chem.Commun.","2016","52","","525","","10.1039/C5CC08168H","","","0.71073","MoKα","","0.0489","0.0416","","","0.1043","0.1102","","","","","","1.009","","","","has coordinates","192153","2020-10-21","18:00:00",""
"7118412","11.7454","0.0009","24.4796","0.0019","13.3037","0.001","90","","115.166","0.002","90","","3462","0.5","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H48 F3 Ge N3 O3 S -","- C35 H48 F3 Ge N3 O3 S -","- C140 H192 F12 Ge4 N12 O12 S4 -","4","1","","Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo","Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes","Chem.Commun.","2016","52","","613","","","","","0.71073","MoKα","","0.0726","0.0482","","","0.1075","0.1184","","","","","","1.025","","","","has coordinates,has disorder","174392","2020-10-21","18:00:00",""
"7118413","10.2157","0.0003","22.5884","0.0005","15.2996","0.0005","90","","97.648","0.0013","90","","3499.07","0.17","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H47 Cr Ge N3 O6 -","- C36 H47 Cr Ge N3 O6 -","- C144 H188 Cr4 Ge4 N12 O24 -","4","1","","Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo","Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes","Chem.Commun.","2016","52","","613","","","","","0.71073","MoKα","","0.0678","0.0403","","","0.0894","0.0997","","","","","","1.017","","","","has coordinates","174392","2020-10-21","18:00:00",""
"7118414","10.3172","0.0009","22.6231","0.0018","15.3939","0.0012","90","","97.423","0.003","90","","3562.9","0.5","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H47 Ge Mo N3 O6 -","- C36 H47 Ge Mo N3 O6 -","- C144 H188 Ge4 Mo4 N12 O24 -","4","1","","Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo","Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes","Chem.Commun.","2016","52","","613","","","","","0.71073","MoKα","","0.0985","0.0512","","","0.1292","0.1846","","","","","","1.024","","","","has coordinates","174392","2020-10-21","18:00:00",""
"7118415","10.3691","0.0005","22.617","0.0007","15.3476","0.0007","90","","97.055","0.003","90","","3572","0.3","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H47 Ge N3 O6 W -","- C36 H47 Ge N3 O6 W -","- C144 H188 Ge4 N12 O24 W4 -","4","1","","Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo","Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes","Chem.Commun.","2016","52","","613","","","","","0.71073","MoKα","","0.0674","0.0416","","","0.0885","0.0998","","","","","","1.001","","","","has coordinates,has disorder","174392","2020-10-21","18:00:00",""
"7118416","8.299","0.016","12.11","0.02","13.39","0.03","76.13","0.02","87.13","0.03","87.08","0.03","1304","4","293","2","293","2","","","","","","","No","3","P -1","-P 1","2","2,6,10-tributylbenzo[lmn]phenanthridino[2,1,10,9-defgh][2,8]phenanthroline","2, 6,10-tributyl-1,5,9-triazacoronene","","- C33 H33 N3 -","- C33 H33 N3 -","- C66 H66 N6 -","2","1","","Qitao Tan; Huanhuan Chen; Huaida Xia; Bingxin Liu; Bin Xu","Parent and trisubstituted triazacoronenes: synthesis, crystal structure and physicochemical properties","Chem.Commun.","2016","52","","537","","","","","0.71073","MoKα","","0.1221","0.0814","","","0.2619","0.3043","","","","","","1.186","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118417","8.3829","0.0003","18.5671","0.0005","17.8534","0.0006","90","","98.919","0.003","90","","2745.21","0.16","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H23 F12 N3 Ru Sb2 -","- C16 H23 F12 N3 Ru Sb2 -","- C64 H92 F48 N12 Ru4 Sb8 -","4","1","","Zhao, Yinsong; He, Zhen; Li, Shiqing; Tang, Junbin; Gao, Ge; Lan, Jingbo; You, Jingsong","An air-stable half-sandwich Ru(II) complex as an efficient catalyst for [3+2] annulation of 2-arylcyclo-2-enones with alkynes.","Chemical communications (Cambridge, England)","2016","52","25","4613","4616","10.1039/c5cc10169g","","x-ray","0.71073","MoKα","","0.0845","0.0539","","","0.1369","0.1561","","","","","","1.02","","","","has coordinates","181540","2020-10-21","18:00:00",""
"7118418","9.7368","0.0003","8.7212","0.0003","17.6929","0.0005","90","","97.34","0.003","90","","1490.11","0.08","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O -","- C20 H18 O -","- C80 H72 O4 -","4","1","","Zhao, Yinsong; He, Zhen; Li, Shiqing; Tang, Junbin; Gao, Ge; Lan, Jingbo; You, Jingsong","An air-stable half-sandwich Ru(II) complex as an efficient catalyst for [3+2] annulation of 2-arylcyclo-2-enones with alkynes.","Chemical communications (Cambridge, England)","2016","52","25","4613","4616","10.1039/c5cc10169g","","x-ray","0.71073","MoKα","","0.0758","0.0501","","","0.1216","0.1374","","","","","","1.05","","","","has coordinates","181540","2020-10-21","18:00:00",""
"7118419","7.7687","0.0006","9.4304","0.0007","12.8027","0.001","101.342","0.001","104.75","0.001","102.507","0.001","853.44","0.11","130","","130","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H14 Cl3 N S -","- C18 H14 Cl3 N S -","- C36 H28 Cl6 N2 S2 -","2","1","","Yu, Liu-Zhu; Hu, Xu-Bo; Xu, Qin; Shi, Min","Thermally induced formal [3+2] cyclization of ortho-aminoaryl-tethered alkylidenecyclopropanes: facile synthesis of furoquinoline and thienoquinoline derivatives.","Chemical communications (Cambridge, England)","2016","52","13","2701","2704","10.1039/c5cc09218c","","","0.71073","MoKα","","0.0476","0.0408","","","0.1423","0.1503","","","","","","1.178","","","","has coordinates","177633","2020-10-21","18:00:00",""
"7118420","8.277","0.0012","8.861","0.0013","20.949","0.003","78.278","0.003","83.751","0.003","64.58","0.003","1358.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H12 Cl N O -","- C17 H12 Cl N O -","- C68 H48 Cl4 N4 O4 -","4","2","","Yu, Liu-Zhu; Hu, Xu-Bo; Xu, Qin; Shi, Min","Thermally induced formal [3+2] cyclization of ortho-aminoaryl-tethered alkylidenecyclopropanes: facile synthesis of furoquinoline and thienoquinoline derivatives.","Chemical communications (Cambridge, England)","2016","52","13","2701","2704","10.1039/c5cc09218c","","","0.71073","MoKα","","0.0669","0.0469","","","0.1163","0.1294","","","","","","1.029","","","","has coordinates","177633","2020-10-21","18:00:00",""
"7118421","7.7899","0.0017","9.516","0.002","11.134","0.002","99.138","0.005","97.433","0.005","109.903","0.005","751.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H13 Cl2 N O -","- C17 H13 Cl2 N O -","- C34 H26 Cl4 N2 O2 -","2","1","","Yu, Liu-Zhu; Hu, Xu-Bo; Xu, Qin; Shi, Min","Thermally induced formal [3+2] cyclization of ortho-aminoaryl-tethered alkylidenecyclopropanes: facile synthesis of furoquinoline and thienoquinoline derivatives.","Chemical communications (Cambridge, England)","2016","52","13","2701","2704","10.1039/c5cc09218c","","","0.71073","MoKα","","0.0853","0.0586","","","0.151","0.1707","","","","","","1.019","","","","has coordinates","177633","2020-10-21","18:00:00",""
"7118422","10.9669","0.0003","14.7049","0.0004","13.0353","0.0009","90","","113.016","0.008","90","","1934.82","0.19","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 N2 O8 Ti -","- C18 H22 N2 O8 Ti -","- C72 H88 N8 O32 Ti4 -","4","1","","Brennan, Bradley J.; Chen, Jeffrey; Rudshteyn, Benjamin; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W.","Molecular titanium-hydroxamate complexes as models for TiO2 surface binding.","Chemical communications (Cambridge, England)","2016","52","14","2972","2975","10.1039/c5cc09857b","","","0.71075","MoKα","","0.0516","0.0384","","","0.0943","0.1021","","","","","","1.056","","","","has coordinates,has disorder","177694","2020-10-21","18:00:00",""
"7118423","15.7049","0.0009","15.7049","0.0009","53.457","0.004","90","","90","","120","","11418.4","1.3","93","2","93","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C54 H72 N6 O21 S6 Ti3 -","- C54 H72 N6 O21 S6 Ti3 -","- C324 H432 N36 O126 S36 Ti18 -","6","0.166667","","Brennan, Bradley J.; Chen, Jeffrey; Rudshteyn, Benjamin; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W.","Molecular titanium-hydroxamate complexes as models for TiO2 surface binding.","Chemical communications (Cambridge, England)","2016","52","14","2972","2975","10.1039/c5cc09857b","","","0.71075","MoKα","","0.1024","0.0744","","","0.1801","0.1986","","","","","","1.037","","","","has coordinates,has disorder","177694","2020-10-21","18:00:00",""
"7118424","12.1927","0.0009","10.0654","0.0008","19.3484","0.0015","90","","102.042","0.007","90","","2322.3","0.3","93","2","93","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H40 Cl8 N4 O10 Ti2 -","- C36 H40 Cl8 N4 O10 Ti2 -","- C72 H80 Cl16 N8 O20 Ti4 -","2","0.5","","Brennan, Bradley J.; Chen, Jeffrey; Rudshteyn, Benjamin; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W.","Molecular titanium-hydroxamate complexes as models for TiO2 surface binding.","Chemical communications (Cambridge, England)","2016","52","14","2972","2975","10.1039/c5cc09857b","","","0.71075","MoKα","","0.1033","0.0886","","","0.2478","0.2587","","","","","","1.124","","","","has coordinates","177694","2020-10-21","18:00:00",""
"7118425","18.2657","0.0008","18.2657","0.0008","22.3708","0.0015","90","","90","","120","","6463.8","0.6","173","2","173","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- C24 O25 Zn4 -","- C24 O25 Zn4 -","- C72 O75 Zn12 -","3","0.0833333","","Bai, Linyi; Tu, Binbin; Qi, Yi; Gao, Qiang; Liu, Dong; Liu, Zhizhou; Zhao, Lingzhi; Li, Qiaowei; Zhao, Yanli","Enhanced performance in gas adsorption and Li ion batteries by docking Li(+) in a crown ether-based metal-organic framework.","Chemical communications (Cambridge, England)","2016","52","14","3003","3006","10.1039/c5cc09935h","","","0.71073","MoKα","","0.147","0.0802","","","0.1782","0.1969","","","","","","1.035","","","","has coordinates","177695","2020-10-21","18:00:00",""
"7118426","16.3223","0.0006","17.6076","0.0007","18.3797","0.0008","71.478","0.0019","77.643","0.0018","67.458","0.0017","4600.3","0.3","152","2","152","2","","","","","","","","4","P -1","-P 1","2","","","","- C99 H152 Ge2 Si4 -","- C98.5 H144 Ge2 Si4 -","- C197 H288 Ge4 Si8 -","2","1","","Nieder, David; Yildiz, Cem B.; Jana, Anukul; Zimmer, Michael; Huch, Volker; Scheschkewitz, David","Dimerization of a marginally stable disilenyl germylene to tricyclic systems: evidence for reversible NHC-coordination.","Chemical communications (Cambridge, England)","2016","52","13","2799","2802","10.1039/c5cc09878e","","","0.71073","MoKα","","0.0832","0.0492","","","0.1197","0.1353","","","","","","1.032","","","","has coordinates,has disorder","177641","2020-10-21","18:00:00",""
"7118427","33.8499","0.0014","26.2285","0.0014","20.2919","0.0008","90","","97.911","0.002","90","","17844.3","1.4","133","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C95.5 H152 Ge2 Si4 -","- C95.5 H144 Ge2 Si4 -","- C764 H1152 Ge16 Si32 -","8","1","","Nieder, David; Yildiz, Cem B.; Jana, Anukul; Zimmer, Michael; Huch, Volker; Scheschkewitz, David","Dimerization of a marginally stable disilenyl germylene to tricyclic systems: evidence for reversible NHC-coordination.","Chemical communications (Cambridge, England)","2016","52","13","2799","2802","10.1039/c5cc09878e","","","0.71073","MoKα","","0.0883","0.0462","","","0.095","0.1105","","","","","","1.01","","","","has coordinates,has disorder","177641","2020-10-21","18:00:00",""
"7118428","13.9588","0.0019","8.5515","0.0011","16.218","0.002","90","","104.782","0.014","90","","1871.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 F3 N O2 -","- C22 H18 F3 N O2 -","- C88 H72 F12 N4 O8 -","4","1","","Jiang, Quanbin; Guo, Tenglong; Wu, Kaikai; Yu, Zhengkun","Rhodium(iii)-catalyzed sp(2) C-H bond addition to CF3-substituted unsaturated ketones.","Chemical communications (Cambridge, England)","2016","52","14","2913","2915","10.1039/c5cc10361d","","","0.71073","MoKα","","0.0717","0.0463","","","0.1103","0.1266","","","","","","1.021","","","","has coordinates","177689","2020-10-21","18:00:00",""
"7118429","6.826","0.0015","9.791","0.002","30.82","0.007","90","","90","","90","","2059.8","0.8","273.15","","273.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H32 N O6 Si -","- C18 H32 N O6 Si -","- C72 H128 N4 O24 Si4 -","4","1","","Jian-Liang Ye; Yang Liu; Zhi-Ping Yang; Pei-Qiang Huang","The asymmetric total synthesis of (+)-N-acetyl norloline","Chem.Commun.","2016","52","","561","","","","","0.71073","MoKα","","0.0522","0.0464","","","0.1214","0.1251","","","","","","1.0367","","","","has coordinates","209363","2020-10-21","18:00:00",""
"7118430","8.4892","0.0007","8.7454","0.0007","14.2585","0.0011","83.179","0.007","79.851","0.007","84.564","0.007","1031.68","0.15","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H21 B F2 N4 -","- C24 H21 B F2 N4 -","- C48 H42 B2 F4 N8 -","2","1","","Dan Wu; Li Shao; Yang Li; Qinglian Hu; Feihe Huang; Guocan Yu; Guping Tang","A boron difluoride dye showing the aggregation-induced emission feature and high sensitivity to intra- and extra-cellular pH changes","Chem.Commun.","2016","52","","541","","","","","0.71073","MoKα","","0.0773","0.0491","","","0.1119","0.1357","","","","","","1.041","","","","has coordinates","174460","2020-10-21","18:00:00",""
"7118431","20.474","0.004","22.468","0.004","17.673","0.003","90","","110.92","0.03","90","","7594","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H52 Ni P2 Si -","- C43 H52 Ni P2 Si -","- C344 H416 Ni8 P16 Si8 -","8","2","","LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.","Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.","Chemical communications (Cambridge, England)","2016","52","7","1361","1364","10.1039/c5cc09349j","","","0.71073","MoKα","","0.0921","0.0603","","","0.1454","0.1794","","","","","","1.209","","","","has coordinates","174464","2020-10-21","18:00:00",""
"7118432","15.1784","0.0002","13.3439","0.0002","21.4058","0.0003","90","","110.73","0.001","90","","4054.82","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H58 Ni P2 Si -","- C46 H58 Ni P2 Si -","- C184 H232 Ni4 P8 Si4 -","4","1","","LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.","Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.","Chemical communications (Cambridge, England)","2016","52","7","1361","1364","10.1039/c5cc09349j","","","1.54178","CuKα","","0.039","0.034","","","0.0888","0.0925","","","","","","1.043","","","","has coordinates","174464","2020-10-21","18:00:00",""
"7118433","15.514","0.0004","13.3974","0.0003","21.723","0.0005","90","","112.905","0.002","90","","4159.06","0.18","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H58 Ni O3 P2 Si -","- C46 H58 Ni O3 P2 Si -","- C184 H232 Ni4 O12 P8 Si4 -","4","1","","LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.","Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.","Chemical communications (Cambridge, England)","2016","52","7","1361","1364","10.1039/c5cc09349j","","","1.54178","CuKα","","0.039","0.0347","","","0.0914","0.095","","","","","","1.064","","","","has coordinates,has disorder","174464","2020-10-21","18:00:00",""
"7118434","18.2625","0.0012","8.1482","0.0005","21.5259","0.0018","90","","93.717","0.004","90","","3196.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H48 Ni P2 Si -","- C33 H48 Ni P2 Si -","- C132 H192 Ni4 P8 Si4 -","4","1","","LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.","Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.","Chemical communications (Cambridge, England)","2016","52","7","1361","1364","10.1039/c5cc09349j","","","1.54178","CuKα","","0.0367","0.0316","","","0.0825","0.0862","","","","","","1.026","","","","has coordinates","174464","2020-10-21","18:00:00",""
"7118435","30.7146","0.0004","10.0835","0.0001","20.284","0.0003","90","","114.295","0.001","90","","5725.82","0.13","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H42 Ni O P2 -","- C31 H42 Ni O P2 -","- C248 H336 Ni8 O8 P16 -","8","1","","LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.","Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.","Chemical communications (Cambridge, England)","2016","52","7","1361","1364","10.1039/c5cc09349j","","","1.54178","CuKα","","0.0828","0.0777","","","0.1902","0.1996","","","","","","1.061","","","","has coordinates","174464","2020-10-21","18:00:00",""
"7118436","12.91","0.0005","15.492","0.0004","19.254","0.0006","90","","90","","90","","3850.8","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C43 H52 Ni P2 Si -","- C43 H52 Ni P2 Si -","- C172 H208 Ni4 P8 Si4 -","4","1","","LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.","Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.","Chemical communications (Cambridge, England)","2016","52","7","1361","1364","10.1039/c5cc09349j","","","0.71073","MoKα","","0.0839","0.0601","","","0.1151","0.1314","","","","","","1.045","","","","has coordinates","174464","2020-10-21","18:00:00",""
"7118437","8.394","0.0017","9.35","0.0019","13.675","0.003","82.26","0.03","73.44","0.03","82.14","0.03","1013.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Fe(3MeO-SalEen)(thsa)]","","","- C20 H24 Fe N5 O3 S -","- C20 H24 Fe N5 O3 S -","- C40 H48 Fe2 N10 O6 S2 -","2","1","","Phonsri, Wasinee; Martinez, Victor; Davies, Casey G.; Jameson, Guy N. L.; Moubaraki, Boujemaa; Murray, Keith S.","Ligand effects in a heteroleptic bis-tridentate iron(iii) spin crossover complex showing a very high T1/2 value.","Chemical communications (Cambridge, England)","2016","52","7","1443","1446","10.1039/c5cc08701e","","","0.71073","synchrotron","","0.0464","0.0401","","","0.1093","0.1123","","","","","","1.074","","","","has coordinates","174465","2020-10-21","18:00:00",""
"7118438","10.0309","0.0004","16.5754","0.0006","17.784","0.0007","90","","96.069","0.002","90","","2940.3","0.2","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H17 B F13 O3 P S -","- C30 H17 B F13 O3 P S -","- C120 H68 B4 F52 O12 P4 S4 -","4","1","","Yu, Jiangang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cooperative reaction chemistry derived from a borata-diene framework.","Chemical communications (Cambridge, England)","2016","52","7","1393","1396","10.1039/c5cc07954c","","","1.54178","CuKα","","0.0705","0.0452","","","0.0987","0.111","","","","","","1.035","","","","has coordinates,has disorder","174466","2020-10-21","18:00:00",""
"7118439","11.8789","0.0006","12.5298","0.0007","12.6592","0.0006","61.284","0.003","72.907","0.003","67.981","0.003","1516.86","0.14","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H18 B F10 P -","- C29 H18 B F10 P -","- C58 H36 B2 F20 P2 -","2","1","","Yu, Jiangang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cooperative reaction chemistry derived from a borata-diene framework.","Chemical communications (Cambridge, England)","2016","52","7","1393","1396","10.1039/c5cc07954c","","","1.54178","CuKα","","0.0647","0.0499","","","0.1297","0.1394","","","","","","1.079","","","","has coordinates","174466","2020-10-21","18:00:00",""
"7118440","12.7173","0.0003","24.4025","0.0006","16.3076","0.0004","90","","111.724","0.001","90","","4701.4","0.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H19 B2 F20 P -","- C41 H19 B2 F20 P -","- C164 H76 B8 F80 P4 -","4","1","","Yu, Jiangang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cooperative reaction chemistry derived from a borata-diene framework.","Chemical communications (Cambridge, England)","2016","52","7","1393","1396","10.1039/c5cc07954c","","","1.54178","CuKα","","0.0723","0.0546","","","0.1665","0.1793","","","","","","1.05","","","","has coordinates","174466","2020-10-21","18:00:00",""
"7118441","24.6726","0.0005","20.3084","0.0006","19.6095","0.0006","90","","124.093","0.001","90","","8136.8","0.4","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H19 B2 F20 P -","- C41 H19 B2 F20 P -","- C328 H152 B16 F160 P8 -","8","1","","Yu, Jiangang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cooperative reaction chemistry derived from a borata-diene framework.","Chemical communications (Cambridge, England)","2016","52","7","1393","1396","10.1039/c5cc07954c","","","1.54178","CuKα","","0.0522","0.0461","","","0.131","0.1357","","","","","","1.061","","","","has coordinates","174466","2020-10-21","18:00:00",""
"7118442","13.2593","0.0004","22.2116","0.0007","19.2412","0.0007","90","","101.101","0.002","90","","5560.7","0.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H25 B2 F20 O P -","- C48 H25 B2 F20 O P -","- C192 H100 B8 F80 O4 P4 -","4","1","","Yu, Jiangang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cooperative reaction chemistry derived from a borata-diene framework.","Chemical communications (Cambridge, England)","2016","52","7","1393","1396","10.1039/c5cc07954c","","","1.54178","CuKα","","0.0807","0.0538","","","0.143","0.1593","","","","","","1.052","","","","has coordinates","174466","2020-10-21","18:00:00",""
"7118443","11.3678","0.0004","11.6324","0.0004","16.8035","0.0007","70.245","0.002","82.445","0.002","79.967","0.003","2052.93","0.14","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H19 B2 F20 O P -","- C42 H19 B2 F20 O P -","- C84 H38 B4 F40 O2 P2 -","2","1","","Yu, Jiangang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard","Cooperative reaction chemistry derived from a borata-diene framework.","Chemical communications (Cambridge, England)","2016","52","7","1393","1396","10.1039/c5cc07954c","","","1.54178","CuKα","","0.0482","0.0465","","","0.1359","0.1379","","","","","","1.036","","","","has coordinates","174466","2020-10-21","18:00:00",""
"7118444","8.24752","0.0001","12.7555","0.00014","13.60131","0.00017","90","","100.427","0.0012","90","","1407.24","0.03","110.05","0.1","110.05","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H21 N O S -","- C15 H21 N O S -","- C60 H84 N4 O4 S4 -","4","1","","Rayner, Peter J.; Smith, Joshua C.; Denneval, Charline; O'Brien, Peter; Clarke, Paul A.; Horan, Richard A. J.","Mechanistic interrogation of the asymmetric lithiation-trapping of N-thiopivaloyl azetidine and pyrrolidine.","Chemical communications (Cambridge, England)","2016","52","7","1354","1357","10.1039/c5cc08690f","","","0.71073","MoKα","","0.0377","0.033","","","0.0841","0.0879","","","","","","1.038","","","","has coordinates","174467","2020-10-21","18:00:00",""
"7118445","7.0524","0.0003","17.7693","0.0008","22.6194","0.0007","90","","90","","90","","2834.6","0.2","110","0.1","110","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 N O S -","- C15 H21 N O S -","- C120 H168 N8 O8 S8 -","8","2","","Rayner, Peter J.; Smith, Joshua C.; Denneval, Charline; O'Brien, Peter; Clarke, Paul A.; Horan, Richard A. J.","Mechanistic interrogation of the asymmetric lithiation-trapping of N-thiopivaloyl azetidine and pyrrolidine.","Chemical communications (Cambridge, England)","2016","52","7","1354","1357","10.1039/c5cc08690f","","","0.71073","MoKα","","0.082","0.0691","","","0.165","0.1787","","","","","","1.058","","","","has coordinates","174467","2020-10-21","18:00:00",""
"7118446","6.51691","0.00018","11.9691","0.0003","29.6051","0.0008","90","","90","","90","","2309.24","0.11","110","0.14","110","0.14","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H17 N O2 S -","- C10 H17 N O2 S -","- C80 H136 N8 O16 S8 -","8","2","","Rayner, Peter J.; Smith, Joshua C.; Denneval, Charline; O'Brien, Peter; Clarke, Paul A.; Horan, Richard A. J.","Mechanistic interrogation of the asymmetric lithiation-trapping of N-thiopivaloyl azetidine and pyrrolidine.","Chemical communications (Cambridge, England)","2016","52","7","1354","1357","10.1039/c5cc08690f","","x-ray","0.71073","MoKα","","0.0397","0.0352","","","0.0785","0.0807","","","","","","1.054","","","","has coordinates","174467","2020-10-21","18:00:00",""
"7118447","9.6985","0.0003","6.50545","0.00016","17.186","0.0005","90","","94.266","0.002","90","","1081.31","0.05","110.05","0.1","110.05","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C9 H15 N O2 S -","- C9 H15 N O2 S -","- C36 H60 N4 O8 S4 -","4","2","","Rayner, Peter J.; Smith, Joshua C.; Denneval, Charline; O'Brien, Peter; Clarke, Paul A.; Horan, Richard A. J.","Mechanistic interrogation of the asymmetric lithiation-trapping of N-thiopivaloyl azetidine and pyrrolidine.","Chemical communications (Cambridge, England)","2016","52","7","1354","1357","10.1039/c5cc08690f","","x-ray","0.71073","MoKα","","0.047","0.0415","","","0.1003","0.1047","","","","","","1.072","","","","has coordinates","174467","2020-10-21","18:00:00",""
"7118448","10.2939","0.0005","10.7278","0.0003","14.0751","0.0007","90","","90","","90","","1554.33","0.12","103.3","","103.3","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(R)-3-(4-chlorophenyl)-4,4,4-trifluoro-3-(nitromethyl)-1-(thiazol-2-yl)butan-1-one","","- C14 H10 Cl F3 N2 O3 S -","- C14 H10 Cl F3 N2 O3 S -","- C56 H40 Cl4 F12 N8 O12 S4 -","4","1","","Hou, Xuhe; Ma, Hongli; Zhang, Zhenhua; Xie, Lei; Qin, Zhaohai; Fu, Bin","An efficient approach for the construction of trifluoromethylated all-carbon quaternary stereocenters: enantioselective Ni(ii)-catalyzed Michael addition of 2-acetyl azaarene to β,β-disubstituted nitroalkenes.","Chemical communications (Cambridge, England)","2016","52","7","1470","1473","10.1039/c5cc08480f","","","1.5418","CuKα","","0.0281","0.0276","","","0.0705","0.0708","","","","","","1.081","","","","has coordinates","174468","2020-10-21","18:00:00",""
"7118449","27.4838","0.0003","17.6558","0.0002","21.9216","0.0003","90","","118.269","0.001","90","","9368.7","0.2","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H63 Cl3 N2 O0.5 P2 -","- C44 H63 Cl3 N2 O0.5 P2 -","- C352 H504 Cl24 N16 O4 P16 -","8","1","","Schwedtmann, Kai; Holthausen, Michael H.; Sala, Chris H.; Hennersdorf, Felix; Fröhlich, Roland; Weigand, Jan J.","[((Cl)Im(Dipp))P[double bond, length as m-dash]P(Dipp)][GaCl4]: a polarized, cationic diphosphene.","Chemical communications (Cambridge, England)","2016","52","7","1409","1412","10.1039/c5cc08248j","","","1.54178","CuKα","","0.0591","0.0522","","","0.1579","0.1655","","","","","","1.051","","","","has coordinates,has disorder","174469","2020-10-21","18:00:00",""
"7118450","10.7484","0.0006","13.6179","0.0007","33.6481","0.0018","90","","94.25","0.001","90","","4911.6","0.5","153","1","153","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H56 Cl6 F Ga N2 P2 -","- C45 H56 Cl6 F Ga N2 P2 -","- C180 H224 Cl24 F4 Ga4 N8 P8 -","4","1","","Schwedtmann, Kai; Holthausen, Michael H.; Sala, Chris H.; Hennersdorf, Felix; Fröhlich, Roland; Weigand, Jan J.","[((Cl)Im(Dipp))P[double bond, length as m-dash]P(Dipp)][GaCl4]: a polarized, cationic diphosphene.","Chemical communications (Cambridge, England)","2016","52","7","1409","1412","10.1039/c5cc08248j","","","0.71073","MoKα","","0.0835","0.0663","","","0.1762","0.1849","","","","","","1.117","","","","has coordinates","174469","2020-10-21","18:00:00",""
"7118451","12.2639","0.0002","12.5384","0.0002","36.3192","0.0007","90","","99.262","0.001","90","","5511.98","0.17","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C53 H61 Cl3 F7 N2 O3 P2 S -","- C53 H61 Cl3 F7 N2 O3 P2 S -","- C212 H244 Cl12 F28 N8 O12 P8 S4 -","4","1","","Schwedtmann, Kai; Holthausen, Michael H.; Sala, Chris H.; Hennersdorf, Felix; Fröhlich, Roland; Weigand, Jan J.","[((Cl)Im(Dipp))P[double bond, length as m-dash]P(Dipp)][GaCl4]: a polarized, cationic diphosphene.","Chemical communications (Cambridge, England)","2016","52","7","1409","1412","10.1039/c5cc08248j","","","0.71073","MoKα","","0.077","0.0483","","","0.1453","0.1833","","","","","","1.087","","","","has coordinates,has disorder","174469","2020-10-21","18:00:00",""
"7118452","13.8028","0.0004","17.4286","0.0005","21.7529","0.0006","107.609","0.001","98.701","0.001","97.42","0.001","4844.6","0.2","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H60 Cl6 Ga N2 P3 -","- C42 H60 Cl6 Ga N2 P3 -","- C168 H240 Cl24 Ga4 N8 P12 -","4","2","","Schwedtmann, Kai; Holthausen, Michael H.; Sala, Chris H.; Hennersdorf, Felix; Fröhlich, Roland; Weigand, Jan J.","[((Cl)Im(Dipp))P[double bond, length as m-dash]P(Dipp)][GaCl4]: a polarized, cationic diphosphene.","Chemical communications (Cambridge, England)","2016","52","7","1409","1412","10.1039/c5cc08248j","","","0.71073","MoKα","","0.097","0.0503","","","0.1069","0.1246","","","","","","1.007","","","","has coordinates,has disorder","174469","2020-10-21","18:00:00",""
"7118457","9.5019","0.0006","10.4381","0.001","18.819","0.002","93.77","0.009","102.375","0.007","116.062","0.008","1610.3","0.3","293.78","0.1","293.78","0.1","","","","","","","","5","P 1","P 1","1","","","","- C34 H33 Br N2 O7 -","- C34 H33 Br N2 O7 -","- C68 H66 Br2 N4 O14 -","2","2","","Zhang, Zhenhua; Sun, Wangsheng; Zhu, Gongming; Yang, Junxian; Zhang, Ming; Hong, Liang; Wang, Rui","Chiral phosphoric acid catalyzed enantioselective 1,3-dipolar cycloaddition reaction of azlactones.","Chemical communications (Cambridge, England)","2016","52","7","1377","1380","10.1039/c5cc08989a","","x-ray","0.71073","MoKα","","0.0973","0.0387","","","0.0685","0.0744","","","","","","0.729","","","","has coordinates","174471","2020-10-21","18:00:00",""
"7118458","13.008","0.0002","13.008","0.0002","50.2913","0.0012","90","","90","","120","","7369.6","0.2","293","2","293","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C150 H116 Cl2 Cu3 La6 N12 O56 -","- C150 H101.94 Cl2 Cu3 La6 N12 O50.01 -","- C300 H203.88 Cl4 Cu6 La12 N24 O100.02 -","2","0.166667","","Fang, Wei-Hui; Zhang, Lei; Zhang, Jian; Yang, Guo-Yu","Halogen dependent symmetry change in two series of wheel cluster organic frameworks built from La18 tertiary building units.","Chemical communications (Cambridge, England)","2016","52","7","1455","1457","10.1039/c5cc08702c","","","1.54178","CuKα","","0.0729","0.0687","","","0.1662","0.1688","","","","","","1.081","","","","has coordinates","174472","2020-10-21","18:00:00",""
"7118459","13.0109","0.0003","13.0109","0.0003","51.3152","0.0011","90","","90","","120","","7523","0.3","293","2","293","2","","","","","","","","7","P -3 c 1","-P 3 2""c","165","","","","- C150 H101 Br3 Cu4 La6 N12 O39 -","- C150 H96 Br3 Cu4 La6 N12 O39 -","- C300 H192 Br6 Cu8 La12 N24 O78 -","2","0.166667","","Fang, Wei-Hui; Zhang, Lei; Zhang, Jian; Yang, Guo-Yu","Halogen dependent symmetry change in two series of wheel cluster organic frameworks built from La18 tertiary building units.","Chemical communications (Cambridge, England)","2016","52","7","1455","1457","10.1039/c5cc08702c","","","1.54178","CuKα","","0.1062","0.0988","","","0.2553","0.2622","","","","","","1.051","","","","has coordinates","174472","2020-10-21","18:00:00",""
"7118460","13.0142","0.0003","13.0142","0.0003","51.3233","0.0011","90","","90","","120","","7528","0.3","293","2","293","2","","","","","","","","7","P -3 c 1","-P 3 2""c","165","","","","- C150 H101 Cu4 I3 La6 N12 O39 -","- C150 H96 Cu4 I3 La6 N12 O39 -","- C300 H192 Cu8 I6 La12 N24 O78 -","2","0.166667","","Fang, Wei-Hui; Zhang, Lei; Zhang, Jian; Yang, Guo-Yu","Halogen dependent symmetry change in two series of wheel cluster organic frameworks built from La18 tertiary building units.","Chemical communications (Cambridge, England)","2016","52","7","1455","1457","10.1039/c5cc08702c","","","1.54178","CuKα","","0.1036","0.0955","","","0.2446","0.2509","","","","","","1.055","","","","has coordinates","174472","2020-10-21","18:00:00",""
"7118461","17.323","0.003","22.428","0.004","15.591","0.003","90","","95.051","0.003","90","","6033.9","1.9","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C77.5 H46 O10.5 -","- C77.5 H46 O10.5 -","- C310 H184 O42 -","4","1","","Suzuki, Akira; Kondo, Kei; Sei, Yoshihisa; Akita, Munetaka; Yoshizawa, Michito","A fluorescent molecular capsule with a flexible polyaromatic shell for the detection of monoterpene compounds in water.","Chemical communications (Cambridge, England)","2016","52","15","3151","3154","10.1039/c5cc09647b","","","0.71073","MoKα","","0.1414","0.0791","","","0.2217","0.2674","","","","","","0.938","","","","has coordinates","295947","2024-11-15","22:25:06",""
"7118462","9.302","0.0004","15.8206","0.0005","32.7189","0.0011","90","","90","","90","","4815","0.3","200","1","200","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C25 H31 N3 O4 -","- C25 H31 N3 O4 -","- C200 H248 N24 O32 -","8","1","","Diedrich, D.; Hamacher, A.; Gertzen, C. G. W.; Alves Avelar, L. A.; Reiss, G. J.; Kurz, T.; Gohlke, H.; Kassack, M. U.; Hansen, F. K.","Rational design and diversity-oriented synthesis of peptoid-based selective HDAC6 inhibitors.","Chemical communications (Cambridge, England)","2016","52","15","3219","3222","10.1039/c5cc10301k","","","0.71073","MoKα","","0.1359","0.1145","","","0.1625","0.1674","","","","","","1.866","","","","has coordinates","177665","2020-10-21","18:00:00",""
"7118463","7.7764","0.0012","15.755","0.002","25.521","0.004","90","","90","","90","","3126.8","0.8","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H20 F3 N O3 -","- C14 H20 F2.997 N O3 -","- C112 H160 F23.976 N8 O24 -","8","1","","Yagafarov, Niyaz Z.; Kolesnikov, Pavel N.; Usanov, Dmitry L.; Novikov, Valentin V.; Nelyubina, Yulia V.; Chusov, Denis","The synthesis of sterically hindered amines by a direct reductive amination of ketones.","Chemical communications (Cambridge, England)","2016","52","7","1397","1400","10.1039/c5cc08577b","","","0.71073","MoKα","","0.1015","0.0734","","","0.1742","0.185","","","","","","1.376","","","","has coordinates,has disorder","174475","2020-10-21","18:00:00",""
"7118464","14.124","0.003","15.235","0.004","17.465","0.003","87.755","0.016","69.97","0.012","89.95","0.02","3527.8","1.4","93","2","93","2","","","","","","","","5","P -1","-P 1","2","para nitro phenyl subp","tict1","","- C90 H72 B2 N8 O6 -","- C90 H72 B2 N8 O6 -","- C180 H144 B4 N16 O12 -","2","1","","Copley, Graeme; Oh, Juwon; Yoshida, Kota; Shimizu, Daiki; Kim, Dongho; Osuka, Atsuhiro","Intramolecular electron transfer reactions in meso-(4-nitrophenyl)-substituted subporphyrins.","Chemical communications (Cambridge, England)","2016","52","7","1424","1427","10.1039/c5cc09005a","","","1.54187","CuKα","","0.1453","0.1084","","","0.267","0.2952","","","","","","1.084","","","","has coordinates,has disorder","174476","2020-10-21","18:00:00",""
"7118465","17.046","0.0005","24.0462","0.0006","28.8442","0.0006","90","","90","","90","","11823","0.5","100","0.1","100","0.1","","","","","","","","6","P 2 2 21","P 2c 2","17","","","","- C104 H100 Cd2 N8 O13.63 V2 -","- C104 H100 Cd2 N8 O13.6285 V2 -","- C416 H400 Cd8 N32 O54.514 V8 -","4","1","","Bhunia, Asamanjoy; Dey, Subarna; Moreno, José María; Diaz, Urbano; Concepcion, Patricia; Van Hecke, Kristof; Janiak, Christoph; Van Der Voort, Pascal","A homochiral vanadium-salen based cadmium bpdc MOF with permanent porosity as an asymmetric catalyst in solvent-free cyanosilylation.","Chemical communications (Cambridge, England)","2016","52","7","1401","1404","10.1039/c5cc09459c","","x-ray","1.54184","CuKα","","0.0767","0.0564","","","0.1276","0.1393","","","","","","0.957","","","","has coordinates,has disorder","174477","2020-10-21","18:00:00",""
"7118466","9.8347","0.0003","10.7763","0.0004","13.371","0.0004","77.323","0.002","76.332","0.002","67.333","0.002","1257.5","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H27 N3 O4 S2 -","- C27 H27 N3 O4 S2 -","- C54 H54 N6 O8 S4 -","2","1","","Chen, Yu-Ling; Sharma, Pankaj; Liu, Rai-Shung","Sulfonamide-directed gold-catalyzed [2+2+2]-cycloadditions of nitriles with two discrete ynamides to construct 2,4-diaminopyridine cores.","Chemical communications (Cambridge, England)","2016","52","15","3187","3190","10.1039/c5cc09688j","","","0.71073","MoKα","","0.054","0.0405","","","0.1182","0.1518","","","","","","1.203","","","","has coordinates","177662","2020-10-21","18:00:00",""
"7118478","14.8737","0.0004","14.8737","0.0004","24.3175","0.0008","90","","90","","120","","4658.9","0.2","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","[Li(DME)3]2[Th(C6H5)6]","","- C60 H90 Li2 O12 Th -","- C60 H90 Li2 O12 Th -","- C180 H270 Li6 O36 Th3 -","3","0.166667","","Elizabeth A. Pedrick; Peter Hrobarik; Lani A. Seaman; Guang Wu; Trevor W. Hayton","Synthesis, structure and bonding of hexaphenyl thorium(IV): observation of a non-octahedral structure","Chem.Commun.","2016","52","","689","","","","","0.71073","MoKα","","0.0451","0.0338","","","0.0655","0.07","","","","","","1.047","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118479","16.5641","0.001","16.7043","0.001","21.3854","0.0012","90","","108.682","0.001","90","","5605.4","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Li(12-crown-4)(THF)]2[Th(C6H5)6]","","- C60 H78 Li2 O10 Th -","- C60 H78 Li2 O10 Th -","- C240 H312 Li8 O40 Th4 -","4","1","","Elizabeth A. Pedrick; Peter Hrobarik; Lani A. Seaman; Guang Wu; Trevor W. Hayton","Synthesis, structure and bonding of hexaphenyl thorium(IV): observation of a non-octahedral structure","Chem.Commun.","2016","52","","689","","","","","0.71073","MoKα","","0.0427","0.0297","","","0.0701","0.0756","","","","","","1.007","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7118480","5.6288","0.0011","12.578","0.003","41.669","0.008","90","","90","","90","","2950.1","1.1","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H26 Br2 O4 -","- C36 H26 Br2 O4 -","- C144 H104 Br8 O16 -","4","1","","Zhan-Yong Wang; Ya-Li Ding; Gang Wang; Ying Cheng","Chiral N-heterocyclic carbene/Lewis acid cooperative catalysis of the reaction of 2-aroylvinylcinnamaldehydes: a switch of the reaction pathway by Lewis acid activation","Chem.Commun.","2016","52","","788","","","","","0.71073","MoKα","","0.0777","0.0698","","","0.1496","0.1646","","","","","","1.001","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118481","9.263","0.0012","12.8186","0.0016","22.369","0.003","90","","90","","90","","2656.1","0.6","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C36 H28 O4 -","- C36 H28 O4 -","- C144 H112 O16 -","4","1","","Zhan-Yong Wang; Ya-Li Ding; Gang Wang; Ying Cheng","Chiral N-heterocyclic carbene/Lewis acid cooperative catalysis of the reaction of 2-aroylvinylcinnamaldehydes: a switch of the reaction pathway by Lewis acid activation","Chem.Commun.","2016","52","","788","","","","","1.54187","CuKα","","0.0275","0.0269","","","0.0703","0.0707","","","","","","1.045","","","","has coordinates","174541","2020-10-21","18:00:00",""
"7118482","5.5911","0.0018","13.004","0.004","40.623","0.013","90","","90","","90","","2953.6","1.6","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H26 Br2 O4 -","- C36 H26 Br2 O4 -","- C144 H104 Br8 O16 -","4","1","","Zhan-Yong Wang; Ya-Li Ding; Gang Wang; Ying Cheng","Chiral N-heterocyclic carbene/Lewis acid cooperative catalysis of the reaction of 2-aroylvinylcinnamaldehydes: a switch of the reaction pathway by Lewis acid activation","Chem.Commun.","2016","52","","788","","","","","0.71075","MoKα","","0.0574","0.0388","","","0.0641","0.0701","","","","","","0.931","","","","has coordinates","174541","2020-10-21","18:00:00",""
"7118484","21.0859","0.0012","8.8941","0.0005","8.6908","0.0005","90","","110.448","0.0018","90","","1527.18","0.15","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3',5'-Diethyl-2,2':6',2''-terpyridine","","- C19 H21 N3 -","- C19 H21 N3 -","- C76 H84 N12 -","4","0.5","","Hong, Seung Youn; Kwak, Jaesung; Chang, Sukbok","Rhodium-catalyzed selective CH functionalization of NNN tridentate chelating compounds via a rollover pathway.","Chemical communications (Cambridge, England)","2016","52","15","3159","3162","10.1039/c5cc09960a","","","0.71073","MoKα","","0.0611","0.0506","","","0.1442","0.1534","","","","","","1.094","","","","has coordinates","177649","2020-10-21","18:00:00",""
"7118485","30.5673","0.0018","9.9939","0.0005","8.7408","0.0006","90","","106.271","0.002","90","","2563.2","0.3","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3',5'-Bis(2-cyclohexylethyl)-2,2':6',2''-terpyridine","","- C31 H39 N3 -","- C31 H39 N3 -","- C124 H156 N12 -","4","0.5","","Hong, Seung Youn; Kwak, Jaesung; Chang, Sukbok","Rhodium-catalyzed selective CH functionalization of NNN tridentate chelating compounds via a rollover pathway.","Chemical communications (Cambridge, England)","2016","52","15","3159","3162","10.1039/c5cc09960a","","","0.71073","MoKα","","0.1235","0.075","","","0.2059","0.2414","","","","","","1.047","","","","has coordinates","177649","2020-10-21","18:00:00",""
"7118486","6.0936","0.0012","8.4244","0.0017","26.374","0.005","90","","90","","90","","1353.9","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H15 Cl N2 O -","- C15 H15 Cl N2 O -","- C60 H60 Cl4 N8 O4 -","4","1","","Feng, Qi; Li, Yuanyuan; Wang, Lili; Li, Chen; Wang, Jinmin; Liu, Yuanyuan; Li, Kai; Hou, Hongwei","Multiple-color aggregation-induced emission (AIE) molecules as chemodosimeters for pH sensing.","Chemical communications (Cambridge, England)","2016","52","15","3123","3126","10.1039/c5cc10423h","","","0.71073","MoKα","","0.1296","0.0888","","","0.1309","0.1505","","","","","","1.11","","","","has coordinates","177654","2020-10-21","18:00:00",""
"7118487","14.9189","0.0013","5.968","0.0005","20.9971","0.0018","90","","130.968","0.003","90","","1411.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Feng, Qi; Li, Yuanyuan; Wang, Lili; Li, Chen; Wang, Jinmin; Liu, Yuanyuan; Li, Kai; Hou, Hongwei","Multiple-color aggregation-induced emission (AIE) molecules as chemodosimeters for pH sensing.","Chemical communications (Cambridge, England)","2016","52","15","3123","3126","10.1039/c5cc10423h","","","0.71073","MoKα","","0.0929","0.0492","","","0.1095","0.1304","","","","","","1.052","","","","has coordinates","177654","2020-10-21","18:00:00",""
"7118488","11.278","0.002","8.2043","0.0016","27.475","0.006","90","","90","","90","","2542.2","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H16 N2 O -","- C15 H16 N2 O -","- C120 H128 N16 O8 -","8","1","","Feng, Qi; Li, Yuanyuan; Wang, Lili; Li, Chen; Wang, Jinmin; Liu, Yuanyuan; Li, Kai; Hou, Hongwei","Multiple-color aggregation-induced emission (AIE) molecules as chemodosimeters for pH sensing.","Chemical communications (Cambridge, England)","2016","52","15","3123","3126","10.1039/c5cc10423h","","","0.71073","MoKα","","0.1461","0.094","","","0.1812","0.2099","","","","","","1.179","","","","has coordinates","177654","2020-10-21","18:00:00",""
"7118489","26.956","0.004","26.956","0.004","39.145","0.008","90","","90","","90","","28444","8","293","2","253","2","","","","","","","","5","P 4/m n c","-P 4 2n","128","","","","- C78 H121 Cu6 N17 O54 -","- C54 H21 Cu6 N9 O30 -","- C432 H168 Cu48 N72 O240 -","8","0.5","","Liu, Bing; Yao, Shuo; Shi, Chao; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Significant enhancement of gas uptake capacity and selectivity via the judicious increase of open metal sites and Lewis basic sites within two polyhedron-based metal-organic frameworks.","Chemical communications (Cambridge, England)","2016","52","15","3223","3226","10.1039/c5cc09922f","","","0.71073","MoKα","","0.1246","0.0856","","","0.2344","0.2587","","","","","","0.934","","","","has coordinates","177660","2020-10-21","18:00:00",""
"7118490","27.405","0.004","27.405","0.004","39.362","0.008","90","","90","","90","","29562","9","100","2","100","2","","","","","","","","5","P 4/m n c","-P 4 2n","128","","","","- C87 H126 Cu6 N20 O48 -","- C62 H33 Cu6 N11 O28 -","- C496 H264 Cu48 N88 O224 -","8","0.5","","Liu, Bing; Yao, Shuo; Shi, Chao; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Significant enhancement of gas uptake capacity and selectivity via the judicious increase of open metal sites and Lewis basic sites within two polyhedron-based metal-organic frameworks.","Chemical communications (Cambridge, England)","2016","52","15","3223","3226","10.1039/c5cc09922f","","","0.71073","MoKα","","0.0866","0.072","","","0.1896","0.2002","","","","","","0.982","","","","has coordinates,has disorder","177660","2020-10-21","18:00:00",""
"7118491","8.5843","0.0012","8.5843","0.0012","21.69","0.004","90","","90","","120","","1384.2","0.4","296","2","296","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Methyl Ammonium Bismuth iodide","","- C3 H18 Bi2 I9 N3 -","- C2.9998 H17.9994 Bi2 I9 N3 -","- C5.9996 H35.9988 Bi4 I18 N6 -","2","0.0833333","","Eckhardt, Kai; Bon, Volodymyr; Getzschmann, Jürgen; Grothe, Julia; Wisser, Florian M.; Kaskel, Stefan","Crystallographic insights into (CH3NH3)3(Bi2I9): a new lead-free hybrid organic-inorganic material as a potential absorber for photovoltaics.","Chemical communications (Cambridge, England)","2016","52","14","3058","3060","10.1039/c5cc10455f","","","0.71073","MoKα","","0.0945","0.0453","","","0.108","0.125","","","","","","0.865","","","","has coordinates,has disorder","177688","2020-10-21","18:00:00",""
"7118492","21.876","0.003","22.174","0.003","15.3753","0.0018","90","","130.23","0.004","90","","5694","1.3","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H12 O4 -","- C18 H12 O4 -","- C288 H192 O64 -","16","2","","Reddy, Baddigam Kiran; Gadekar, Santosh C.; Anand, Venkataramanarao G.","The synthesis and characterization of the meso-meso linked antiaromatic tetraoxa isophlorin dimer.","Chemical communications (Cambridge, England)","2016","52","14","3007","3009","10.1039/c5cc10370c","","","0.71073","MoKα","","0.0791","0.0532","","","0.1592","0.1799","","","","","","1.222","","","","has coordinates","177693","2020-10-21","18:00:00",""
"7118493","35.203","0.006","55.389","0.009","12.2274","0.0019","90","","90","","90","","23842","7","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C98 H14 F10 O4 -","- C98 H14 F10 O4 -","- C1568 H224 F160 O64 -","16","1","","Reddy, Baddigam Kiran; Gadekar, Santosh C.; Anand, Venkataramanarao G.","The synthesis and characterization of the meso-meso linked antiaromatic tetraoxa isophlorin dimer.","Chemical communications (Cambridge, England)","2016","52","14","3007","3009","10.1039/c5cc10370c","","","0.71073","MoKα","","0.1225","0.0678","","","0.1396","0.1573","","","","","","0.971","","","","has coordinates","177693","2020-10-21","18:00:00",""
"7118494","57.756","0.006","57.756","0.006","57.756","0.006","90","","90","","90","","192660","3","100","2","100","2","","","","","","","","4","F d -3","-F 2uv 2vw 3","203","","","","- C84.86 H11.14 F8.57 O3.43 -","- C84.8571 H11.1429 F8.57143 O3.42857 -","- C9504 H1248 F960 O384 -","112","","","Reddy, Baddigam Kiran; Gadekar, Santosh C.; Anand, Venkataramanarao G.","The synthesis and characterization of the meso-meso linked antiaromatic tetraoxa isophlorin dimer.","Chemical communications (Cambridge, England)","2016","52","14","3007","3009","10.1039/c5cc10370c","","","0.71073","MoKα","","0.194","0.1296","","","0.3647","0.4364","","","","","","1.557","","","","has coordinates","177693","2020-10-21","18:00:00",""
"7118495","9.6614","0.0002","9.005","0.0002","18.1004","0.0004","90","","91.9684","0.0013","90","","1573.82","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 N O3 -","- C18 H19 N O3 -","- C72 H76 N4 O12 -","4","1","","Ramakrishna, Isai; Sahoo, Harekrishna; Baidya, Mahiuddin","Brønsted acid mediated N-O bond cleavage for α-amination of ketones through the aromatic nitroso aldol reaction.","Chemical communications (Cambridge, England)","2016","52","15","3215","3218","10.1039/c5cc10102f","","","0.71073","MoKα","","0.0559","0.0408","","","0.1077","0.1188","","","","","","1.046","","","","has coordinates","177656","2020-10-21","18:00:00",""
"7118496","9.0979","0.0002","9.836","0.0002","17.0069","0.0004","90","","102.321","0.0011","90","","1486.84","0.06","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N2 S -","- C17 H16 N2 S -","- C68 H64 N8 S4 -","4","1","","Ramakrishna, Isai; Sahoo, Harekrishna; Baidya, Mahiuddin","Brønsted acid mediated N-O bond cleavage for α-amination of ketones through the aromatic nitroso aldol reaction.","Chemical communications (Cambridge, England)","2016","52","15","3215","3218","10.1039/c5cc10102f","","","0.71073","MoKα","","0.0418","0.0343","","","0.0897","0.0969","","","","","","1.049","","","","has coordinates","177656","2020-10-21","18:00:00",""
"7118497","12.4037","0.0004","9.4552","0.0003","13.0281","0.0005","90","","100.594","0.0017","90","","1501.88","0.09","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 Br N O -","- C16 H16 Br N O -","- C64 H64 Br4 N4 O4 -","4","1","","Ramakrishna, Isai; Sahoo, Harekrishna; Baidya, Mahiuddin","Brønsted acid mediated N-O bond cleavage for α-amination of ketones through the aromatic nitroso aldol reaction.","Chemical communications (Cambridge, England)","2016","52","15","3215","3218","10.1039/c5cc10102f","","","0.71073","MoKα","","0.0663","0.042","","","0.0952","0.1063","","","","","","1.035","","","","has coordinates","177656","2020-10-21","18:00:00",""
"7118498","8.9551","0.0004","9.4163","0.0006","14.8711","0.0009","90","","95.037","0.002","90","","1249.15","0.12","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N O -","- C15 H15 N O -","- C60 H60 N4 O4 -","4","1","","Ramakrishna, Isai; Sahoo, Harekrishna; Baidya, Mahiuddin","Brønsted acid mediated N-O bond cleavage for α-amination of ketones through the aromatic nitroso aldol reaction.","Chemical communications (Cambridge, England)","2016","52","15","3215","3218","10.1039/c5cc10102f","","","0.71073","MoKα","","0.0624","0.0394","","","0.0992","0.11","","","","","","1.048","","","","has coordinates","177656","2020-10-21","18:00:00",""
"7118499","24.5419","0.0006","22.54","0.0006","25.4485","0.0007","90","","111.767","0.002","90","","13073.7","0.6","100","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C61 H52 B F8 N4 O10 Ru2 S2 -","- C61 H52 B F8 N4 O10 Ru2 S2 -","- C488 H416 B8 F64 N32 O80 Ru16 S16 -","8","1","","Gupta, Gajendra; Das, Abhishek; Ghate, Nikhil Baban; Kim, Takhyeon; Ryu, Ji Yeon; Lee, Junseong; Mandal, Nripendranath; Lee, Chang Yeon","Novel BODIPY-based Ru(ii) and Ir(iii) metalla-rectangles: cellular localization of compounds and their antiproliferative activities.","Chemical communications (Cambridge, England)","2016","52","23","4274","4277","10.1039/c6cc00046k","","","0.71073","MoKα","","0.0956","0.0746","","","0.1967","0.2072","","","","","","1.049","","","","has coordinates,has disorder","181571","2020-10-21","18:00:00",""
"7118500","24.488","0.002","24.507","0.003","25.043","0.004","60.821","0.009","61.007","0.009","60.124","0.005","10782","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C126.67 B2 F8 N8 O12.67 Ru4 S2 -","- C130 B2 F8 N8 O12.6667 Ru4 S2 -","- C390 B6 F24 N24 O38 Ru12 S6 -","3","1.5","","Gupta, Gajendra; Das, Abhishek; Ghate, Nikhil Baban; Kim, Takhyeon; Ryu, Ji Yeon; Lee, Junseong; Mandal, Nripendranath; Lee, Chang Yeon","Novel BODIPY-based Ru(ii) and Ir(iii) metalla-rectangles: cellular localization of compounds and their antiproliferative activities.","Chemical communications (Cambridge, England)","2016","52","23","4274","4277","10.1039/c6cc00046k","","","0.71073","MoKα","","0.325","0.2233","","","0.4644","0.5047","","","","","","2.513","","","","has coordinates","181571","2020-10-21","18:00:00",""
"7118501","20.4184","0.0009","19.7746","0.0009","20.8298","0.0009","90","","113.735","0.002","90","","7699","0.6","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C67 H75 B F5 Ir2 N4 O9 S -","- C67 H75 B F5 Ir2 N4 O9 S -","- C268 H300 B4 F20 Ir8 N16 O36 S4 -","4","1","","Gupta, Gajendra; Das, Abhishek; Ghate, Nikhil Baban; Kim, Takhyeon; Ryu, Ji Yeon; Lee, Junseong; Mandal, Nripendranath; Lee, Chang Yeon","Novel BODIPY-based Ru(ii) and Ir(iii) metalla-rectangles: cellular localization of compounds and their antiproliferative activities.","Chemical communications (Cambridge, England)","2016","52","23","4274","4277","10.1039/c6cc00046k","","","0.71073","MoKα","","0.1262","0.0851","","","0.2121","0.2347","","","","","","1.054","","","","has coordinates","181571","2020-10-21","18:00:00",""
"7118502","9.703","0.0006","10.0809","0.001","11.7856","0.0009","68.569","0.008","80.101","0.006","67.458","0.008","990.43","0.16","293","2","293.15","","","","","","","","","4","P -1","-P 1","2","Methyl 2-(4-bromophenyl)-4,5-diphenylfuran-3-carboxylate","wip2014-9-3","","- C24 H17 Br O3 -","- C24 H17 Br O3 -","- C48 H34 Br2 O6 -","2","1","","Wu, Jiaping; Wang, Dongxu; Wan, Yanjun; Ma, Cheng","Rhodium-catalyzed tunable oxidative cyclization toward the selective synthesis of α-pyrones and furans.","Chemical communications (Cambridge, England)","2016","52","8","1661","1664","10.1039/c5cc09137c","","","0.71073","MoKα","","0.0604","0.041","","","0.0778","0.0879","","","","","","1.062","","","","has coordinates","174637","2020-10-21","18:00:00",""
"7118503","10.9313","0.0006","18.7544","0.0011","9.2937","0.0007","90","","105.181","0.006","90","","1838.8","0.2","293","2","293.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Ethyl 4-(4-methoxyphenyl)-6-methyl-2-oxo-3-phenyl-2H-pyran-5-carboxylate","wjp2014-7-4-OCH3","","- C22 H20 O5 -","- C22 H20 O5 -","- C88 H80 O20 -","4","1","","Wu, Jiaping; Wang, Dongxu; Wan, Yanjun; Ma, Cheng","Rhodium-catalyzed tunable oxidative cyclization toward the selective synthesis of α-pyrones and furans.","Chemical communications (Cambridge, England)","2016","52","8","1661","1664","10.1039/c5cc09137c","","","0.71073","MoKα","","0.0748","0.0499","","","0.1157","0.1313","","","","","","1.033","","","","has coordinates","174637","2020-10-21","18:00:00",""
"7118504","9.2716","0.0005","11.6329","0.0006","17.2262","0.0009","90","","90","","90","","1857.94","0.17","293","2","293.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","wjp2014_10_9","tert-butyl 2-methyl-5-phenyl-4-(thiophen-2-yl)furan-3-carboxylate","","- C20 H20 O3 S -","- C20 H20 O3 S -","- C80 H80 O12 S4 -","4","1","","Wu, Jiaping; Wang, Dongxu; Wan, Yanjun; Ma, Cheng","Rhodium-catalyzed tunable oxidative cyclization toward the selective synthesis of α-pyrones and furans.","Chemical communications (Cambridge, England)","2016","52","8","1661","1664","10.1039/c5cc09137c","","","0.71073","MoKα","","0.064","0.0428","","","0.1051","0.1175","","","","","","1.018","","","","has coordinates,has disorder","174637","2020-10-21","18:00:00",""
"7118505","21.4013","0.0008","21.4013","0.0008","7.1696","0.0005","90","","90","","120","","2843.8","0.2","293","2","293","2","","","","","","","","6","P 63","P 6c","173","","","","- C1.33 H9.77 Al B5 N1.33 O10.88 -","- C1.33333 H9 Al B5 N1.33333 O10.8833 -","- C8 H54 Al6 B30 N8 O65.3 -","6","1","","Cao, Gao-Juan; Wei, Qi; Cheng, Jian-Wen; Cheng, Lin; Yang, Guo-Yu","A zeolite CAN-type aluminoborate with gigantic 24-ring channels.","Chemical communications (Cambridge, England)","2016","52","8","1729","1732","10.1039/c5cc08164e","","","0.71073","MoKα","","0.0571","0.0532","","","0.1626","0.1664","","","","","","1.087","","","","has coordinates,has disorder","174638","2020-10-21","18:00:00",""
"7118506","28.118","0.0013","14.1732","0.0006","19.5603","0.0011","90","","106.288","0.005","90","","7482.3","0.7","170","","170","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C38 H43 Cl3 O8 -","- C38 H43 Cl3 O8 -","- C304 H344 Cl24 O64 -","8","1","","Zhou, Jiong; Yang, Jie; Hua, Bin; Shao, Li; Zhang, Zhihua; Yu, Guocan","The synthesis, structure, and molecular recognition properties of a [2]calix[1]biphenyl-type hybrid[3]arene.","Chemical communications (Cambridge, England)","2016","52","8","1622","1624","10.1039/c5cc09088a","","","0.71073","MoKα","","0.0987","0.0536","","","0.1224","0.143","","","","","","1.02","","","","has coordinates","174639","2020-10-21","18:00:00",""
"7118507","14.4786","0.0002","11.9118","0.0001","21.7475","0.0002","90","","98.8187","0.0008","90","","3706.37","0.07","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 Cl2 F3 Ir2 N5 O3 S -","- C34 H40 Cl2 F3 Ir2 N5 O3 S -","- C136 H160 Cl8 F12 Ir8 N20 O12 S4 -","4","1","","Valencia, Marta; Müller-Bunz, Helge; Gossage, Robert A.; Albrecht, Martin","Enhanced product selectivity promoted by remote metal coordination in acceptor-free alcohol dehydrogenation catalysis.","Chemical communications (Cambridge, England)","2016","52","16","3344","3347","10.1039/c6cc00267f","","","0.71073","MoKα","","0.0253","0.0219","","","0.0463","0.0477","","","","","","1.081","","","","has coordinates","177668","2020-10-21","18:00:00",""
"7118508","14.4611","0.0007","8.8412","0.0005","24.209","0.001","90","","94.954","0.004","90","","3083.6","0.3","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C25 H27 Cl F6 Ir N5 O6 S2 -","- C25 H27 Cl F6 Ir N5 O6 S2 -","- C100 H108 Cl4 F24 Ir4 N20 O24 S8 -","4","1","","Valencia, Marta; Müller-Bunz, Helge; Gossage, Robert A.; Albrecht, Martin","Enhanced product selectivity promoted by remote metal coordination in acceptor-free alcohol dehydrogenation catalysis.","Chemical communications (Cambridge, England)","2016","52","16","3344","3347","10.1039/c6cc00267f","","","1.54184","CuKα","","0.0635","0.0487","","","0.1208","0.1318","","","","","","1.025","","","","has coordinates","177668","2020-10-21","18:00:00",""
"7118509","23.831","0.005","20.716","0.004","29.555","0.006","90","","90.75","0.03","90","","14590","5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C110 H78 N4 O56 S6 U8 -","- C110 H78 N4 O56 S6 U8 -","- C440 H312 N16 O224 S24 U32 -","4","1","","An, Shu-Wen; Mei, Lei; Hu, Kong-Qiu; Xia, Chuan-Qin; Chai, Zhi-Fang; Shi, Wei-Qun","The templated synthesis of a unique type of tetra-nuclear uranyl-mediated two-fold interpenetrating uranyl-organic framework.","Chemical communications (Cambridge, England)","2016","52","8","1641","1644","10.1039/c5cc09314g","","","0.71073","MoKα","","0.0883","0.0814","","","0.2333","0.2416","","","","","","1.028","","","","has coordinates","174641","2020-10-21","18:00:00",""
"7118510","10.523","0.002","11.866","0.002","29.288","0.006","90.81","0.03","92.91","0.03","92.71","0.03","3647.8","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H29 N2 O28 S3 U4 -","- C55 H29 N2 O28 S3 U4 -","- C110 H58 N4 O56 S6 U8 -","2","1","","An, Shu-Wen; Mei, Lei; Hu, Kong-Qiu; Xia, Chuan-Qin; Chai, Zhi-Fang; Shi, Wei-Qun","The templated synthesis of a unique type of tetra-nuclear uranyl-mediated two-fold interpenetrating uranyl-organic framework.","Chemical communications (Cambridge, England)","2016","52","8","1641","1644","10.1039/c5cc09314g","","","0.71073","MoKα","","0.066","0.0513","","","0.14","0.1494","","","","","","1.121","","","","has coordinates,has disorder","174641","2020-10-21","18:00:00",""
"7118511","13.9571","0.0006","14.1969","0.0006","18.5023","0.0008","90","","102.735","0.0015","90","","3576","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H37 Cl3 N2 Pt -","- C42 H37 Cl3 N2 Pt -","- C168 H148 Cl12 N8 Pt4 -","4","1","","Juliá, Fabio; Bautista, Delia; González-Herrero, Pablo","Developing strongly luminescent platinum(iv) complexes: facile synthesis of bis-cyclometalated neutral emitters.","Chemical communications (Cambridge, England)","2016","52","8","1657","1660","10.1039/c5cc09566b","","","0.71073","MoKα","","0.0218","0.0175","","","0.0376","0.0389","","","","","","1.05","","","","has coordinates","288195","2023-12-08","17:36:04",""
"7118512","10.0073","0.0006","21.4773","0.0012","11.0633","0.0006","90","","109.939","0.0019","90","","2235.3","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H23 Cl N2 O2 Pt -","- C25 H23 Cl N2 O2 Pt -","- C100 H92 Cl4 N8 O8 Pt4 -","4","1","","Juliá, Fabio; Bautista, Delia; González-Herrero, Pablo","Developing strongly luminescent platinum(iv) complexes: facile synthesis of bis-cyclometalated neutral emitters.","Chemical communications (Cambridge, England)","2016","52","8","1657","1660","10.1039/c5cc09566b","","","0.71073","MoKα","","0.0552","0.0343","","","0.0489","0.0527","","","","","","1.054","","","","has coordinates","174642","2020-10-21","18:00:00",""
"7118513","26.587","0.003","40.68","0.004","6.9773","0.0007","90","","90","","90","","7546.4","1.4","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C23 H19 Cl N2 Pt -","- C23 H19 Cl N2 Pt -","- C368 H304 Cl16 N32 Pt16 -","16","1","","Juliá, Fabio; Bautista, Delia; González-Herrero, Pablo","Developing strongly luminescent platinum(iv) complexes: facile synthesis of bis-cyclometalated neutral emitters.","Chemical communications (Cambridge, England)","2016","52","8","1657","1660","10.1039/c5cc09566b","","","0.71073","MoKα","","0.0313","0.0233","","","0.0357","0.037","","","","","","1.059","","","","has coordinates","174642","2020-10-21","18:00:00",""
"7118514","8.87","0.0005","10.7659","0.0006","12.1232","0.0006","99.7042","0.0016","109.505","0.0015","104.886","0.0016","1012.69","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H15 Cl F4 N2 Pt -","- C23 H15 Cl F4 N2 Pt -","- C46 H30 Cl2 F8 N4 Pt2 -","2","1","","Juliá, Fabio; Bautista, Delia; González-Herrero, Pablo","Developing strongly luminescent platinum(iv) complexes: facile synthesis of bis-cyclometalated neutral emitters.","Chemical communications (Cambridge, England)","2016","52","8","1657","1660","10.1039/c5cc09566b","","","0.71073","MoKα","","0.0182","0.0162","","","0.0383","0.0388","","","","","","1.078","","","","has coordinates","174642","2020-10-21","18:00:00",""
"7118515","8.81","0.003","14.662","0.005","22.745","0.007","101.843","0.009","100.698","0.008","101.743","0.007","2734.9","1.6","124","2","124","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H32 F18 N9 P3 Ru -","- C44 H32 F18 N9 P3 Ru -","- C88 H64 F36 N18 P6 Ru2 -","2","1","","Gupta, Suraj K.; Choudhury, Joyanta","A remote coordination booster enhances the catalytic efficiency by accelerating the generation of an active catalyst.","Chemical communications (Cambridge, England)","2016","52","16","3384","3387","10.1039/c6cc00157b","","","0.71073","MoKα","","0.2019","0.1024","","","0.2466","0.2798","","","","","","0.982","","","","has coordinates","177671","2020-10-21","18:00:00",""
"7118516","8.7665","0.0007","12.4009","0.0011","37.66","0.003","81.692","0.004","84.839","0.004","78.866","0.004","3966.8","0.6","140","2","140","2","","","","","","","","8","P -1","-P 1","2","","","","- C55 H46 F21 N14 O3 P3 Ru2 S -","- C55 H46 F21 N14 O3 P3 Ru2 S -","- C110 H92 F42 N28 O6 P6 Ru4 S2 -","2","1","","Gupta, Suraj K.; Choudhury, Joyanta","A remote coordination booster enhances the catalytic efficiency by accelerating the generation of an active catalyst.","Chemical communications (Cambridge, England)","2016","52","16","3384","3387","10.1039/c6cc00157b","","","0.71073","MoKα","","0.1087","0.0829","","","0.1851","0.1976","","","","","","1.095","","","","has coordinates","177671","2020-10-21","18:00:00",""
"7118517","5.498","0.005","9.083","0.008","16.538","0.015","90","","92.524","0.01","90","","825.1","1.3","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H15 F2 N O -","- C21 H15 F2 N O -","- C42 H30 F4 N2 O2 -","2","1","","Wan, Wen; Ma, Guobin; Li, Jialiang; Chen, Yunrong; Hu, Qingyang; Li, Minjie; Jiang, Haizhen; Deng, Hongmei; Hao, Jian","Silver-catalyzed oxidative decarboxylation of difluoroacetates: efficient access to C-CF2 bond formation.","Chemical communications (Cambridge, England)","2016","52","8","1598","1601","10.1039/c5cc09179a","","","0.71073","MoKα","","0.0354","0.0311","","","0.0536","0.0549","","","","","","1.603","","","","has coordinates","174644","2020-10-21","18:00:00",""
"7118518","21.6754","0.0006","11.3153","0.0003","12.8588","0.0003","90","","102.895","0.002","90","","3074.26","0.14","173.15","","173.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dichloro[diphenyl-(2-pyridyl)phosphine-1-N]zinc(II)","","- C34 H28 Cl2 N2 P2 Zn -","- C34 H28 Cl2 N2 P2 Zn -","- C136 H112 Cl8 N8 P8 Zn4 -","4","0.5","","Donovan, Elizabeth S.; Barry, Brian M.; Larsen, Christopher A.; Wirtz, Melissa N.; Geiger, William E.; Kemp, Richard A.","Facilitated carbon dioxide reduction using a Zn(ii) complex.","Chemical communications (Cambridge, England)","2016","52","8","1685","1688","10.1039/c5cc07318a","","","0.71073","MoKα","","0.064","0.0359","","","0.0654","0.0741","","","","","","1.026","","","","has coordinates","174645","2020-10-21","18:00:00",""
"7118519","16.0669","0.0005","12.254","0.0004","19.5763","0.0007","90","","98.966","0.002","90","","3807.2","0.2","173","2","173.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","dichloro[phenyldi(2-pyridyl)phosphine-2-N,N]zinc(II)","","- C36 H34 Cl4 N4 O P2 Zn2 -","- C36 H34 Cl4 N4 O P2 Zn2 -","- C144 H136 Cl16 N16 O4 P8 Zn8 -","4","1","","Donovan, Elizabeth S.; Barry, Brian M.; Larsen, Christopher A.; Wirtz, Melissa N.; Geiger, William E.; Kemp, Richard A.","Facilitated carbon dioxide reduction using a Zn(ii) complex.","Chemical communications (Cambridge, England)","2016","52","8","1685","1688","10.1039/c5cc07318a","","","0.71073","MoKα","","0.1165","0.0629","","","0.1515","0.1727","","","","","","1.071","","","","has coordinates,has disorder","174645","2020-10-21","18:00:00",""
"7118520","12.1574","0.0018","16.907","0.003","23.516","0.004","110.972","0.003","94.49","0.003","95.764","0.003","4456.5","1.3","173","2","173.15","","","","","","","","","6","P -1","-P 1","2","","","","- C95 H124 B4 Ge2 N4 O5 -","- C95 H124 B4 Ge2 N4 O5 -","- C190 H248 B8 Ge4 N8 O10 -","2","1","","Wu, Yile; Liu, Liu; Su, Jue; Yan, Kaili; Zhu, Jun; Zhao, Yufen","Synthesis of digermylene-stabilized linear tetraboronate and boroxine.","Chemical communications (Cambridge, England)","2016","52","8","1582","1585","10.1039/c5cc09330a","","","0.71073","MoKα","","0.1034","0.0762","","","0.2011","0.2314","","","","","","1.023","","","","has coordinates,has disorder","174646","2020-10-21","18:00:00",""
"7118521","13.192","0.008","24.045","","13.298","","90","","93.46","0.02","90","","4210","3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C67 H95 B3 Ge2 N4 O5 -","- C67 H95 B3 Ge2 N4 O5 -","- C134 H190 B6 Ge4 N8 O10 -","2","1","","Wu, Yile; Liu, Liu; Su, Jue; Yan, Kaili; Zhu, Jun; Zhao, Yufen","Synthesis of digermylene-stabilized linear tetraboronate and boroxine.","Chemical communications (Cambridge, England)","2016","52","8","1582","1585","10.1039/c5cc09330a","","","0.71073","MoKα","","0.1269","0.0793","","","0.1881","0.2176","","","","","","0.921","","","","has coordinates","174646","2020-10-21","18:00:00",""
"7118522","13.605","0.006","14.004","0.006","19.843","0.011","90","","90.69","0.04","90","","3780","3","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H51 B Ge N2 O2 -","- C41 H51 B Ge N2 O2 -","- C164 H204 B4 Ge4 N8 O8 -","4","1","","Wu, Yile; Liu, Liu; Su, Jue; Yan, Kaili; Zhu, Jun; Zhao, Yufen","Synthesis of digermylene-stabilized linear tetraboronate and boroxine.","Chemical communications (Cambridge, England)","2016","52","8","1582","1585","10.1039/c5cc09330a","","","0.71073","MoKα","","0.0575","0.0443","","","0.1104","0.1158","","","","","","1.068","","","","has coordinates","174646","2020-10-21","18:00:00",""
"7118523","15.8294","0.0004","31.0399","0.0008","16.1007","0.0004","90","","92.257","0.002","90","","7904.8","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C69 H75 F24 N16 O2 P4 Pd2 -","- C69 H68 F24 N16 O2 P4 Pd2 -","- C276 H272 F96 N64 O8 P16 Pd8 -","4","1","","Gazvoda, Martin; Virant, Miha; Pevec, Andrej; Urankar, Damijana; Bolje, Aljoša; Kočevar, Marijan; Košmrlj, Janez","A mesoionic bis(Py-tzNHC) palladium(ii) complex catalyses ""green"" Sonogashira reaction through an unprecedented mechanism.","Chemical communications (Cambridge, England)","2016","52","8","1571","1574","10.1039/c5cc08717a","","","0.71073","MoKα","","0.1094","0.0583","","","0.1093","0.1277","","","","","","1.046","","","","has coordinates","174647","2020-10-21","18:00:00",""
"7118524","16.4014","0.0006","19.0245","0.0007","41.5572","0.0015","90","","90","","90","","12967","0.8","150","2","150","2","","","","","","","","7","I b c a","-I 2b 2c","73","","","","- C32 H31 B F4 N8 O2 Pd -","- C32 H31 B F4 N8 O2 Pd -","- C512 H496 B16 F64 N128 O32 Pd16 -","16","1","","Gazvoda, Martin; Virant, Miha; Pevec, Andrej; Urankar, Damijana; Bolje, Aljoša; Kočevar, Marijan; Košmrlj, Janez","A mesoionic bis(Py-tzNHC) palladium(ii) complex catalyses ""green"" Sonogashira reaction through an unprecedented mechanism.","Chemical communications (Cambridge, England)","2016","52","8","1571","1574","10.1039/c5cc08717a","","","0.71073","MoKα","","0.1512","0.0653","","","0.1079","0.1341","","","","","","0.963","","","","has coordinates,has disorder","174647","2020-10-21","18:00:00",""
"7118525","11.925","0.006","23.667","0.012","7.039","0.004","90","","99.498","0.006","90","","1959.4","1.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H19 Cl N2 O -","- C23 H19 Cl N2 O -","- C92 H76 Cl4 N8 O4 -","4","1","","Roy, Tony; Thangaraj, Manikandan; Gonnade, Rajesh G.; Biju, Akkattu T.","Synthesis of functionalized amino epoxides by a three-component coupling involving aziridines, arynes and aldehydes.","Chemical communications (Cambridge, England)","2016","52","58","9044","9047","10.1039/c6cc00057f","","","0.71073","MoKα","","0.0722","0.0559","","","0.1374","0.1448","","","","","","1.416","","","","has coordinates","185102","2020-10-21","18:00:00",""
"7118526","9.859","0.002","9.973","0.002","11.943","0.003","103.759","0.014","101.793","0.014","114.317","0.012","976.9","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H19 Cl N2 O -","- C23 H19 Cl N2 O -","- C46 H38 Cl2 N4 O2 -","2","1","","Roy, Tony; Thangaraj, Manikandan; Gonnade, Rajesh G.; Biju, Akkattu T.","Synthesis of functionalized amino epoxides by a three-component coupling involving aziridines, arynes and aldehydes.","Chemical communications (Cambridge, England)","2016","52","58","9044","9047","10.1039/c6cc00057f","","","0.71073","MoKα","","0.342","0.0923","","","0.2626","0.41","","","","","","1.295","","","","has coordinates","185102","2020-10-21","18:00:00",""
"7118527","13.12","0.0002","22.789","0.0002","21.2","0.0003","90","","103.706","0.001","90","","6158.13","0.14","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H95 B2 N6 O0.5 Si3 -","- C58 H90 B2 N6 Si3 -","- C232 H360 B8 N24 Si12 -","4","1","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","1.5418","CuKα","","0.0433","0.0382","","","0.103","0.1075","","","","","","1.045","","","","has coordinates","174649","2020-10-21","18:00:00",""
"7118528","26.444","0.005","12.059","0.002","18.181","0.004","90","","98.06","0.03","90","","5740","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H90 B2 N6 Si2 Sn -","- C58 H90 B2 N6 Si2 Sn -","- C232 H360 B8 N24 Si8 Sn4 -","4","0.5","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","0.7108","Synchrotron","","0.0359","0.0336","","","0.0861","0.0876","","","","","","1.068","","","","has coordinates","174649","2020-10-21","18:00:00",""
"7118529","26.6148","0.0007","12.0185","0.0004","18.1788","0.0005","90","","97.896","0.001","90","","5759.7","0.3","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H90 B2 N6 Pb Si2 -","- C58 H90 B2 N6 Pb Si2 -","- C232 H360 B8 N24 Pb4 Si8 -","4","0.5","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","0.71073","MoKα","","0.0576","0.0365","","","0.0596","0.0661","","","","","","1.029","","","","has coordinates","174649","2020-10-21","18:00:00",""
"7118530","23.6484","0.0002","10.2456","0.0001","30.482","0.0002","90","","108.41","0.001","90","","7007.56","0.11","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H52 B Cl Ge N3 Si -","- C32 H52 B Cl Ge N3 Si -","- C256 H416 B8 Cl8 Ge8 N24 Si8 -","8","1","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","1.5418","CuKα","","0.0279","0.0266","","","0.0678","0.0688","","","","","","1.061","","","","has coordinates","174649","2020-10-21","18:00:00",""
"7118531","13.17","0.0002","20.129","0.0003","22.951","0.0004","90","","104.647","0.002","90","","5886.56","0.17","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H90 B2 N6 O2 Si3 -","- C58 H90 B2 N6 O2 Si3 -","- C232 H360 B8 N24 O8 Si12 -","4","1","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","1.5418","CuKα","","0.0525","0.0448","","","0.1187","0.1259","","","","","","1.022","","","","has coordinates","174649","2020-10-21","18:00:00",""
"7118532","10.0089","0.0005","16.8248","0.0007","19.7026","0.001","90","","104.172","0.002","90","","3216.9","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H50 B N5 Si2 -","- C29 H50 B N5 Si2 -","- C116 H200 B4 N20 Si8 -","4","1","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","0.71073","MoKα","","0.0955","0.0691","","","0.1717","0.1903","","","","","","1.054","","","","has coordinates,has disorder","174649","2020-10-21","18:00:00",""
"7118533","10.162","0.0006","16.8562","0.0008","19.2329","0.0013","90","","90","","90","","3294.5","0.3","123","2","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C29 H46 B Cl2 N3 Si2 -","- C29 H46 B Cl2 N3 Si2 -","- C116 H184 B4 Cl8 N12 Si8 -","4","1","","Hadlington, Terrance J.; Abdalla, Joseph A. B.; Tirfoin, Rémi; Aldridge, Simon; Jones, Cameron","Stabilization of a two-coordinate, acyclic diaminosilylene (ADASi): completion of the series of isolable diaminotetrylenes, :E(NR2)2 (E = group 14 element).","Chemical communications (Cambridge, England)","2016","52","8","1717","1720","10.1039/c5cc09673a","","","0.71073","MoKα","","0.1029","0.0672","","","0.1821","0.2101","","","","","","1.041","","","","has coordinates","174649","2020-10-21","18:00:00",""
"7118534","18.972","0.002","7.8309","0.0009","13.6741","0.0015","90","","90","","90","","2031.5","0.4","310","2","310","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0535","0.0415","","","0.0962","0.1018","","","","","","1.03","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118535","18.973","0.002","7.8316","0.0009","13.6758","0.0015","90","","90","","90","","2032.1","0.4","310","2","310","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0547","0.0416","","","0.0964","0.1023","","","","","","1.029","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118536","19.1246","0.0011","7.804","0.0005","13.7839","0.0008","90","","90","","90","","2057.2","0.2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0275","0.0257","","","0.0674","0.0684","","","","","","1.095","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118537","19.1221","0.0011","7.8119","0.0005","13.7812","0.0008","90","","90","","90","","2058.6","0.2","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0276","0.0258","","","0.0659","0.0669","","","","","","1.092","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118538","19.1203","0.0011","7.8191","0.0004","13.7785","0.0008","90","","90","","90","","2059.9","0.2","140","2","140","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0275","0.0258","","","0.0669","0.0678","","","","","","1.104","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118539","19.1211","0.001","7.8289","0.0004","13.7769","0.0008","90","","90","","90","","2062.36","0.19","160","2","160","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.028","0.0258","","","0.0669","0.068","","","","","","1.099","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118540","19.1196","0.001","7.8379","0.0004","13.7729","0.0007","90","","90","","90","","2063.97","0.18","180","2","180","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0278","0.0255","","","0.0651","0.0663","","","","","","1.092","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118541","19.1195","0.0009","7.8491","0.0004","13.7716","0.0007","90","","90","","90","","2066.72","0.18","200","2","200","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0278","0.0258","","","0.0665","0.0675","","","","","","1.06","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118542","19.1176","0.0009","7.8572","0.0004","13.7712","0.0007","90","","90","","90","","2068.58","0.18","220","2","220","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0293","0.0269","","","0.0692","0.0703","","","","","","1.084","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118543","19.1136","0.0009","7.8642","0.0004","13.7696","0.0006","90","","90","","90","","2069.75","0.17","240","2","240","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0297","0.0274","","","0.0732","0.0746","","","","","","1.074","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118544","19.1062","0.0009","7.8702","0.0004","13.7665","0.0007","90","","90","","90","","2070.06","0.18","260","2","260","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0314","0.0284","","","0.0751","0.077","","","","","","1.062","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118545","19.1073","0.0009","7.8706","0.0004","13.7668","0.0006","90","","90","","90","","2070.33","0.17","260","2","260","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H20 N2 O7 Zn -","- C22 H20 N2 O7 Zn -","- C88 H80 N8 O28 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0317","0.0288","","","0.0754","0.0771","","","","","","1.067","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118546","18.9732","0.0017","7.753","0.0007","13.6972","0.0012","90","","90","","90","","2014.8","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0409","0.0354","","","0.0854","0.0881","","","","","","1.059","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118547","18.9781","0.0018","7.766","0.0008","13.6963","0.0013","90","","90","","90","","2018.6","0.3","130","2","130","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0425","0.036","","","0.0866","0.0901","","","","","","1.06","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118548","18.976","0.002","7.7768","0.0008","13.692","0.0014","90","","90","","90","","2020.6","0.4","160","2","160","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0434","0.0363","","","0.086","0.0893","","","","","","1.061","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118549","18.977","0.002","7.7881","0.0009","13.689","0.0015","90","","90","","90","","2023.2","0.4","190","2","190","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0446","0.037","","","0.0897","0.0935","","","","","","1.056","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118550","18.983","0.002","7.8009","0.0009","13.6902","0.0016","90","","90","","90","","2027.3","0.4","220","2","220","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0477","0.0387","","","0.0918","0.0958","","","","","","1.057","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118551","18.9745","0.0019","7.808","0.0008","13.6816","0.0014","90","","90","","90","","2027","0.4","250","2","250","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0509","0.0406","","","0.0977","0.1029","","","","","","1.045","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118552","18.9725","0.0019","7.8178","0.0008","13.6767","0.0014","90","","90","","90","","2028.6","0.4","280","2","280","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H18 N2 O6 Zn -","- C22 H18 N2 O6 Zn -","- C88 H72 N8 O24 Zn4 -","4","1","","Lama, Prem; Alimi, Lukman O.; Das, Raj Kumar; Barbour, Leonard J.","Hydration-dependent anomalous thermal expansion behaviour in a coordination polymer.","Chemical communications (Cambridge, England)","2016","52","15","3231","3234","10.1039/c6cc00158k","","","0.71073","MoKα","","0.0509","0.0396","","","0.093","0.0979","","","","","","1.044","","","","has coordinates","177661","2020-10-21","18:00:00",""
"7118553","20.74","0.002","22.507","0.002","21.262","0.002","90","","113.972","0.004","90","","9068.9","1.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C144 H112 Co6 Gd6 N18 O44 -","- C144 H108 Co6 Gd6 N18 O44 -","- C288 H216 Co12 Gd12 N36 O88 -","2","0.5","","Alexandropoulos, Dimitris I.; Cunha-Silva, Luís; Lorusso, Giulia; Evangelisti, Marco; Tang, Jinkui; Stamatatos, Theocharis C.","Dodecanuclear 3d/4f-metal clusters with a 'Star of David' topology: single-molecule magnetism and magnetocaloric properties.","Chemical communications (Cambridge, England)","2016","52","8","1693","1696","10.1039/c5cc09385f","","","0.68239","synchrotron","","0.0775","0.0748","","","0.1958","0.1986","","","","","","0.889","","","","has coordinates","174651","2020-10-21","18:00:00",""
"7118554","35.3299","0.0016","22.8072","0.001","22.7035","0.001","90","","90","","90","","18293.9","1.4","120","2","120","2","","","","","","","","6","C m c e","-C 2ac 2","64","","","","- C144 H112 Gd6 N18 Ni6 O44 -","- C144 H84 Gd6 N18 Ni6 O44 -","- C576 H336 Gd24 N72 Ni24 O176 -","4","0.25","","Alexandropoulos, Dimitris I.; Cunha-Silva, Luís; Lorusso, Giulia; Evangelisti, Marco; Tang, Jinkui; Stamatatos, Theocharis C.","Dodecanuclear 3d/4f-metal clusters with a 'Star of David' topology: single-molecule magnetism and magnetocaloric properties.","Chemical communications (Cambridge, England)","2016","52","8","1693","1696","10.1039/c5cc09385f","","","0.71073","MoKα","","0.1003","0.0575","","","0.1531","0.1992","","","","","","1.043","","","","has coordinates","206165","2020-10-21","18:00:00",""
"7118555","35.809","0.002","22.7395","0.0015","23.0503","0.0014","90","","90","","90","","18769","2","120","2","120","2","","","","","","","","6","C m c e","-C 2ac 2","64","","","","- C132 H112 Gd6 N15 O48 Zn6 -","- C132 H90 Gd6 N12 O50 Zn6 -","- C528 H360 Gd24 N48 O200 Zn24 -","4","0.25","","Alexandropoulos, Dimitris I.; Cunha-Silva, Luís; Lorusso, Giulia; Evangelisti, Marco; Tang, Jinkui; Stamatatos, Theocharis C.","Dodecanuclear 3d/4f-metal clusters with a 'Star of David' topology: single-molecule magnetism and magnetocaloric properties.","Chemical communications (Cambridge, England)","2016","52","8","1693","1696","10.1039/c5cc09385f","","","0.71073","MoKα","","0.0771","0.0545","","","0.1513","0.1756","","","","","","0.93","","","","has coordinates","206165","2020-10-21","18:00:00",""
"7118556","35.395","0.0019","22.7777","0.0015","22.9329","0.0018","90","","90","","90","","18489","2","150","2","150","2","","","","","","","","6","C m c e","-C 2ac 2","64","","","","- C128 H104 Dy6 N10 O52 Zn6 -","- C128 H84 Dy6 N10 O52 Zn6 -","- C512 H336 Dy24 N40 O208 Zn24 -","4","0.25","","Alexandropoulos, Dimitris I.; Cunha-Silva, Luís; Lorusso, Giulia; Evangelisti, Marco; Tang, Jinkui; Stamatatos, Theocharis C.","Dodecanuclear 3d/4f-metal clusters with a 'Star of David' topology: single-molecule magnetism and magnetocaloric properties.","Chemical communications (Cambridge, England)","2016","52","8","1693","1696","10.1039/c5cc09385f","","","0.71073","MoKα","","0.0621","0.0498","","","0.13","0.1486","","","","","","0.919","","","","has coordinates","206165","2020-10-21","18:00:00",""
"7118557","35.887","0.003","22.5851","0.0017","23.2338","0.0017","90","","90","","90","","18831","3","120","2","120","2","","","","","","","","6","C m c e","-C 2ac 2","64","","","","- C128 H104 Dy6 N14 Ni6 O52 -","- C128 H84 Dy6 N10 Ni6 O52 -","- C512 H336 Dy24 N40 Ni24 O208 -","4","0.25","","Alexandropoulos, Dimitris I.; Cunha-Silva, Luís; Lorusso, Giulia; Evangelisti, Marco; Tang, Jinkui; Stamatatos, Theocharis C.","Dodecanuclear 3d/4f-metal clusters with a 'Star of David' topology: single-molecule magnetism and magnetocaloric properties.","Chemical communications (Cambridge, England)","2016","52","8","1693","1696","10.1039/c5cc09385f","","","0.71073","MoKα","","0.0958","0.0731","","","0.1852","0.2004","","","","","","1.085","","","","has coordinates","206165","2020-10-21","18:00:00",""
"7118558","5.2566","0.00005","12.33003","0.00013","25.5995","0.0003","90","","90","","90","","1659.21","0.03","123.01","0.1","123.01","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H12 Br N O5 -","- C20 H12 Br N O5 -","- C80 H48 Br4 N4 O20 -","4","1","","Kaya, Uğur; Chauhan, Pankaj; Hack, Daniel; Deckers, Kristina; Puttreddy, Rakesh; Rissanen, Kari; Enders, Dieter","Enantioselective synthesis of 4H-pyranonaphthoquinones via sequential squaramide and silver catalysis.","Chemical communications (Cambridge, England)","2016","52","8","1669","1672","10.1039/c5cc09592a","","x-ray","1.54184","CuKα","","0.0224","0.0206","","","0.0523","0.0537","","","","","","1.067","","","","has coordinates","174652","2020-10-21","18:00:00",""
"7118559","14.2762","0.0003","10.1806","0.00018","17.0287","0.0003","90","","109.886","0.001","90","","2327.38","0.08","123","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","benzofuran-based cage-dhaped borate","4?THF","","- C29 H21 B O7 -","- C29 H21 B O7 -","- C116 H84 B4 O28 -","4","1","","Konishi, Akihito; Yasunaga, Ryosuke; Chiba, Kouji; Yasuda, Makoto","Synthesis, characterization, and properties of a benzofuran-based cage-shaped borate: photo activation of Lewis acid catalysts.","Chemical communications (Cambridge, England)","2016","52","16","3348","3351","10.1039/c6cc00291a","","","1.54187","CuKα","","","0.0526","","","","0.1067","","","","","","3.326","","","","has coordinates","177666","2020-10-21","18:00:00",""
"7118560","7.9612","0.0001","24.5627","0.0004","16.5897","0.0003","90","","90.823","0.001","90","","3243.76","0.09","130","","130","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H34 N4 O8 -","- C36 H34 N4 O8 -","- C144 H136 N16 O32 -","4","2","","Wang, Yue-Ming; Zhang, Hong-Hao; Li, Can; Fan, Tao; Shi, Feng","Catalytic asymmetric chemoselective 1,3-dipolar cycloadditions of an azomethine ylide with isatin-derived imines: diastereo- and enantioselective construction of a spiro[imidazolidine-2,3'-oxindole] framework.","Chemical communications (Cambridge, England)","2016","52","9","1804","1807","10.1039/c5cc07924a","","","1.54178","CuKα","","0.0567","0.0478","","","0.1173","0.1245","","","","","","1.022","","","","has coordinates","174800","2020-10-21","18:00:00",""
"7118561","9.9607","0.001","7.291","0.0008","18.5284","0.0019","90","","95.286","0.002","90","","1339.9","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(3S,5S,8R,9S,10S,13R,14R,16R,17R)-16-hydroxy-10,17-dimethyl-17-((S)-1-((2R,5R)-5-methyl-6-oxotetrahydro-2H-pyran-2-yl)ethyl)tetradecahydro-15H-13,14-epoxycyclopenta[a]phenanthren-3-yl acetate","","- C29 H44 O6 -","- C29 H44 O6 -","- C58 H88 O12 -","2","1","","Wu, Jing-Jing; Shi, Yong; Tian, Wei-Sheng","Synthesis of the aglycon of aspafiliosides E and F based on cascade reactions.","Chemical communications (Cambridge, England)","2016","52","9","1942","1944","10.1039/c5cc08856a","","","0.71073","MoKα","","0.0638","0.0583","","","0.1516","0.1574","","","","","","1.035","","","","has coordinates,has disorder","174801","2020-10-21","18:00:00",""
"7118562","5.5837","0.0007","8.5339","0.001","19.865","0.002","90","","92.074","0.011","90","","945.96","0.19","293.15","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","","0.71073","MoKα","","0.1489","0.07","","","0.0975","0.1218","","","","","","1.052","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118563","5.6063","0.0002","8.5811","0.0007","19.4662","0.0017","90","","91.595","0.007","90","","936.12","0.12","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1382","0.0948","","","0.1826","0.2018","","","","","","1.22","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118564","5.618","0.0003","8.5855","0.0007","19.373","0.002","90","","91.521","0.007","90","","934.1","0.13","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1499","0.0925","","","0.1679","0.1923","","","","","","1.16","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118565","5.6294","0.0005","8.5824","0.0008","19.252","0.003","90","","91.427","0.009","90","","929.85","0.19","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1406","0.0854","","","0.1701","0.1914","","","","","","1.113","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118566","5.6409","0.0005","8.5631","0.0008","19.131","0.003","90","","91.475","0.01","90","","923.79","0.19","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1963","0.0877","","","0.1908","0.2345","","","","","","1.031","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118567","5.6523","0.0007","8.5616","0.0014","19.105","0.005","90","","91.471","0.017","90","","924.2","0.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1532","0.1149","","","0.2164","0.2367","","","","","","1.173","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118568","5.6822","0.0005","8.5112","0.0012","18.888","0.003","90","","91.591","0.01","90","","913.1","0.2","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1281","0.0875","","","0.1971","0.2163","","","","","","1.124","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118569","5.6907","0.0005","8.4732","0.0018","18.86","0.003","90","","91.741","0.009","90","","909","0.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1249","0.1019","","","0.2137","0.2266","","","","","","1.173","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118570","5.7167","0.0006","8.417","0.002","18.889","0.003","90","","91.904","0.01","90","","908.4","0.3","295","2","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1244","0.1034","","","0.2014","0.2125","","","","","","1.2","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118571","5.7431","0.0017","8.221","0.003","19.012","0.006","90","","92.47","0.03","90","","896.8","0.5","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N O2 -","- C9 H10 Cl N O2 -","- C36 H40 Cl4 N4 O8 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.3096","0.1088","","","0.265","0.3918","","","","","","0.965","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118572","13.1014","0.0006","11.7129","0.0004","13.2735","0.0006","90","","100.385","0.004","90","","2003.52","0.15","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C72 H88 N8 O36 S4 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1461","0.0761","","","0.1887","0.2476","","","","","","1.047","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118573","7.3374","0.0008","10.5566","0.0012","13.8798","0.0015","103.793","0.01","99.924","0.009","102.838","0.01","988.8","0.2","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1119","0.0681","","","0.1422","0.1686","","","","","","1.034","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118574","7.3066","0.0009","10.5681","0.0017","13.8909","0.0016","104.253","0.012","99.577","0.01","102.609","0.012","986.7","0.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.16","0.0776","","","0.1814","0.2375","","","","","","1.005","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118575","7.259","0.001","10.5719","0.0015","13.8895","0.0018","104.423","0.012","98.792","0.011","102.601","0.012","982.9","0.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1985","0.1049","","","0.281","0.3746","","","","","","1.023","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118576","7.2497","0.001","10.6164","0.0017","13.902","0.002","104.762","0.014","98.258","0.013","102.574","0.013","987.1","0.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.2188","0.1282","","","0.3363","0.4098","","","","","","1.149","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118577","7.1238","0.0019","10.631","0.002","13.925","0.003","106.01","0.017","95.898","0.018","102.081","0.019","976.7","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1893","0.1032","","","0.2711","0.3381","","","","","","0.975","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118578","7.096","0.0005","10.6518","0.0009","13.9338","0.0012","106.307","0.008","95.377","0.007","101.948","0.007","975.91","0.15","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1522","0.1009","","","0.2728","0.3155","","","","","","1.04","","","","has coordinates,has disorder","174802","2020-10-21","18:00:00",""
"7118579","7.0956","0.0007","10.6597","0.0013","13.943","0.0015","106.348","0.01","95.271","0.009","101.923","0.01","977.4","0.2","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N2 O9 S -","- C18 H22 N2 O9 S -","- C36 H44 N4 O18 S2 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1349","0.1076","","","0.2511","0.2698","","","","","","1.176","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118580","7.262","0.005","10.026","0.005","30.424","0.005","90","0.005","96.193","0.005","90","0.005","2202.2","1.9","295","2","295","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C9 H10 B F4 N O2 -","- C9 H10 B F4 N O2 -","- C72 H80 B8 F32 N8 O16 -","8","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.1203","0.0567","","","0.0976","0.1242","","","","","","1.048","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118581","7.2802","0.0011","9.067","0.0015","9.7329","0.0016","115.13","0.016","100.802","0.013","101.825","0.014","541.32","0.19","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C9 H10 B F4 N O2 -","- C9 H10 B F4 N O2 -","- C18 H20 B2 F8 N2 O4 -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","","0.71073","MoKα","","0.1684","0.0857","","","0.202","0.2686","","","","","","1.021","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118582","5.14519","0.00011","28.63202","0.00068","7.0164","0.00022","90","","104.505","0.0022","90","","1000.69","0.05","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 N2 O5 -","- C9 H10 N2 O5 -","- C36 H40 N8 O20 -","4","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","powder diffraction","","1.54056","CuKα1andKα2","","","","","","","","","","1.5","","","","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118583","5.5647","0.0005","5.8519","0.0008","15.82","0.0015","85.376","0.009","86.255","0.007","72.178","0.01","488.4","0.1","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C9 H10 F3 N O2 P0.5 -","- C9 H10 F3 N O2 P0.5 -","- C18 H20 F6 N2 O4 P -","2","1","","d'Agostino, Simone; Spinelli, Floriana; Boanini, Elisa; Braga, Dario; Grepioni, Fabrizia","Single crystal to single crystal [2+2] photoreactions in chloride and sulphate salts of 4-amino-cinnamic acid via solid-solution formation: a structural and kinetic study.","Chemical communications (Cambridge, England)","2016","52","9","1899","1902","10.1039/c5cc09412g","","x-ray","0.71073","MoKα","","0.0956","0.0703","","","0.1637","0.1832","","","","","","1.087","","","","has coordinates","174802","2020-10-21","18:00:00",""
"7118584","13.8075","0.0004","20.3411","0.0007","27.8465","0.0009","81.213","0.003","86.01","0.003","75.367","0.003","7474.5","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C97 H85 N5 Zn -","- C97 H85 N5 Zn -","- C388 H340 N20 Zn4 -","4","2","","Diev, Vyacheslav V.; Femia, Denise; Zhong, Qiwen; Djurovich, Peter I.; Haiges, Ralf; Thompson, Mark E.","A quinoidal bis-phenalenyl-fused porphyrin with supramolecular organization and broad near-infrared absorption.","Chemical communications (Cambridge, England)","2016","52","9","1949","1952","10.1039/c5cc09128d","","","1.54178","CuKα","","0.2037","0.0843","","","0.1683","0.2144","","","","","","1.008","","","","has coordinates,has disorder","174803","2020-10-21","18:00:00",""
"7118585","13.273","0.004","8.87","0.003","18.749","0.006","90","","90","","90","","2207.3","1.2","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C104 H104 N8 O16 -","8","1","","Jha, Abadh Kishor; Jain, Nidhi","The microwave-assisted ortho-alkylation of azine N-oxides with N-tosylhydrazones catalyzed by copper(i) iodide.","Chemical communications (Cambridge, England)","2016","52","9","1831","1834","10.1039/c5cc07833d","","","0.71073","MoKα","","0.1464","0.0951","","","0.1646","0.1831","","","","","","1.199","","","","has coordinates","174804","2020-10-21","18:00:00",""
"7118586","17.576","0.004","7.9026","0.0016","10.347","0.002","90","","100.213","0.007","90","","1414.4","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Zinc aminotriazolato oxalate","Zinc aminotriazolato oxalate","","- C6 H6 N8 O5 Zn2 -","- C6 H6 N8 O5 Zn2 -","- C24 H24 N32 O20 Zn8 -","4","1","","Banerjee, Aparna; Nandi, Shyamapada; Nasa, Parveen; Vaidhyanathan, Ramanathan","Enhancing the carbon capture capacities of a rigid ultra-microporous MOF through gate-opening at low CO2 pressures assisted by swiveling oxalate pillars.","Chemical communications (Cambridge, England)","2016","52","9","1851","1854","10.1039/c5cc08172f","","","1.54178","CuKα","","0.1141","0.1084","","","0.3081","0.3127","","","","","","1.047","","","","has coordinates","174805","2020-10-21","18:00:00",""
"7118587","9.1877","0.0004","13.6108","0.0006","12.5305","0.0005","90","","104.629","0.001","90","","1516.16","0.11","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zinc aminotriazolato oxalate","Zinc aminotriazolato oxalate","","- C9 H14 N8 O5 Zn2 -","- C9 H14 N8 O5 Zn2 -","- C36 H56 N32 O20 Zn8 -","4","1","","Banerjee, Aparna; Nandi, Shyamapada; Nasa, Parveen; Vaidhyanathan, Ramanathan","Enhancing the carbon capture capacities of a rigid ultra-microporous MOF through gate-opening at low CO2 pressures assisted by swiveling oxalate pillars.","Chemical communications (Cambridge, England)","2016","52","9","1851","1854","10.1039/c5cc08172f","","","1.54178","CuKα","","0.028","0.0271","","","0.0712","0.0719","","","","","","1.055","","","","has coordinates,has disorder","174805","2020-10-21","18:00:00",""
"7118588","17.576","0.004","7.9026","0.0016","10.347","0.002","90","","100.213","0.007","90","","1414.4","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Zinc aminotriazolato oxalate","Zinc aminotriazolato oxalate","","- C6 H6 N8 O4 Zn2 -","- C6 H6 N8 O4 Zn2 -","- C24 H24 N32 O16 Zn8 -","4","1","","Banerjee, Aparna; Nandi, Shyamapada; Nasa, Parveen; Vaidhyanathan, Ramanathan","Enhancing the carbon capture capacities of a rigid ultra-microporous MOF through gate-opening at low CO2 pressures assisted by swiveling oxalate pillars.","Chemical communications (Cambridge, England)","2016","52","9","1851","1854","10.1039/c5cc08172f","","","1.54178","CuKα","","0.0995","0.0943","","","0.253","0.2563","","","","","","1.045","","","","has coordinates","174805","2020-10-21","18:00:00",""
"7118589","8.9818","0.001","13.8656","0.0013","12.4104","0.0012","90","","105.36","0.005","90","","1490.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zinc aminotriazolato oxalate","Zinc aminotriazolato oxalate","","- C8 H11 N8 O5 Zn2 -","- C8 H11 N8 O5 Zn2 -","- C32 H44 N32 O20 Zn8 -","4","1","","Banerjee, Aparna; Nandi, Shyamapada; Nasa, Parveen; Vaidhyanathan, Ramanathan","Enhancing the carbon capture capacities of a rigid ultra-microporous MOF through gate-opening at low CO2 pressures assisted by swiveling oxalate pillars.","Chemical communications (Cambridge, England)","2016","52","9","1851","1854","10.1039/c5cc08172f","","","1.54178","CuKα","","0.1082","0.0999","","","0.2087","0.2127","","","","","","1.188","","","","has coordinates,has disorder","174805","2020-10-21","18:00:00",""
"7118590","8.9818","0.001","13.8656","0.0013","12.4104","0.0012","90","","105.36","0.005","90","","1490.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zinc aminotriazolato oxalate","Zinc aminotriazolato oxalate","","- C6 H5 N8 O4 Zn2 -","- C6 H5 N8 O4 Zn2 -","- C24 H20 N32 O16 Zn8 -","4","1","","Banerjee, Aparna; Nandi, Shyamapada; Nasa, Parveen; Vaidhyanathan, Ramanathan","Enhancing the carbon capture capacities of a rigid ultra-microporous MOF through gate-opening at low CO2 pressures assisted by swiveling oxalate pillars.","Chemical communications (Cambridge, England)","2016","52","9","1851","1854","10.1039/c5cc08172f","","","1.54178","CuKα","","0.0979","0.0896","","","0.1814","0.1852","","","","","","1.162","","","","has coordinates,has disorder","174805","2020-10-21","18:00:00",""
"7118591","11.1901","0.0009","36.49","0.003","8.194","0.0007","90","","96.076","0.002","90","","3327","0.5","298","2","298","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31 H23 Br Cl2 I N O5 S2 -","- C31 H23 Br Cl2 I N O5 S2 -","- C124 H92 Br4 Cl8 I4 N4 O20 S8 -","4","1","","Zhu, Yi-Long; Jiang, Bo; Hao, Wen-Juan; Wang, Ai-Fang; Qiu, Jiang-Kai; Wei, Ping; Wang, De-Cai; Li, Guigen; Tu, Shu-Jiang","A new cascade halosulfonylation of 1,7-enynes toward 3,4-dihydroquinolin-2(1H)-ones via sulfonyl radical-triggered addition/6-exo-dig cyclization.","Chemical communications (Cambridge, England)","2016","52","9","1907","1910","10.1039/c5cc08895j","","","0.71073","MoKα","","0.1942","0.125","","","0.3016","0.3308","","","","","","1.062","","","","has coordinates","174806","2020-10-21","18:00:00",""
"7118592","15.6069","0.0004","26.4325","0.0008","16.6221","0.0005","90","","90.155","0.002","90","","6857.1","0.3","233","2","233.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C69 H32 Co3 N5.75 O15 -","- C69 H32 Co3 N5.75 O15 -","- C276 H128 Co12 N23 O60 -","4","1","","Wang, Xiuli; Gao, Wen-Yang; Luan, Jian; Wojtas, Lukasz; Ma, Shengqian","An effective strategy to boost the robustness of metal-organic frameworks via introduction of size-matching ligand braces.","Chemical communications (Cambridge, England)","2016","52","9","1971","1974","10.1039/c5cc09432a","","","1.54178","CuKα","","0.1215","0.0695","","","0.1786","0.2069","","","","","","1.02","","","","has coordinates,has disorder","174807","2020-10-21","18:00:00",""
"7118593","15.3816","0.0003","15.3816","0.0003","16.8215","0.0004","90","","90","","120","","3446.66","0.13","233","2","233.15","","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- C64 H24 Co3 N5 O18.75 -","- C63.9996 H24 Co3 N4.9998 O18.7555 -","- C127.999 H48 Co6 N9.9996 O37.511 -","2","0.166667","","Wang, Xiuli; Gao, Wen-Yang; Luan, Jian; Wojtas, Lukasz; Ma, Shengqian","An effective strategy to boost the robustness of metal-organic frameworks via introduction of size-matching ligand braces.","Chemical communications (Cambridge, England)","2016","52","9","1971","1974","10.1039/c5cc09432a","","","1.54178","CuKα","","0.0704","0.0571","","","0.1561","0.1671","","","","","","1.033","","","","has coordinates,has disorder","174807","2020-10-21","18:00:00",""
"7118594","11.6963","0.0001","11.6963","0.0001","47.2239","0.0007","90","","90","","90","","6460.39","0.12","180","0.1","180","0.1","","","","","","","","5","P 43 2 2","P 4cw 2c","95","","","","- C24 H20 N8 O2 Zn2 -","- C24 H20 N8 O2 Zn2 -","- C192 H160 N64 O16 Zn16 -","8","1","","Xu, Zhong-Xuan; Ma, Yu-Lu; Zhang, Jian","Enantiopure anion templated synthesis of a zeolitic metal-organic framework.","Chemical communications (Cambridge, England)","2016","52","9","1923","1925","10.1039/c5cc09308b","","","1.54178","CuKα","","0.0497","0.0458","","","0.1504","0.1568","","","","","","1.048","","","","has coordinates","174808","2020-10-21","18:00:00",""
"7118595","43.645","0.003","43.645","0.003","43.645","0.003","90","","90","","90","","83139","10","110","2","110","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","PCN-99","","- C108 H48 In3 N12 O24 -","- C108 H48 In3 N12 O24 -","- C864 H384 In24 N96 O192 -","8","0.0416667","","Wang, Xuan; Lu, Weigang; Gu, Zhi-Yuan; Wei, Zhangwen; Zhou, Hong-Cai","Topology-guided design of an anionic bor-network for photocatalytic [Ru(bpy)3](2+) encapsulation.","Chemical communications (Cambridge, England)","2016","52","9","1926","1929","10.1039/c5cc08614k","","","0.71073","MoKα","","0.1597","0.0987","","","0.2798","0.3309","","","","","","1.117","","","","has coordinates,has disorder","174809","2020-10-21","18:00:00",""
"7118596","6.2745","0.0008","10.4378","0.0012","13.5235","0.0016","109.644","0.003","97.81","0.003","90.942","0.003","824.56","0.17","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H19 N2 -","- C23 H18 N2 -","- C46 H36 N4 -","2","1","","Chen, Kai; Tang, Xiang-Ying; Shi, Min","Rh(ii)-Catalyzed formation of pyrrolo[2,3-b]quinolines from azide-methylenecyclopropanes and isonitriles.","Chemical communications (Cambridge, England)","2016","52","9","1967","1970","10.1039/c5cc09236a","","","0.71073","MoKα","","0.0688","0.0491","","","0.1168","0.1294","","","","","","1.038","","","","has coordinates","174810","2020-10-21","18:00:00",""
"7118597","10.372","0.0001","12.1576","0.0001","21.0058","0.0002","77.946","0.001","84.483","0.001","80.041","0.001","2546.41","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C58 H66 N4 O4 -","- C58 H66 N4 O4 -","- C116 H132 N8 O8 -","2","1","","Chen, Kai; Tang, Xiang-Ying; Shi, Min","Rh(ii)-Catalyzed formation of pyrrolo[2,3-b]quinolines from azide-methylenecyclopropanes and isonitriles.","Chemical communications (Cambridge, England)","2016","52","9","1967","1970","10.1039/c5cc09236a","","","1.54178","CuKα","","0.0517","0.0444","","","0.1255","0.1347","","","","","","1.003","","","","has coordinates,has disorder","174810","2020-10-21","18:00:00",""
"7118598","12.014","0.002","15.518","0.003","15.75","0.002","90","","90","","90","","2936.3","0.8","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H41 Br2 Fe N P2 -","- C26 H41 Br2 Fe N P2 -","- C104 H164 Br8 Fe4 N4 P8 -","4","1","","Chakraborty, Subrata; Leitus, Gregory; Milstein, David","Selective hydrogenation of nitriles to primary amines catalyzed by a novel iron complex.","Chemical communications (Cambridge, England)","2016","52","9","1812","1815","10.1039/c5cc08204h","","","0.71073","MoKα","","0.0435","0.0333","","","0.0767","0.0814","","","","","","1.036","","","","has coordinates","174811","2020-10-21","18:00:00",""
"7118599","5.6674","0.0019","8.267","0.003","9.097","0.003","101.836","0.008","101.813","0.006","92.712","0.006","406.5","0.2","200","2","200","2","","","","","","","","3","P 1","P 1","1","","","","- C21 H19 P -","- C21 H19 P -","- C21 H19 P -","1","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0463","0.0439","","","0.0984","0.0997","","","","","","1.052","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118600","16.561","0.006","5.936","0.002","17.511","0.006","90","","111.673","0.003","90","","1599.7","1","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 N P -","- C20 H18 N P -","- C80 H72 N4 P4 -","4","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.710747","MoKα","","0.0423","0.0369","","","0.0962","0.0997","","","","","","1.033","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118601","9.5281","0.001","11.4269","0.0012","17.881","0.002","90","","90","","90","","1946.8","0.4","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H21 Fe P -","- C24 H21 Fe P -","- C96 H84 Fe4 P4 -","4","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0768","0.0602","","","0.15","0.164","","","","","","1.057","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118602","13.7817","0.0011","5.8294","0.0004","22.8279","0.0017","90","","97.672","0.004","90","","1817.6","0.2","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 N P -","- C22 H22 N P -","- C88 H88 N4 P4 -","4","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0762","0.0518","","","0.1148","0.1281","","","","","","1.072","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118603","18.2866","0.0007","6.0518","0.0002","25.5425","0.001","90","","94.9633","0.0017","90","","2816.11","0.18","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H33 N P2 -","- C34 H33 N P2 -","- C136 H132 N4 P8 -","4","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0652","0.0486","","","0.1013","0.1113","","","","","","1.086","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118604","7.4495","0.0018","13.489","0.003","8.484","0.002","90","","112.353","0.004","90","","788.5","0.3","200","2","200","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C17 H23 Fe N O -","- C17 H23 Fe N O -","- C34 H46 Fe2 N2 O2 -","2","0.5","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0427","0.039","","","0.0923","0.0939","","","","","","1.128","","","","has coordinates,has disorder","177652","2020-10-21","18:00:00",""
"7118605","13.439","0.004","9.537","0.003","20.11","0.005","90","","91.374","0.004","90","","2576.7","1.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H31 Fe O P -","- C31 H31 Fe O P -","- C124 H124 Fe4 O4 P4 -","4","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0975","0.076","","","0.1397","0.1529","","","","","","1.164","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118606","10.8265","0.0001","11.9861","0","13.0692","0.0004","81.455","0.007","88.558","0.007","63.176","0.004","1494.98","0.08","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H36 Fe O P2 -","- C35 H36 Fe O P2 -","- C70 H72 Fe2 O2 P4 -","2","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0373","0.0345","","","0.089","0.0919","","","","","","1.059","","","","has coordinates,has disorder","177652","2020-10-21","18:00:00",""
"7118607","8.282","","9.8286","0.0001","14.5509","0.0001","74.635","0.007","73.74","0.008","75.57","0.007","1076.66","0.06","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H29 Fe O P -","- C24 H29 Fe O P -","- C48 H58 Fe2 O2 P2 -","2","1","","Itazaki, Masumi; Katsube, Shinya; Kamitani, Masahiro; Nakazawa, Hiroshi","Synthesis of vinylphosphines and unsymmetric diphosphines: iron-catalyzed selective hydrophosphination reaction of alkynes and vinylphosphines with secondary phosphines.","Chemical communications (Cambridge, England)","2016","52","15","3163","3166","10.1039/c5cc10185a","","","0.7107","MoKα","","0.0452","0.0383","","","0.0895","0.0941","","","","","","1.061","","","","has coordinates","177652","2020-10-21","18:00:00",""
"7118608","31.68","0.006","38.34","0.008","41.12","0.008","90","","90","","90","","49945","17","293","2","293","2","","","","","","","","8","P c c n","-P 2ab 2ac","56","","","","- C1401 H1152 B16 N125 O181 P32 Pt16 S32 -","- C1412.32 H1152 B16 N129.44 O185.44 P32 Pt16 S32 -","- C1412.32 H1152 B16 N129.44 O185.44 P32 Pt16 S32 -","1","0.125","","Kaloudi-Chantzea, Antonia; Martinou, Elisabeth; Seintis, Kostas; Karakostas, Nikolaos; Giastas, Petros; Pitterl, Florian; Oberacher, Herbert; Fakis, Mihalis; Pistolis, George","Formation of a highly-ordered rigid multichromophoric 3D supramolecular network by combining ionic and coordination-driven self-assembly.","Chemical communications (Cambridge, England)","2016","52","16","3388","3391","10.1039/c5cc10335e","","","0.756","","","0.1915","0.1252","","","0.2421","0.288","","","","","","1.299","","","","has coordinates","177670","2020-10-21","18:00:00",""
"7118609","11.5013","0.0005","11.9173","0.0005","13.3035","0.0006","102.745","0.002","106.178","0.002","112.038","0.002","1511.12","0.12","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H37 Al N2 O7 -","- C34 H37 Al N2 O7 -","- C68 H74 Al2 N4 O14 -","2","1","","Saikawa, Makoto; Daicho, Manami; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of a new family of ionophores based on aluminum-dipyrrin complexes (ALDIPYs) and their strong recognition of alkaline earth ions.","Chemical communications (Cambridge, England)","2016","52","21","4014","4017","10.1039/c6cc00250a","","","0.71073","MoKα","","0.1108","0.0573","","","0.1634","0.1942","","","","","","1.164","","","","has coordinates","181557","2020-10-21","18:00:00",""
"7118610","17.1558","0.0006","11.8814","0.0004","24.8691","0.0008","90","","90","","90","","5069.2","0.3","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H27 B N2 O4 -","- C32 H27 B N2 O4 -","- C256 H216 B8 N16 O32 -","8","1","","Saikawa, Makoto; Daicho, Manami; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of a new family of ionophores based on aluminum-dipyrrin complexes (ALDIPYs) and their strong recognition of alkaline earth ions.","Chemical communications (Cambridge, England)","2016","52","21","4014","4017","10.1039/c6cc00250a","","","0.71073","MoKα","","0.0845","0.0518","","","0.1454","0.17","","","","","","1.046","","","","has coordinates","181557","2020-10-21","18:00:00",""
"7118611","24.6207","0.0014","7.271","0.003","35.445","0.006","90","","111.987","0.003","90","","5884","3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C64 H59 Al2 N4 Na O11 -","- C64 H55 Al2 N4 Na O11 -","- C256 H220 Al8 N16 Na4 O44 -","4","0.5","","Saikawa, Makoto; Daicho, Manami; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of a new family of ionophores based on aluminum-dipyrrin complexes (ALDIPYs) and their strong recognition of alkaline earth ions.","Chemical communications (Cambridge, England)","2016","52","21","4014","4017","10.1039/c6cc00250a","","","0.71073","MoKα","","0.1919","0.1208","","","0.3497","0.3923","","","","","","1.314","","","","has coordinates,has disorder","181557","2020-10-21","18:00:00",""
"7118612","23.498","0.004","38.393","0.007","23.36","0.004","90","","91.08","0.003","90","","21071","6","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C60 H50 N4 O6 -","- C60 H48 N4 O7 -","- C960 H768 N64 O112 -","16","2","","Saikawa, Makoto; Daicho, Manami; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of a new family of ionophores based on aluminum-dipyrrin complexes (ALDIPYs) and their strong recognition of alkaline earth ions.","Chemical communications (Cambridge, England)","2016","52","21","4014","4017","10.1039/c6cc00250a","","","0.71073","MoKα","","0.0989","0.0623","","","0.1701","0.1857","","","","","","1.107","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7118613","13.3625","0.0009","13.7619","0.0009","28.7802","0.0018","90","","90.967","0.003","90","","5291.7","0.6","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 N2 O4 -","- C32 H29 N2 O4 -","- C256 H232 N16 O32 -","8","2","","Saikawa, Makoto; Daicho, Manami; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of a new family of ionophores based on aluminum-dipyrrin complexes (ALDIPYs) and their strong recognition of alkaline earth ions.","Chemical communications (Cambridge, England)","2016","52","21","4014","4017","10.1039/c6cc00250a","","","0.71073","MoKα","","0.1468","0.0969","","","0.2289","0.2529","","","","","","1.428","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7118614","15.4739","0.0002","57.1814","0.0006","24.7469","0.0003","90","","94.602","0.001","90","","21825.9","0.5","100","2","100","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C168 H118 N10 O31 Zn8 -","- C168 H118 N10 O31 Zn8 -","- C672 H472 N40 O124 Zn32 -","4","1","","Bag, Partha Pratim; Wang, Dong; Chen, Zhuo; Cao, Rong","Outstanding drug loading capacity by water stable microporous MOF: a potential drug carrier.","Chemical communications (Cambridge, England)","2016","52","18","3669","3672","10.1039/c5cc09925k","","","1.54184","CuKα","","0.1302","0.1114","","","0.2154","0.2419","","","","","","1.364","","","","has coordinates","177645","2020-10-21","18:00:00",""
"7118615","14.385","0.003","25.076","0.005","17.318","0.004","90","","107.02","0.03","90","","5973","2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C57 H62 Au Cl5 N2 O4 P2 Ru -","- C57 H62 Au Cl5 N2 O4 P2 Ru -","- C228 H248 Au4 Cl20 N8 O16 P8 Ru4 -","4","1","","Fernández-Gallardo, Jacob; Elie, Benelita T.; Sanaú, Mercedes; Contel, María","Versatile synthesis of cationic N-heterocyclic carbene-gold(i) complexes containing a second ancillary ligand. Design of heterobimetallic ruthenium-gold anticancer agents.","Chemical communications (Cambridge, England)","2016","52","15","3155","3158","10.1039/c5cc09718e","","","0.71073","MoKα","","0.107","0.0548","","","0.1491","0.2066","","","","","","1.026","","","","has coordinates","177664","2020-10-21","18:00:00",""
"7118616","21.2","0.004","14.09","0.003","22.972","0.005","90","","93.02","0.03","90","","6852","2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C62 H72 Au Cl3 N2 O4 P2 Ru -","- C62 H72 Au Cl3 N2 O4 P2 Ru -","- C248 H288 Au4 Cl12 N8 O16 P8 Ru4 -","4","1","","Fernández-Gallardo, Jacob; Elie, Benelita T.; Sanaú, Mercedes; Contel, María","Versatile synthesis of cationic N-heterocyclic carbene-gold(i) complexes containing a second ancillary ligand. Design of heterobimetallic ruthenium-gold anticancer agents.","Chemical communications (Cambridge, England)","2016","52","15","3155","3158","10.1039/c5cc09718e","","","0.71073","MoKα","","0.0845","0.0657","","","0.1929","0.2056","","","","","","0.889","","","","has coordinates","177664","2020-10-21","18:00:00",""
"7118617","23.4136","0.0016","11.6676","0.0008","35.146","0.003","90","","102.822","0.004","90","","9361.8","1.2","173","2","173","2","","","","","","","","8","I 1 2/a 1","-I 2ya","15","","","","- C43 H45 B2 F15 N2 Ni O2 P2 -","- C43 H45 B2 F15 N2 Ni O2 P2 -","- C344 H360 B16 F120 N16 Ni8 O16 P16 -","8","1","","Ríos, Pablo; Curado, Natalia; López-Serrano, Joaquín; Rodríguez, Amor","Selective reduction of carbon dioxide to bis(silyl)acetal catalyzed by a PBP-supported nickel complex.","Chemical communications (Cambridge, England)","2016","52","10","2114","2117","10.1039/c5cc09650b","","","0.71073","MoKα","","0.0542","0.0372","","","0.1237","0.1405","","","","","","1.031","","","","has coordinates","175115","2020-10-21","18:00:00",""
"7118618","10.8323","0.0005","15.4988","0.0008","24.841","0.0013","103.448","0.0014","97.059","0.0013","107.037","0.0013","3795.4","0.3","150.15","","150.15","","","","","","","","","5","P -1","-P 1","2","","","","- C72 H90 N7 O2 Rh -","- C72 H90 N7 O2 Rh -","- C144 H180 N14 O4 Rh2 -","2","1","","Kleinhans, George; Guisado-Barrios, Gregorio; Liles, David C.; Bertrand, Guy; Bezuidenhout, Daniela I.","A rhodium(i)-oxygen adduct as a selective catalyst for one-pot sequential alkyne dimerization-hydrothiolation tandem reactions.","Chemical communications (Cambridge, England)","2016","52","17","3504","3507","10.1039/c6cc00029k","","","0.71073","MoKα","","0.1086","0.066","","","0.1716","0.1896","","","","","","1.046","","","","has coordinates,has disorder","181577","2020-10-21","18:00:00",""
"7118619","16.2214","0.0004","24.0518","0.0005","15.2494","0.0003","90","","108.856","0.0009","90","","5630.3","0.2","150.15","","150.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H69 Cl F6 N7 P -","- C60 H69 Cl F6 N7 P -","- C240 H276 Cl4 F24 N28 P4 -","4","1","","Kleinhans, George; Guisado-Barrios, Gregorio; Liles, David C.; Bertrand, Guy; Bezuidenhout, Daniela I.","A rhodium(i)-oxygen adduct as a selective catalyst for one-pot sequential alkyne dimerization-hydrothiolation tandem reactions.","Chemical communications (Cambridge, England)","2016","52","17","3504","3507","10.1039/c6cc00029k","","","1.54178","CuKα","","0.047","0.043","","","0.1107","0.1137","","","","","","1.042","","","","has coordinates,has disorder","181577","2020-10-21","18:00:00",""
"7118620","8.3991","0.0006","10.1015","0.0007","13.5475","0.0009","69.158","0.001","78.162","0.001","84.594","0.001","1051.08","0.13","153","2","153","1","","","","","","","","7","P -1","-P 1","2","","","","- C15 H20 F3 N4 O3 P S3 -","- C15 H20 F3 N4 O3 P S3 -","- C30 H40 F6 N8 O6 P2 S6 -","2","1","","Henne, Florian D.; Watt, Fabian A.; Schwedtmann, Kai; Hennersdorf, Felix; Kokoschka, Malte; Weigand, Jan J.","Tetra-cationic imidazoliumyl-substituted phosphorus-sulfur heterocycles from a cationic organophosphorus sulfide.","Chemical communications (Cambridge, England)","2016","52","10","2023","2026","10.1039/c5cc08182c","","","0.71073","MoKα","","0.0568","0.0412","","","0.0975","0.1064","","","","","","1.029","","","","has coordinates","175118","2020-10-21","18:00:00",""
"7118621","6.5855","0.0004","12.5308","0.0006","12.4698","0.0007","90","","91.568","0.002","90","","1028.64","0.1","153","","153","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C15 H20 F3 N4 O3 P S3 -","- C15 H20 F3 N4 O3 P S3 -","- C30 H40 F6 N8 O6 P2 S6 -","2","0.5","","Henne, Florian D.; Watt, Fabian A.; Schwedtmann, Kai; Hennersdorf, Felix; Kokoschka, Malte; Weigand, Jan J.","Tetra-cationic imidazoliumyl-substituted phosphorus-sulfur heterocycles from a cationic organophosphorus sulfide.","Chemical communications (Cambridge, England)","2016","52","10","2023","2026","10.1039/c5cc08182c","","","0.71073","MoKα","","0.0406","0.0369","","","0.1027","0.1055","","","","","","1.061","","","","has coordinates","175119","2020-10-21","18:00:00",""
"7118622","9.1184","0.0007","13.9277","0.001","25.5013","0.0018","101.117","0.001","91.826","0.001","94.621","0.001","3163.8","0.4","153","2","153","1","","","","","","","","7","P -1","-P 1","2","","","","- C38 H57 F12 N11 O12 P4 S8 -","- C38 H57 F12 N11 O12 P4 S8 -","- C76 H114 F24 N22 O24 P8 S16 -","2","1","","Henne, Florian D.; Watt, Fabian A.; Schwedtmann, Kai; Hennersdorf, Felix; Kokoschka, Malte; Weigand, Jan J.","Tetra-cationic imidazoliumyl-substituted phosphorus-sulfur heterocycles from a cationic organophosphorus sulfide.","Chemical communications (Cambridge, England)","2016","52","10","2023","2026","10.1039/c5cc08182c","","","0.71073","MoKα","","0.0651","0.0456","","","0.1102","0.1207","","","","","","1.038","","","","has coordinates","175120","2020-10-21","18:00:00",""
"7118623","17.5055","0.0004","17.5055","0.0004","13.3734","0.0006","90","","90","","90","","4098.2","0.2","100","","100","","","","","","","","","7","I 4","I 4","79","","","","- C48 H80 F12 N8 O12 P4 S8 -","- C48 H80 F12 N8 O12 P4 S8 -","- C96 H160 F24 N16 O24 P8 S16 -","2","0.25","","Henne, Florian D.; Watt, Fabian A.; Schwedtmann, Kai; Hennersdorf, Felix; Kokoschka, Malte; Weigand, Jan J.","Tetra-cationic imidazoliumyl-substituted phosphorus-sulfur heterocycles from a cationic organophosphorus sulfide.","Chemical communications (Cambridge, England)","2016","52","10","2023","2026","10.1039/c5cc08182c","","","0.71073","MoKα","","0.0784","0.0623","","","0.1627","0.1761","","","","","","1.046","","","","has coordinates,has disorder","175121","2020-10-21","18:00:00",""
"7118624","19.4474","0.0011","10.8872","0.0005","9.4942","0.0005","90","","99.138","0.005","90","","1984.67","0.18","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H33 N O5 -","- C19 H33 N O5 -","- C76 H132 N4 O20 -","4","1","","Álvarez-Méndez, Sergio J; García, Celina; Martín, Víctor S","The Evans Aldol-Prins cyclization: a general and stereoselective method for the synthesis of 2,3,4,5,6-pentasubstituted tetrahydropyrans.","Chemical communications (Cambridge, England)","2016","52","16","3380","3383","10.1039/c6cc00160b","","x-ray","1.54184","CuKα","","0.0895","0.0788","","","0.2167","0.2303","","","","","","1.038","","","","has coordinates,has disorder","177669","2020-10-21","18:00:00",""
"7118625","7.2543","0.0011","10.8861","0.0017","12.636","0.002","90","","90","","90","","997.9","0.3","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-phenylimidazo[1,5-a]pyridine","","- C13 H10 N2 -","- C13 H10 N2 -","- C52 H40 N8 -","4","1","","Li, Yajun; Chao, Allen; Fleming, Fraser F.","Isonitrile alkylations: a rapid route to imidazo[1,5-a]pyridines.","Chemical communications (Cambridge, England)","2016","52","10","2111","2113","10.1039/c5cc08724d","","","0.71073","MoKα","","0.0656","0.0577","","","0.1365","0.1449","","","","","","1.139","","","","has coordinates","175123","2020-10-21","18:00:00",""
"7118626","30.871","0.003","30.871","0.003","10.6581","0.0014","90","","90","","90","","10157.4","1.9","296","2","296","2","","","","","","","","6","P 42/n b c","-P 4ac 2b","133","","","","- C74 H54 N2 Na2 O10 Zn -","- C74 H54 N2 Na2 O10 Zn -","- C296 H216 N8 Na8 O40 Zn4 -","4","","","Chen, Dashu; Xing, Hongzhu; Su, Zhongmin; Wang, Chungang","Electrical conductivity and electroluminescence of a new anthracene-based metal-organic framework with π-conjugated zigzag chains.","Chemical communications (Cambridge, England)","2016","52","10","2019","2022","10.1039/c5cc09065b","","","0.71073","MoKα","","0.1121","0.0581","","","0.1666","0.2018","","","","","","0.978","","","","has coordinates","175124","2020-10-21","18:00:00",""
"7118627","13.113","0.006","29.058","0.014","30.167","0.012","90","","90","","90","","11495","9","100","16","100","16","","","","","","","","4","C c c m","-C 2 2c","66","","UTSA-68","","- C40 H26 Cu2 O10 -","- C40 H26 Cu2 O10 -","- C160 H104 Cu8 O40 -","4","0.25","","Chang, Ganggang; Li, Bin; Wang, Hailong; Hu, Tongliang; Bao, Zongbi; Chen, Banglin","Control of interpenetration in a microporous metal-organic framework for significantly enhanced C2H2/CO2 separation at room temperature.","Chemical communications (Cambridge, England)","2016","52","17","3494","3496","10.1039/c5cc10598f","","","0.71073","MoKα","","0.0989","0.061","","","0.1713","0.1955","","","","","","0.64","","","","has coordinates","177706","2020-10-21","18:00:00",""
"7118628","9.818","0.0006","18.2883","0.0013","13.7042","0.0007","90","","97.628","0.005","90","","2438.9","0.3","285.07","0.1","285.07","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 B2 N2 P -","- C26 H25 B2 N2 P -","- C104 H100 B8 N8 P4 -","4","1","","Liu, Tianlin; Qi, Xiujuan; Huang, Shi; Jiang, Linhai; Li, Jianling; Tang, Chenglong; Zhang, Qinghua","Exploiting hydrophobic borohydride-rich ionic liquids as faster-igniting rocket fuels.","Chemical communications (Cambridge, England)","2016","52","10","2031","2034","10.1039/c5cc09737a","","x-ray","0.71073","MoKα","","0.1777","0.0725","","","0.1544","0.2096","","","","","","0.982","","","","has coordinates","175126","2020-10-21","18:00:00",""
"7118629","12.7251","0.0004","13.0624","0.0004","20.4974","0.0007","82.857","0.003","74.521","0.003","88.927","0.003","3257.65","0.19","130.01","0.1","130.01","0.1","","","101","","","","","5","P -1","-P 1","2","","Sodium terbium tungsten oxide hydrate","","- H70 Na9 O71 Tb W10 -","- Na9 O71 Tb W10 -","- Na18 O142 Tb2 W20 -","2","1","","Vonci, Michele; Giansiracusa, Marcus J.; Gable, Robert W.; Van den Heuvel, Willem; Latham, Kay; Moubaraki, Boujemaa; Murray, Keith S.; Yu, Dehong; Mole, Richard A.; Soncini, Alessandro; Boskovic, Colette","Ab initio calculations as a quantitative tool in the inelastic neutron scattering study of a single-molecule magnet analogue.","Chemical communications (Cambridge, England)","2016","52","10","2091","2094","10.1039/c5cc07541f","","x-ray","1.54184","CuKα","","0.0501","0.0476","","","0.1329","0.1365","","","","","","1.085","","","","has coordinates","204136","2020-10-21","18:00:00",""
"7118630","12.8949","0.0005","13.1098","0.0005","20.9057","0.0007","76.956","0.003","83.954","0.003","77.348","0.003","3353.5","0.2","131.1","0.1","131.1","0.1","","","","","","","","5","P -1","-P 1","2","","","","- H72 Na9 O72 Tb W10 -","- Na8.998 O72 Tb W10 -","- Na17.996 O144 Tb2 W20 -","2","1","","Vonci, Michele; Giansiracusa, Marcus J.; Gable, Robert W.; Van den Heuvel, Willem; Latham, Kay; Moubaraki, Boujemaa; Murray, Keith S.; Yu, Dehong; Mole, Richard A.; Soncini, Alessandro; Boskovic, Colette","Ab initio calculations as a quantitative tool in the inelastic neutron scattering study of a single-molecule magnet analogue.","Chemical communications (Cambridge, England)","2016","52","10","2091","2094","10.1039/c5cc07541f","","x-ray","1.54184","CuKα","","0.0439","0.0353","","","0.0863","0.0912","","","","","","1.052","","","","has coordinates,has disorder","204136","2020-10-21","18:00:00",""
"7118631","12.7357","0.0005","13.0732","0.0004","20.4565","0.0008","82.865","0.003","74.492","0.004","88.859","0.003","3256.2","0.2","130.01","0.1","130.01","0.1","","","101","","","","","5","P -1","-P 1","2","","Sodium terbium yttrium oxide hydrate","","- H70 Na9 O71 W10 Y -","- Na9 O71 W10 Y -","- Na18 O142 W20 Y2 -","2","1","","Vonci, Michele; Giansiracusa, Marcus J.; Gable, Robert W.; Van den Heuvel, Willem; Latham, Kay; Moubaraki, Boujemaa; Murray, Keith S.; Yu, Dehong; Mole, Richard A.; Soncini, Alessandro; Boskovic, Colette","Ab initio calculations as a quantitative tool in the inelastic neutron scattering study of a single-molecule magnet analogue.","Chemical communications (Cambridge, England)","2016","52","10","2091","2094","10.1039/c5cc07541f","","x-ray","1.54184","CuKα","","0.0446","0.0354","","","0.0822","0.0879","","","","","","1.017","","","","has coordinates","204136","2020-10-21","18:00:00",""
"7118632","7.7128","0.0001","8.5049","0.0001","26.8442","0.0004","90","","90","","90","","1760.89","0.04","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(R)-3-(4-fluorophenyl)-3-(o-tolylthio)isoindolin-1-one","","- C21 H15 F N O S -","- C21 H15 F N O S -","- C84 H60 F4 N4 O4 S4 -","4","1","","Suć, Josipa; Dokli, Irena; Gredičak, Matija","Chiral Brønsted acid-catalysed enantioselective synthesis of isoindolinone-derived N(acyl),S-acetals.","Chemical communications (Cambridge, England)","2016","52","10","2071","2074","10.1039/c5cc08813e","","","1.54184","CuKα","","0.0385","0.0382","","","0.1085","0.1088","","","","","","1.1","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7118633","12.8268","0.0014","13.2644","0.0013","24.5245","0.0007","96.008","0.005","95.267","0.006","118.65","0.011","3593.1","0.7","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C40.5 H40.5 Cl1.5 N4 O2 S4 -","- C40 H40 N4 O2 S4 -","- C160 H160 N16 O8 S16 -","4","2","","Llewellyn, Ben A.; Davies, E. Stephen; Pfeiffer, Constance R.; Cooper, Mick; Lewis, William; Champness, Neil R.","Thionated perylene diimides with intense absorbance in the near-IR.","Chemical communications (Cambridge, England)","2016","52","10","2099","2102","10.1039/c5cc09962e","","x-ray","1.54184","CuKα","","0.1863","0.1488","","","0.3777","0.4157","","","","","","1.264","","","","has coordinates,has disorder","175129","2020-10-21","18:00:00",""
"7118634","10.5929","0.0005","13.3915","0.0008","15.0416","0.0008","93.393","0.005","105.711","0.005","107.519","0.005","1935.6","0.2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H41 Cl3 N4 O2 S4 -","- C41 H41 Cl3 N4 O2 S4 -","- C82 H82 Cl6 N8 O4 S8 -","2","1","","Llewellyn, Ben A.; Davies, E. Stephen; Pfeiffer, Constance R.; Cooper, Mick; Lewis, William; Champness, Neil R.","Thionated perylene diimides with intense absorbance in the near-IR.","Chemical communications (Cambridge, England)","2016","52","10","2099","2102","10.1039/c5cc09962e","","x-ray","1.54184","CuKα","","0.0738","0.0605","","","0.1541","0.1664","","","","","","1.024","","","","has coordinates,has disorder","175129","2020-10-21","18:00:00",""
"7118635","12.7735","0.0002","8.3815","0.0001","32.1723","0.0005","90","","111.684","0.001","90","","3200.66","0.08","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 N4 O6 -","- C40 H40 N4 O6 -","- C160 H160 N16 O24 -","4","1","","Llewellyn, Ben A.; Davies, E. Stephen; Pfeiffer, Constance R.; Cooper, Mick; Lewis, William; Champness, Neil R.","Thionated perylene diimides with intense absorbance in the near-IR.","Chemical communications (Cambridge, England)","2016","52","10","2099","2102","10.1039/c5cc09962e","","","1.5418","CuKα","","0.0476","0.0436","","","0.1236","0.1269","","","","","","1.039","","","","has coordinates","175129","2020-10-21","18:00:00",""
"7118636","13.8281","0.0009","17.5883","0.0011","23.8941","0.0016","80.217","0.002","75.331","0.002","84.33","0.003","5530.7","0.6","122","2","122","2","","","","","","","","9","P -1","-P 1","2","","","","- C95.19 H158.44 Cl11.82 Mo3 O0.39 P4 Pd2 Ru2 S4 -","- C95.185 H158.323 Cl11.815 Mo3 O0.395 P4 Pd2 Ru2 S4 -","- C190.37 H316.646 Cl23.63 Mo6 O0.79 P8 Pd4 Ru4 S8 -","2","1","","Reinholdt, Anders; Herbst, Konrad; Bendix, Jesper","Delivering carbide ligands to sulfide-rich clusters.","Chemical communications (Cambridge, England)","2016","52","10","2015","2018","10.1039/c5cc08918b","","","0.71073","MoKα","","0.0482","0.0314","","","0.063","0.0686","","","","","","1.018","","","","has coordinates,has disorder","175130","2020-10-21","18:00:00",""
"7118637","22.0554","0.0019","9.9627","0.0009","36.388","0.003","90","","93.738","0.002","90","","7978.6","1.2","122","2","122","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C65 H97 Cl11 Mo3 O3 P2 Pt Ru S5 -","- C65 H97 Cl11 Mo3 O3 P2 Pt Ru S5 -","- C260 H388 Cl44 Mo12 O12 P8 Pt4 Ru4 S20 -","4","1","","Reinholdt, Anders; Herbst, Konrad; Bendix, Jesper","Delivering carbide ligands to sulfide-rich clusters.","Chemical communications (Cambridge, England)","2016","52","10","2015","2018","10.1039/c5cc08918b","","","0.71073","MoKα","","0.0789","0.0553","","","0.1049","0.1117","","","","","","1.12","","","","has coordinates,has disorder","175130","2020-10-21","18:00:00",""
"7118638","13.8702","0.0004","17.6143","0.0005","23.8397","0.0008","80.295","0.001","75.255","0.001","83.949","0.001","5540","0.3","122","2","122","2","","","","","","","","9","P -1","-P 1","2","","","","- C94.65 H154.79 Cl12.35 O0.22 P4 Pd2 Ru2 S4 W3 -","- C94.648 H154.784 Cl12.352 O0.216 P4 Pd2 Ru2 S4 W3 -","- C189.296 H309.568 Cl24.704 O0.432 P8 Pd4 Ru4 S8 W6 -","2","1","","Reinholdt, Anders; Herbst, Konrad; Bendix, Jesper","Delivering carbide ligands to sulfide-rich clusters.","Chemical communications (Cambridge, England)","2016","52","10","2015","2018","10.1039/c5cc08918b","","","0.71073","MoKα","","0.0533","0.0359","","","0.0755","0.0839","","","","","","1.043","","","","has coordinates,has disorder","175130","2020-10-21","18:00:00",""
"7118639","22.1025","0.0017","9.9658","0.0008","36.424","0.003","90","","93.775","0.002","90","","8005.7","1.1","122","2","122","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C65 H97 Cl11 O3 P2 Pt Ru S5 W3 -","- C65 H97 Cl11 O3 P2 Pt Ru S5 W3 -","- C260 H388 Cl44 O12 P8 Pt4 Ru4 S20 W12 -","4","1","","Reinholdt, Anders; Herbst, Konrad; Bendix, Jesper","Delivering carbide ligands to sulfide-rich clusters.","Chemical communications (Cambridge, England)","2016","52","10","2015","2018","10.1039/c5cc08918b","","","0.71073","MoKα","","0.0814","0.052","","","0.0977","0.1056","","","","","","1.118","","","","has coordinates,has disorder","175130","2020-10-21","18:00:00",""
"7118640","9.636","0.003","17.256","0.005","18.491","0.007","91.1","0.014","97.986","0.016","99.976","0.012","2995.9","1.7","122","2","122","2","","","","","","","","10","P -1","-P 1","2","","","","- C47 H86.5 B Cl5 Cu F4 O0.75 P2 Ru S3 -","- C47 H86.5 B Cl5 Cu F4 O0.75 P2 Ru S3 -","- C94 H173 B2 Cl10 Cu2 F8 O1.5 P4 Ru2 S6 -","2","1","","Reinholdt, Anders; Herbst, Konrad; Bendix, Jesper","Delivering carbide ligands to sulfide-rich clusters.","Chemical communications (Cambridge, England)","2016","52","10","2015","2018","10.1039/c5cc08918b","","","0.71073","MoKα","","0.0691","0.0547","","","0.1475","0.1593","","","","","","1.03","","","","has coordinates,has disorder","175130","2020-10-21","18:00:00",""
"7118641","9.501","0.0004","22.3773","0.001","27.2642","0.0011","90","","90","","90","","5796.6","0.4","122","2","122","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C46.92 H84.77 Ag Cl3.08 F3 O3.64 P2 Ru S4 -","- C46.923 H84.769 Ag Cl3.077 F3 O3.641 P2 Ru S4 -","- C187.692 H339.076 Ag4 Cl12.308 F12 O14.564 P8 Ru4 S16 -","4","1","","Reinholdt, Anders; Herbst, Konrad; Bendix, Jesper","Delivering carbide ligands to sulfide-rich clusters.","Chemical communications (Cambridge, England)","2016","52","10","2015","2018","10.1039/c5cc08918b","","","0.71073","MoKα","","0.0678","0.0442","","","0.0823","0.0919","","","","","","1.051","","","","has coordinates,has disorder","175130","2020-10-21","18:00:00",""
"7118642","41.4694","0.0004","41.4694","0.0004","41.4694","0.0004","90","","90","","90","","71315.4","1.2","100","","100","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C84 H48 N6 Ni9 O41 -","- C84 H48 N6 Ni9 O41 -","- C1344 H768 N96 Ni144 O656 -","16","0.0833333","","Ren, Guo-Jian; Chang, Ze; Xu, Jian; Hu, Zhenpeng; Liu, Yan-Qing; Xu, Yue-Ling; Bu, Xian-He","Construction of a polyhedron decorated MOF with a unique network through the combination of two classic secondary building units.","Chemical communications (Cambridge, England)","2016","52","10","2079","2082","10.1039/c5cc08941g","","","1.54178","CuKα","","0.1638","0.1259","","","0.3492","0.3793","","","","","","1.218","","","","has coordinates","175131","2020-10-21","18:00:00",""
"7118652","19.6891","0.0018","13.7933","0.0013","26.276","0.002","90","","96.242","0.002","90","","7093.7","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","RPM6-Zn","Zn3(bpdc)3(apy)","","- C63.4 H56.57 N7.08 O15.08 Zn3 -","- C63.431 H56.633 N7.082 O15.082 Zn3 -","- C253.724 H226.532 N28.328 O60.328 Zn12 -","4","1","","Wang, Hao; Lashkari, Elham; Lim, Hyuna; Zheng, Chong; Emge, Thomas J.; Gong, Qihan; Yam, Kit; Li, Jing","The moisture-triggered controlled release of a natural food preservative from a microporous metal-organic framework.","Chemical communications (Cambridge, England)","2016","52","10","2129","2132","10.1039/c5cc09634k","","","0.71073","MoKα","","0.1473","0.0763","","","0.1719","0.2049","","","","","","1.023","","","","has coordinates,has disorder","175134","2020-10-21","18:00:00",""
"7118653","6.6015","0.0002","16.8605","0.0004","17.1484","0.0004","90","","90","","90","","1908.7","0.09","296","1","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","20150112","","- C18 H21 N O7 S -","- C18 H21 N O7 S -","- C72 H84 N4 O28 S4 -","4","1","","Son, Se-Mi; Seo, Yeon Ji; Lee, Hyeon-Kyu","Stereoselective synthesis of 1,3-disubstituted isoindolines via Rh(iii)-catalyzed tandem oxidative olefination-cyclization of 4-aryl cyclic sulfamidates.","Chemical communications (Cambridge, England)","2016","52","23","4286","4289","10.1039/c5cc09888b","","","0.71073","MoKα","","0.1579","0.067","","","0.1734","0.2193","","","","","","1.015","","","","has coordinates","181572","2020-10-21","18:00:00",""
"7118654","6.2084","0.0001","13.742","0.0002","21.5303","0.0004","90","","90","","90","","1836.88","0.05","296","1","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","20150429","","- C17 H19 N O7 S -","- C17 H19 N O7 S -","- C68 H76 N4 O28 S4 -","4","1","","Son, Se-Mi; Seo, Yeon Ji; Lee, Hyeon-Kyu","Stereoselective synthesis of 1,3-disubstituted isoindolines via Rh(iii)-catalyzed tandem oxidative olefination-cyclization of 4-aryl cyclic sulfamidates.","Chemical communications (Cambridge, England)","2016","52","23","4286","4289","10.1039/c5cc09888b","","","0.71073","MoKα","","0.1195","0.0618","","","0.1407","0.1629","","","","","","1.03","","","","has coordinates","181572","2020-10-21","18:00:00",""
"7118655","8.1628","0.0002","8.1111","0.0001","17.0276","0.0003","90","","90.533","0.001","90","","1127.34","0.04","296","1","296","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","sulfamidate+acrylronitrile","","- C11 H10 N2 O3 S -","- C11 H10 N2 O3 S -","- C44 H40 N8 O12 S4 -","4","1","","Son, Se-Mi; Seo, Yeon Ji; Lee, Hyeon-Kyu","Stereoselective synthesis of 1,3-disubstituted isoindolines via Rh(iii)-catalyzed tandem oxidative olefination-cyclization of 4-aryl cyclic sulfamidates.","Chemical communications (Cambridge, England)","2016","52","23","4286","4289","10.1039/c5cc09888b","","","0.71073","MoKα","","0.0416","0.0363","","","0.1005","0.1051","","","","","","1.08","","","","has coordinates","181572","2020-10-21","18:00:00",""
"7118656","6.1638","0.0003","14.6526","0.0007","9.1812","0.0004","90","","102.564","0.003","90","","809.35","0.07","100","1","100","1","","","","","","","","5","P 1 21 1","P 2yb","4","","3a-methylacrylate","","- C16 H17 N O7 S -","- C16 H17 N O7 S -","- C32 H34 N2 O14 S2 -","2","1","","Son, Se-Mi; Seo, Yeon Ji; Lee, Hyeon-Kyu","Stereoselective synthesis of 1,3-disubstituted isoindolines via Rh(iii)-catalyzed tandem oxidative olefination-cyclization of 4-aryl cyclic sulfamidates.","Chemical communications (Cambridge, England)","2016","52","23","4286","4289","10.1039/c5cc09888b","","","0.71073","MoKα","","0.046","0.0401","","","0.1037","0.1079","","","","","","1.038","","","","has coordinates","181572","2020-10-21","18:00:00",""
"7118657","7.3985","0.0009","19.856","0.002","35.447","0.004","90","","90","","90","","5207.3","1","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","VD23","","","- C55 H88 O2 -","- C55 H88 O2 -","- C220 H352 O8 -","4","1","","Wang, Jian-Rong; Yu, Qihui; Dai, Wenjuan; Mei, Xuefeng","Drug-drug co-crystallization presents a new opportunity for the development of stable vitamins.","Chemical communications (Cambridge, England)","2016","52","17","3572","3575","10.1039/c5cc10297a","","","0.71073","MoKα","","0.1325","0.0666","","","0.1649","0.2027","","","","","","1.064","","","","has coordinates","177703","2020-10-21","18:00:00",""
"7118658","20.6101","0.0006","7.2054","0.0003","35.408","0.001","90","","105.513","0.002","90","","5066.7","0.3","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","Co-VD form B","vitamin D2 and D3","","- C55 H88 O2 -","- C55 H88 O2 -","- C220 H352 O8 -","4","2","","Wang, Jian-Rong; Yu, Qihui; Dai, Wenjuan; Mei, Xuefeng","Drug-drug co-crystallization presents a new opportunity for the development of stable vitamins.","Chemical communications (Cambridge, England)","2016","52","17","3572","3575","10.1039/c5cc10297a","","","0.71073","MoKα","","0.157","0.097","","","0.2307","0.2583","","","","","","1.19","","","","has coordinates","183084","2020-10-21","18:00:00",""
"7118659","13.4817","0.0009","41.726","0.002","31.034","0.003","90","","90","","90","","17458","2","90","2","90","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","5-mesityl-N,N-bis(alpha-bromodipyrrinyl)amine Cu(II)","","- C49 H51 Br2 Cu N5 -","- C49 H51 Br2 Cu N5 -","- C784 H816 Br32 Cu16 N80 -","16","4","","Omori, Hiroto; Hiroto, Satoru; Shinokubo, Hiroshi","The synthesis of Ni(II) and Al(III) 10-azacorroles through coordination-induced cyclisation involving 1,2-migration.","Chemical communications (Cambridge, England)","2016","52","17","3540","3543","10.1039/c5cc10247b","","","0.71073","","","0.1351","0.0798","","","0.1796","0.208","","","","","","1.023","","","","has coordinates","177708","2020-10-21","18:00:00",""
"7118660","16.489","0.002","20.454","0.003","12.894","0.002","90","","111.783","0.004","90","","4038.2","1","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-bromo-10-azacorrole","","- C45 H39.5 Br1.5 Cl2 N5 Ni -","- C45 H39.443 Br1.557 Cl2 N5 Ni -","- C180 H157.772 Br6.228 Cl8 N20 Ni4 -","4","1","","Omori, Hiroto; Hiroto, Satoru; Shinokubo, Hiroshi","The synthesis of Ni(II) and Al(III) 10-azacorroles through coordination-induced cyclisation involving 1,2-migration.","Chemical communications (Cambridge, England)","2016","52","17","3540","3543","10.1039/c5cc10247b","","","0.71073","MoKα","","0.1568","0.0978","","","0.2854","0.3347","","","","","","1.051","","","","has coordinates,has disorder","177708","2020-10-21","18:00:00",""
"7118661","7.433","0.0006","11.831","0.0008","12.3401","0.0014","75.797","0.007","83.716","0.008","89.257","0.006","1045.59","0.17","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C7 H8 Cl3 Sb -","- C7 H8 Cl3 Sb -","- C28 H32 Cl12 Sb4 -","4","2","","Lo, Rabindranath; Švec, Petr; Růžičková, Zdeňka; Růžička, Aleš; Hobza, Pavel","On the nature of the stabilisation of the Eπ pnicogen bond in the SbCl3toluene complex.","Chemical communications (Cambridge, England)","2016","52","17","3500","3503","10.1039/c5cc10363k","","","0.71073","MoKα","","0.045","0.0395","","","0.1064","0.1145","","","","","","1.185","","","","has coordinates","177709","2020-10-21","18:00:00",""
"7118662","13.8731","0.001","8.1105","0.0005","23.2586","0.0018","90","","111.782","0.009","90","","2430.2","0.3","294.39","0.1","294.39","0.1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C128 H112 O16 -","8","1","","Sun, Denan; Li, Bijin; Lan, Jingbo; Huang, Quan; You, Jingsong","Chelation-assisted Pd-catalysed ortho-selective oxidative C-H/C-H cross-coupling of aromatic carboxylic acids with arenes and intramolecular Friedel-Crafts acylation: one-pot formation of fluorenones.","Chemical communications (Cambridge, England)","2016","52","18","3635","3638","10.1039/c6cc00103c","","x-ray","1.54184","CuKα","","0.0632","0.059","","","0.1586","0.1649","","","","","","1.052","","","","has coordinates","177644","2020-10-21","18:00:00",""
"7118663","7.2744","0.0003","11.9968","0.0005","12.4989","0.0006","90","","99.099","0.004","90","","1077.05","0.08","285.16","0.1","285.16","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 F2 O2 -","- C14 H8 F2 O2 -","- C56 H32 F8 O8 -","4","1","","Sun, Denan; Li, Bijin; Lan, Jingbo; Huang, Quan; You, Jingsong","Chelation-assisted Pd-catalysed ortho-selective oxidative C-H/C-H cross-coupling of aromatic carboxylic acids with arenes and intramolecular Friedel-Crafts acylation: one-pot formation of fluorenones.","Chemical communications (Cambridge, England)","2016","52","18","3635","3638","10.1039/c6cc00103c","","x-ray","0.71073","MoKα","","0.0654","0.0511","","","0.1468","0.1597","","","","","","1.066","","","","has coordinates","177644","2020-10-21","18:00:00",""
"7118664","26.1535","0.001","13.6168","0.0005","17.1807","0.0007","90","","126.056","0.003","90","","4946.5","0.4","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H32 B2 Co2 N16 O11 -","- C30 H32 B2 Co2 N16 O11 -","- C120 H128 B8 Co8 N64 O44 -","4","0.5","","Zhang, Hai-Xia; Liu, Min; Xu, Guilan; Liu, Liyang; Zhang, Jian","Selectivity of CO2via pore space partition in zeolitic boron imidazolate frameworks.","Chemical communications (Cambridge, England)","2016","52","17","3552","3555","10.1039/c6cc00185h","","","0.71073","MoKα","","0.1113","0.0717","","","0.2146","0.2375","","","","","","1.012","","","","has coordinates","177704","2020-10-21","18:00:00",""
"7118665","9.003","0.005","17.382","0.011","17.057","0.011","90","","104.595","0.01","90","","2583","3","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 B Cd N9 O4 -","- C21 H24 B Cd N9 O4 -","- C84 H96 B4 Cd4 N36 O16 -","4","1","","Zhang, Hai-Xia; Liu, Min; Xu, Guilan; Liu, Liyang; Zhang, Jian","Selectivity of CO2via pore space partition in zeolitic boron imidazolate frameworks.","Chemical communications (Cambridge, England)","2016","52","17","3552","3555","10.1039/c6cc00185h","","","0.71073","MoKα","","0.0764","0.0635","","","0.185","0.1942","","","","","","1.122","","","","has coordinates","177704","2020-10-21","18:00:00",""
"7118666","16.682","0.003","21.662","0.004","27.674","0.005","90","","96.49","0.03","90","","9936","3","293","2","293","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C111 H220 Cu18 N30 O42 S20 W5 -","- C111 H96 Cu18 N30 O42 S20 W5 -","- C222 H192 Cu36 N60 O84 S40 W10 -","2","0.5","","Zhang, Jinfang; Jia, Ding; Humphrey, Mark G.; Meng, Suci; Zaworotko, Michael J.; Cifuentes, Marie P.; Zhang, Chi","Ammonium-crown ether supramolecular cation-templated assembly of an unprecedented heterobicluster-metal coordination polymer with enhanced NLO properties.","Chemical communications (Cambridge, England)","2016","52","19","3797","3800","10.1039/c5cc10076c","","","0.71073","MoKα","","0.0795","0.069","","","0.151","0.1586","","","","","","0.998","","","","has coordinates","177699","2020-10-21","18:00:00",""
"7118667","20.0748","0.0004","26.1979","0.0006","28.8126","0.0006","104.876","0.002","90.485","0.002","92.908","0.002","14622.7","0.6","373","2","373","2","","","","","","","","9","P -1","-P 1","2","","","","- C176 H266 Ag41 B0 F0 N7 O78 Si2 W22 -","- C176 H264 Ag41 N7 O78 Si2 W22 -","- C352 H528 Ag82 N14 O156 Si4 W44 -","2","1","","Liu, Kuan-Guan; Liu, Xi-Yan; Guan, Zong-Jie; Shi, Kang; Lin, Yu-Mei; Wang, Quan-Ming","The transformation of polyoxometalates in the formation of intercluster compound [Ag41(α-SiW10O37)((t)BuC[triple bond, length as m-dash]C)27(CH3CN)3][β-SiW12O40].","Chemical communications (Cambridge, England)","2016","52","19","3801","3804","10.1039/c6cc00524a","","","0.71073","MoKα","","0.0989","0.0689","","","0.17","0.1909","","","","","","1.029","","","","has coordinates","177700","2020-10-21","18:00:00",""
"7118668","9.002","0.002","13.225","0.003","17.293","0.004","90","","90","","90","","2058.8","0.8","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 N O -","- C29 H21 N O -","- C116 H84 N4 O4 -","4","1","","Nagaraju Barsu; Malay Sen; J. Richard Premkumar; Basker Sundararaju","Cobalt(III) catalyzed C-8 selective C-H and C-O coupling of quinoline N-oxide with internal alkynes via C-H activation and oxygen atom transfer","Chem.Commun.","2016","52","","1338","","","","","0.71073","MoKα","","0.0624","0.0451","","","0.0966","0.1162","","","","","","1.07","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7118673","12.7434","0.0003","13.7696","0.0003","16.4706","0.0004","90","","90","","90","","2890.12","0.12","180","2","180","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C18 H44 Al B Cl4 N2 O6 -","- C18 H44 Al B Cl4 N2 O6 -","- C72 H176 Al4 B4 Cl16 N8 O24 -","4","1","","Less, Robert J.; García-Rodríguez, Raúl; Simmonds, Hayley R.; Allen, Lucy K.; Bond, Andrew D.; Wright, Dominic S.","Use of crown ethers to isolate intermediates in ammonia-borane dehydrocoupling reactions.","Chemical communications (Cambridge, England)","2016","52","18","3650","3652","10.1039/c6cc00088f","","","1.54178","CuKα","","0.0412","0.0319","","","0.0681","0.0717","","","","","","1.063","","","","has coordinates","177643","2020-10-21","18:00:00",""
"7118674","19.0847","0.0007","16.0369","0.0006","8.8244","0.0003","90","","90","","90","","2700.79","0.17","180","2","180","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C16 H37 Al B Cl4 N O7 -","- C16 H37 Al B Cl4 N O7 -","- C64 H148 Al4 B4 Cl16 N4 O28 -","4","1","","Less, Robert J.; García-Rodríguez, Raúl; Simmonds, Hayley R.; Allen, Lucy K.; Bond, Andrew D.; Wright, Dominic S.","Use of crown ethers to isolate intermediates in ammonia-borane dehydrocoupling reactions.","Chemical communications (Cambridge, England)","2016","52","18","3650","3652","10.1039/c6cc00088f","","","1.54178","CuKα","","0.1032","0.0987","","","0.2169","0.2191","","","","","","1.424","","","","has coordinates","177643","2020-10-21","18:00:00",""
"7118675","13.6132","0.0005","16.0212","0.0006","17.7762","0.0007","90","","94.329","0.002","90","","3865.9","0.3","180","2","180","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C24 H56 Al B Cl4 N2 O12 -","- C24 H56 Al B Cl4 N2 O12 -","- C96 H224 Al4 B4 Cl16 N8 O48 -","4","2","","Less, Robert J.; García-Rodríguez, Raúl; Simmonds, Hayley R.; Allen, Lucy K.; Bond, Andrew D.; Wright, Dominic S.","Use of crown ethers to isolate intermediates in ammonia-borane dehydrocoupling reactions.","Chemical communications (Cambridge, England)","2016","52","18","3650","3652","10.1039/c6cc00088f","","","1.54178","CuKα","","0.0821","0.0747","","","0.1859","0.1941","","","","","","1.085","","","","has coordinates","177643","2020-10-21","18:00:00",""
"7118676","11.9458","0.0004","12.6538","0.0004","25.2208","0.0008","90","","90","","90","","3812.4","0.2","100","2","100","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C24 H26 N2 -","- C24 H26 N2 -","- C192 H208 N16 -","8","1","","Hepburn, Hamish B.; Melchiorre, Paolo","Brønsted acid-catalysed conjugate addition of photochemically generated α-amino radicals to alkenylpyridines.","Chemical communications (Cambridge, England)","2016","52","17","3520","3523","10.1039/c5cc10401g","","","0.71073","MoKα","","0.081","0.0486","","","0.1099","0.1258","","","","","","1.035","","","","has coordinates","177707","2020-10-21","18:00:00",""
"7118677","4.9957","0.0003","17.7935","0.0009","20.4746","0.001","90","","90","","90","","1820.01","0.17","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","ECI5017","[(2S,3S,5R)-3-amino-5-(5-methyl-4-oxo-2-thioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl acetate","","- C13 H18 Cl3 N3 O4 S -","- C13 H18 Cl3 N3 O4 S -","- C52 H72 Cl12 N12 O16 S4 -","4","1","","Izgu, Enver Cagri; Oh, Seung Soo; Szostak, Jack W.","Synthesis of activated 3'-amino-3'-deoxy-2-thio-thymidine, a superior substrate for the nonenzymatic copying of nucleic acid templates.","Chemical communications (Cambridge, England)","2016","52","18","3684","3686","10.1039/c5cc10317g","","","1.54178","CuKα","","0.0873","0.079","","","0.2088","0.2142","","","","","","1.084","","","","has coordinates,has disorder","177647","2020-10-21","18:00:00",""
"7118678","21.7015","0.0012","21.7015","0.0012","21.7015","0.0012","90","","90","","90","","10220.4","1","223","2","223","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","","","- C48 Cu16 Se31 Sn6 -","- C48 Cu16 Se31 Sn6 -","- C192 Cu64 Se124 Sn24 -","4","0.166667","","Yang, Huajun; Wang, Le; Hu, Dandan; Lin, Jian; Luo, Li; Wang, Hongxiang; Wu, Tao","A novel copper-rich open-framework chalcogenide constructed from octahedral Cu4Se6 and icosahedral Cu8Se13 nanoclusters.","Chemical communications (Cambridge, England)","2016","52","22","4140","4143","10.1039/c6cc00183a","","","0.71073","MoKα","","0.1097","0.0759","","","0.1772","0.2228","","","","","","1.098","","","","has coordinates","181525","2020-10-21","18:00:00",""
"7118679","6.9802","0.0007","7.0738","0.0007","17.9149","0.0018","88.122","0.001","80.589","0.001","67.293","0.001","804.58","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2,2-dichloro-2-nitro-1-(2-nitrophenyl)ethyl benzoate","","- C15 H10 Cl2 N2 O6 -","- C15 H10 Cl2 N2 O6 -","- C30 H20 Cl4 N4 O12 -","2","1","","Ding, Ransheng; Wolf, Christian","Catalytic insertion of aldehydes into dihalonitroacetophenones via sequential bond scission-aldol reaction-acyl transfer.","Chemical communications (Cambridge, England)","2016","52","17","3576","3579","10.1039/c5cc09753c","","","0.71073","MoKα","","0.0327","0.0315","","","0.1024","0.1038","","","","","","1.107","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7118680","7.0035","0.0005","37.401","0.003","6.0429","0.0004","90","","90","","90","","1582.9","0.2","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2,2-dichloro-2-nitro-1-(4-nitrophenyl)ethyl benzoate","","- C15 H10 Cl2 N2 O6 -","- C15 H10 Cl2 N2 O6 -","- C60 H40 Cl8 N8 O24 -","4","1","","Ding, Ransheng; Wolf, Christian","Catalytic insertion of aldehydes into dihalonitroacetophenones via sequential bond scission-aldol reaction-acyl transfer.","Chemical communications (Cambridge, England)","2016","52","17","3576","3579","10.1039/c5cc09753c","","","0.71073","MoKα","","0.0278","0.0264","","","0.0661","0.0668","","","","","","1.037","","","","has coordinates","177705","2020-10-21","18:00:00",""
"7118681","9.8573","0.0012","10.9843","0.0013","19.208","0.002","93.409","0.003","98.295","0.003","115.316","0.003","1843.2","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H50 N3 P Si -","- C39 H50 N3 P Si -","- C78 H100 N6 P2 Si2 -","2","1","","Khan, Shabana; Pal, Shiv; Kathewad, Neha; Purushothaman, Indu; De, Susmita; Parameswaran, Pattiyil","Stepwise isolation of an unprecedented silylene supported dinuclear gold(i) cation with aurophilic interaction.","Chemical communications (Cambridge, England)","2016","52","20","3880","3882","10.1039/c6cc00597g","","","0.71073","MoKα","","0.1082","0.0541","","","0.1205","0.1462","","","","","","0.95","","","","has coordinates","177676","2020-10-21","18:00:00",""
"7118682","11.933","0.011","12.334","0.013","17.499","0.016","81.27","0.03","82.82","0.02","65.87","0.02","2318","4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H52 Au Cl3 N3 P Si -","- C40 H52 Au Cl3 N3 P Si -","- C80 H104 Au2 Cl6 N6 P2 Si2 -","2","1","","Khan, Shabana; Pal, Shiv; Kathewad, Neha; Purushothaman, Indu; De, Susmita; Parameswaran, Pattiyil","Stepwise isolation of an unprecedented silylene supported dinuclear gold(i) cation with aurophilic interaction.","Chemical communications (Cambridge, England)","2016","52","20","3880","3882","10.1039/c6cc00597g","","","0.71073","MoKα","","0.0982","0.0752","","","0.2087","0.2296","","","","","","1.047","","","","has coordinates","177676","2020-10-21","18:00:00",""
"7118683","12.058","0.006","14.762","0.009","15.001","0.009","116.997","0.014","104.713","0.014","95.716","0.014","2229","2","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C80 H104 Au2 Cl4 F12 N6 P2 Sb2 Si2 -","- C80 H104 Au2 Cl4 F12 N6 P2 Sb2 Si2 -","- C80 H104 Au2 Cl4 F12 N6 P2 Sb2 Si2 -","1","0.5","","Khan, Shabana; Pal, Shiv; Kathewad, Neha; Purushothaman, Indu; De, Susmita; Parameswaran, Pattiyil","Stepwise isolation of an unprecedented silylene supported dinuclear gold(i) cation with aurophilic interaction.","Chemical communications (Cambridge, England)","2016","52","20","3880","3882","10.1039/c6cc00597g","","","0.71073","MoKα","","0.0985","0.0571","","","0.1046","0.121","","","","","","1.028","","","","has coordinates","177676","2020-10-21","18:00:00",""
"7118684","17.0258","0.0007","18.6108","0.0008","19.0877","0.0008","90","","90","","90","","6048.2","0.4","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H44 P2 Pd Si -","- C31 H44 P2 Pd Si -","- C248 H352 P16 Pd8 Si8 -","8","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0249","0.0235","","","0.0574","0.058","","","","","","1.194","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118685","9.402","0.003","19.186","0.005","19.053","0.005","90","","93.284","0.005","90","","3431.3","1.7","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H48 P2 Pd Si -","- C37 H48 P2 Pd Si -","- C148 H192 P8 Pd4 Si4 -","4","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0495","0.0316","","","0.0656","0.0694","","","","","","1.026","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118686","9.5894","0.0006","10.6642","0.0007","19.5486","0.0013","78.851","0.003","76.192","0.003","76.697","0.002","1868.9","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H52 P2 Pd Si -","- C43 H52 P2 Pd Si -","- C86 H104 P4 Pd2 Si2 -","2","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0443","0.0333","","","0.0732","0.0772","","","","","","1.049","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118687","11.401","0.002","12.592","0.002","30.423","0.005","90","","97.666","0.003","90","","4328.5","1.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H64 P2 Pd Si -","- C48 H64 P2 Pd Si -","- C192 H256 P8 Pd4 Si4 -","4","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0684","0.0412","","","0.0852","0.0983","","","","","","1.066","","","","has coordinates,has disorder","185097","2020-10-21","18:00:00",""
"7118688","17.3966","0.001","10.0819","0.0006","19.8141","0.0011","90","","115.896","0.0018","90","","3126.3","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H49 B O2 P2 Pd -","- C31 H49 B O2 P2 Pd -","- C124 H196 B4 O8 P8 Pd4 -","4","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0237","0.0203","","","0.0513","0.0528","","","","","","1.065","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118689","8.3636","0.0003","10.0092","0.0004","18.4078","0.0007","94.2185","0.0011","93.3363","0.0011","100.776","0.0011","1505.62","0.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H44 Ge P2 Pd -","- C31 H44 Ge P2 Pd -","- C62 H88 Ge2 P4 Pd2 -","2","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0412","0.034","","","0.0693","0.0725","","","","","","1.076","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118690","22.9918","0.0015","12.0605","0.0007","25.6249","0.0017","90","","105.728","0.004","90","","6839.6","0.8","120","2","120","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C37 H48 Ge P2 Pd -","- C37 H48 Ge P2 Pd -","- C296 H384 Ge8 P16 Pd8 -","8","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0495","0.0337","","","0.0735","0.0776","","","","","","1.052","","","","has coordinates,has disorder","185097","2020-10-21","18:00:00",""
"7118691","11.6399","0.0015","19.396","0.003","17.6306","0.0018","90","","105.713","0.002","90","","3831.7","0.9","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H52 Ge P2 Pd -","- C43 H52 Ge P2 Pd -","- C172 H208 Ge4 P8 Pd4 -","4","1","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0976","0.0499","","","0.0946","0.1041","","","","","","0.986","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118692","9.543","0.0004","20.387","0.001","21.3674","0.0011","90","","99.3602","0.0014","90","","4101.7","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C85 H114 Ge2 P6 Pd2 -","- C85 H114 Ge2 P6 Pd2 -","- C170 H228 Ge4 P12 Pd4 -","2","0.5","","Comanescu, Cezar C.; Iluc, Vlad M.","E-H (E = B, Si, Ge) bond activation of pinacolborane, silanes, and germanes by nucleophilic palladium carbene complexes.","Chemical communications (Cambridge, England)","2016","52","58","9048","9051","10.1039/c5cc09468b","","","0.71073","MoKα","","0.0369","0.0296","","","0.0661","0.0681","","","","","","1.062","","","","has coordinates","185097","2020-10-21","18:00:00",""
"7118693","10.3517","0.0008","17.5995","0.0015","13.2555","0.0011","90","","103.504","0.002","90","","2348.2","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H23 Br N2 O4 S -","- C22 H23 Br N2 O4 S -","- C88 H92 Br4 N8 O16 S4 -","4","2","","Cheng, Ping; Guo, Wengang; Chen, Ping; Liu, Yan; Du, Xin; Li, Can","The enantioselective construction of chiral spirooxindole-based 4-thiazolidinone via asymmetric catalytic formal [3+2] annulation using a bifunctional catalyst.","Chemical communications (Cambridge, England)","2016","52","16","3418","3421","10.1039/c5cc10292h","","","0.71073","MoKα","","0.1506","0.0613","","","0.1187","0.1528","","","","","","0.947","","","","has coordinates,has disorder","177673","2020-10-21","18:00:00",""
"7118694","9.0059","0.0011","12.9439","0.0015","18.305","0.002","90","","90","","90","","2133.8","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H21 Br N2 O5 S -","- C22 H21 F N2 O5 S -","- C88 H84 F4 N8 O20 S4 -","4","1","","Cheng, Ping; Guo, Wengang; Chen, Ping; Liu, Yan; Du, Xin; Li, Can","The enantioselective construction of chiral spirooxindole-based 4-thiazolidinone via asymmetric catalytic formal [3+2] annulation using a bifunctional catalyst.","Chemical communications (Cambridge, England)","2016","52","16","3418","3421","10.1039/c5cc10292h","","","0.71073","MoKα","","0.0491","0.0425","","","0.1033","0.1081","","","","","","1.022","","","","has coordinates","177673","2020-10-21","18:00:00",""
"7118695","17.663","0.0004","18.6473","0.0006","23.0752","0.0008","90","","107.032","0.001","90","","7266.9","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C79 H114 Co2 N4 -","- C79 H114 Co2 N4 -","- C316 H456 Co8 N16 -","4","1","","Andjaba, John M.; Tye, Jesse W.; Yu, Pony; Pappas, Iraklis; Bradley, Christopher A.","Cp*Co(IPr): synthesis and reactivity of an unsaturated Co(i) complex.","Chemical communications (Cambridge, England)","2016","52","12","2469","2472","10.1039/c5cc06756a","","","0.71073","MoKα","","0.0856","0.0542","","","0.1338","0.1537","","","","","","0.953","","","","has coordinates,has disorder","175440","2020-10-21","18:00:00",""
"7118696","23.5831","0.0006","17.9998","0.0005","16.1483","0.0004","90","","90","","90","","6854.8","0.3","100","2","100","","","","","","","","","5","A e a 2","A 2 -2ab","41","","","","- C38 H51 Co N2 O -","- C38 H51 Co N2 O -","- C304 H408 Co8 N16 O8 -","8","1","","Andjaba, John M.; Tye, Jesse W.; Yu, Pony; Pappas, Iraklis; Bradley, Christopher A.","Cp*Co(IPr): synthesis and reactivity of an unsaturated Co(i) complex.","Chemical communications (Cambridge, England)","2016","52","12","2469","2472","10.1039/c5cc06756a","","","1.54178","CuKα","","0.0664","0.0565","","","0.1357","0.1448","","","","","","0.9884","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7118697","30.549","","30.549","","11.026","","90","","90","","120","","8911.33","","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C49 H32 Cl2 N4 -","- C48 H30 N4 -","- C432 H270 N36 -","9","0.5","","Feng, Cunfang; Wang, Kai; Xu, Yuanxiang; Liu, Liqun; Zou, Bo; Lu, Ping","Unique piezochromic fluorescence behavior of organic crystal of carbazole-substituted CNDSB.","Chemical communications (Cambridge, England)","2016","52","19","3836","3839","10.1039/c5cc09152g","","","0.71069","MoKα","","0.0791","0.0568","","","0.1875","0.2098","","","","","","1.098","","","","has coordinates","204120","2020-10-21","18:00:00",""
"7118698","26.108","0.002","8.7687","0.0007","21.6124","0.0018","90","","112.199","0.002","90","","4581.1","0.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 Br2 N4 -","- C28 H22 Br2 N4 -","- C224 H176 Br16 N32 -","8","1","","Xiong, Ruisheng; Arkhypchuk, Anna I.; Kovacs, Daniel; Orthaber, Andreas; Eszter Borbas, K.","Directly linked hydroporphyrin dimers.","Chemical communications (Cambridge, England)","2016","52","58","9056","9058","10.1039/c6cc00516k","","","0.71073","MoKα","","0.0321","0.024","","","0.0538","0.0567","","","","","","1.049","","","","has coordinates","185103","2020-10-21","18:00:00",""
"7118699","8.5776","0.0003","11.6804","0.0004","14.133","0.0005","98.609","0.0017","98.743","0.0017","101.874","0.0016","1345.4","0.08","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H35 Cl Ir N O2 -","- C29 H35 Cl Ir N O2 -","- C58 H70 Cl2 Ir2 N2 O4 -","2","1","","Mukhopadhyay, Sujay; Singh, Roop Shikha; Biswas, Arnab; Pandey, Daya Shankar","Photochemical water oxidation by cyclometalated iridium(iii) complexes: a mechanistic insight.","Chemical communications (Cambridge, England)","2016","52","19","3840","3843","10.1039/c5cc10520j","","","0.71073","MoKα","","0.0234","0.02","","","0.0485","0.0502","","","","","","1.031","","","","has coordinates","177702","2020-10-21","18:00:00",""
"7118700","8.4227","0.0017","11.622","0.002","13.821","0.003","100.173","0.006","98.473","0.005","99.561","0.007","1291.2","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H32 Cl Ir N2 -","- C28 H32 Cl Ir N2 -","- C56 H64 Cl2 Ir2 N4 -","2","1","","Mukhopadhyay, Sujay; Singh, Roop Shikha; Biswas, Arnab; Pandey, Daya Shankar","Photochemical water oxidation by cyclometalated iridium(iii) complexes: a mechanistic insight.","Chemical communications (Cambridge, England)","2016","52","19","3840","3843","10.1039/c5cc10520j","","","0.71073","MoKα","","0.0255","0.0208","","","0.05","0.0522","","","","","","0.998","","","","has coordinates,has disorder","177702","2020-10-21","18:00:00",""
"7118701","6.2612","0.0003","15.4368","0.0008","6.6118","0.0004","90","","96.285","0.002","90","","635.21","0.06","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","(E)-Me2I2TTF","","- C8 H6 I2 S4 -","- C8 H6 I2 S4 -","- C16 H12 I4 S8 -","2","0.5","","Jeannin, Olivier; Canadell, Enric; Auban-Senzier, Pascale; Fourmigué, Marc","Correlating conduction properties with the molecular symmetry: segregation of Z and E isomers in the charge-assisted, halogen-bonded cocrystal [(Z,E)-Me2I2TTF]2Br.","Chemical communications (Cambridge, England)","2016","52","2","308","311","10.1039/c5cc08176a","","x-ray","0.71073","MoKα","","0.0388","0.0374","","","0.0923","0.0931","","","","","","1.177","","","","has coordinates,has disorder","175841","2020-10-21","18:00:00",""
"7118702","7.888","0.002","27.12","0.007","14.215","0.004","90","","95.259","0.01","90","","3028.1","1.4","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","[(Z,E)Me2I2TTF]2 Br CH3CN","","- C18 H15 Br I4 N S8 -","- C18 H15 Br I4 N S8 -","- C72 H60 Br4 I16 N4 S32 -","4","1","","Jeannin, Olivier; Canadell, Enric; Auban-Senzier, Pascale; Fourmigué, Marc","Correlating conduction properties with the molecular symmetry: segregation of Z and E isomers in the charge-assisted, halogen-bonded cocrystal [(Z,E)-Me2I2TTF]2Br.","Chemical communications (Cambridge, England)","2016","52","2","308","311","10.1039/c5cc08176a","","x-ray","0.71073","MoKα","","0.0908","0.0536","","","0.1143","0.142","","","","","","1.061","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7118703","9.814","0.004","10.84","0.004","23.074","0.009","90","","95.566","0.006","90","","2443.1","1.6","130","","130","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 N2 O5 S -","- C26 H32 N2 O5 S -","- C104 H128 N8 O20 S4 -","4","1","","Yang, Jin-Ming; Li, Peng-Hua; Wei, Yin; Tang, Xiang-Ying; Shi, Min","Gold(i)-catalyzed highly stereoselective synthesis of polycyclic indolines: the construction of four contiguous stereocenters.","Chemical communications (Cambridge, England)","2016","52","2","346","349","10.1039/c5cc08381h","","","0.71073","MoKα","","0.1101","0.0766","","","0.1627","0.1787","","","","","","1.115","","","","has coordinates","175842","2020-10-21","18:00:00",""
"7118704","9.5226","0.0008","36.221","0.003","24.769","0.002","90","","99.375","0.002","90","","8429.2","1.2","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 N2 O4 S -","- C23 H24 N2 O4 S -","- C368 H384 N32 O64 S16 -","16","4","","Yang, Jin-Ming; Li, Peng-Hua; Wei, Yin; Tang, Xiang-Ying; Shi, Min","Gold(i)-catalyzed highly stereoselective synthesis of polycyclic indolines: the construction of four contiguous stereocenters.","Chemical communications (Cambridge, England)","2016","52","2","346","349","10.1039/c5cc08381h","","","0.71073","MoKα","","0.14","0.0541","","","0.1001","0.1337","","","","","","1.015","","","","has coordinates","175842","2020-10-21","18:00:00",""
"7118705","28.98","0.004","28.98","0.004","40.961","0.008","90","","90","","90","","34401","9","100","2","100","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C288 H288 Cu12 O108 Pd12 -","- C288 H288 Cu12 O108 Pd12 -","- C576 H576 Cu24 O216 Pd24 -","2","0.125","","Teo, Jesse M.; Coghlan, Campbell J.; Evans, Jack D.; Tsivion, Ehud; Head-Gordon, Martin; Sumby, Christopher J.; Doonan, Christian J.","Hetero-bimetallic metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","2","276","279","10.1039/c5cc08336b","","","0.71073","Synchrotron","","0.1087","0.0948","","","0.2606","0.2726","","","","","","1.04","","","","has coordinates,has disorder","175843","2020-10-21","18:00:00",""
"7118706","29.174","0.004","29.174","0.004","41.296","0.008","90","","90","","90","","35148","10","100","2","100","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C288 H288 Ni12 O108 Pd12 -","- C288 H288 Ni12 O108 Pd12 -","- C576 H576 Ni24 O216 Pd24 -","2","0.125","","Teo, Jesse M.; Coghlan, Campbell J.; Evans, Jack D.; Tsivion, Ehud; Head-Gordon, Martin; Sumby, Christopher J.; Doonan, Christian J.","Hetero-bimetallic metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","2","276","279","10.1039/c5cc08336b","","","0.71073","Synchrotron","","0.0833","0.069","","","0.2067","0.2183","","","","","","1.072","","","","has coordinates,has disorder","175843","2020-10-21","18:00:00",""
"7118707","28.935","0.004","28.935","0.004","41.164","0.008","90","","90","","90","","34464","10","100","2","100","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C288 H288 O108 Pd12 Zn12 -","- C288 H288 O108 Pd12 Zn12 -","- C576 H576 O216 Pd24 Zn24 -","2","0.125","","Teo, Jesse M.; Coghlan, Campbell J.; Evans, Jack D.; Tsivion, Ehud; Head-Gordon, Martin; Sumby, Christopher J.; Doonan, Christian J.","Hetero-bimetallic metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","2","276","279","10.1039/c5cc08336b","","","0.71073","Synchrotron","","0.0919","0.0775","","","0.2233","0.2354","","","","","","1.043","","","","has coordinates,has disorder","175843","2020-10-21","18:00:00",""
"7118708","26.8876","0.0003","16.8644","0.0002","25.0129","0.0003","90","","95.248","0.001","90","","11294.4","0.2","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C65.5 H54 N3 O7.75 Tb -","- C65 H45.5 N3 O7.75 Tb -","- C520 H364 N24 O62 Tb8 -","8","2","","Zhang, Zhao; He, Ya-Ni; Liu, Lin; Lü, Xing-Qiang; Zhu, Xun-Jin; Wong, Wai-Kwok; Pan, Mei; Su, Cheng-Yong","Pure white-light and colour-tuning of Eu(3+)-Gd(3+)-containing metallopolymer.","Chemical communications (Cambridge, England)","2016","52","18","3713","3716","10.1039/c5cc09946c","","","0.71073","MoKα","","0.103","0.0781","","","0.2335","0.2577","","","","","","1.015","","","","has coordinates,has disorder","177646","2020-10-21","18:00:00",""
"7118718","6.623","0.002","8.437","0.003","17.92","0.006","88.636","0.007","88.061","0.007","85.928","0.007","998","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H21 Br N2 O2 Si -","- C18 H19.5 Br N2 O2 Si -","- C36 H39 Br2 N4 O4 Si2 -","2","1","","Zhao, Yu-Lei; Cao, Zhong-Yan; Zeng, Xing-Ping; Shi, Jia-Meng; Yu, Yi-Hua; Zhou, Jian","Asymmetric sequential Au(i)/chiral tertiary amine catalysis: an enone-formation/cyanosilylation sequence to synthesize optically active 3-alkenyloxindoles from diazooxindoles.","Chemical communications (Cambridge, England)","2016","52","20","3943","3946","10.1039/c6cc00333h","","","0.71073","MoKα","","0.1063","0.0881","","","0.2618","0.2704","","","","","","1.082","","","","has coordinates,has disorder","177678","2020-10-21","18:00:00",""
"7118719","34.596","0.007","23.529","0.005","32.903","0.007","90","","113.63","0.03","90","","24538","11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C105 H109.5 N21 O21 S0.5 -","- C105 H109.5 N21 O21 S0.5 -","- C840 H876 N168 O168 S4 -","8","2","","Chandramouli, Nagula; Ferrand, Yann; Kauffmann, Brice; Huc, Ivan","Citric acid encapsulation by a double helical foldamer in competitive solvents.","Chemical communications (Cambridge, England)","2016","52","20","3939","3942","10.1039/c6cc00190d","","","0.8726","synchrotronradiation","","0.2212","0.1705","","","0.4358","0.4705","","","","","","1.728","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7118720","28.125","0.006","30.271","0.006","35.821","0.007","69.22","0.03","80.81","0.03","88.35","0.03","28134","12","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C428 H413 N84 O92 -","- C428 H443 N84 O92 -","- C856 H886 N168 O184 -","2","1","","Chandramouli, Nagula; Ferrand, Yann; Kauffmann, Brice; Huc, Ivan","Citric acid encapsulation by a double helical foldamer in competitive solvents.","Chemical communications (Cambridge, England)","2016","52","20","3939","3942","10.1039/c6cc00190d","","","1.54178","CuKα","","0.2712","0.1928","","","0.4322","0.4585","","","","","","1.961","","","","has coordinates","177679","2020-10-21","18:00:00",""
"7118721","8.96","0.03","24.2","0.08","17.53","0.05","90","","104.8","","90","","3675","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H46 Cu F6 N4 P -","- C35 H46 Cu F6 N4 P -","- C140 H184 Cu4 F24 N16 P4 -","4","1","","Cheung, Pui Man; Berger, Robert F.; Zakharov, Lev N.; Gilbertson, John D.","Square planar Cu(i) stabilized by a pyridinediimine ligand.","Chemical communications (Cambridge, England)","2016","52","22","4156","4159","10.1039/c6cc00271d","","","0.71075","MoKα","","0.1266","0.0888","","","0.2239","0.2701","","","","","","0.941","","","","has coordinates,has disorder","181530","2020-10-21","18:00:00",""
"7118722","8.6259","0.0006","11.8633","0.0008","16.6506","0.0012","90","","100.785","0.008","90","","1673.8","0.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C33 H43 Cl Cu F6 N3 P -","- C33 H43 Cl Cu F6 N3 P -","- C66 H86 Cl2 Cu2 F12 N6 P2 -","2","1","","Cheung, Pui Man; Berger, Robert F.; Zakharov, Lev N.; Gilbertson, John D.","Square planar Cu(i) stabilized by a pyridinediimine ligand.","Chemical communications (Cambridge, England)","2016","52","22","4156","4159","10.1039/c6cc00271d","","","0.71075","MoKα","","0.0698","0.0657","","","0.1802","0.186","","","","","","1.025","","","","has coordinates","181530","2020-10-21","18:00:00",""
"7118723","8.8683","0.0007","12.1402","0.0009","16.1427","0.0013","90","","100.426","0.008","90","","1709.3","0.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C34 H43 Cu F6 N3 O P -","- C34 H43 Cu F6 N3 O P -","- C68 H86 Cu2 F12 N6 O2 P2 -","2","1","","Cheung, Pui Man; Berger, Robert F.; Zakharov, Lev N.; Gilbertson, John D.","Square planar Cu(i) stabilized by a pyridinediimine ligand.","Chemical communications (Cambridge, England)","2016","52","22","4156","4159","10.1039/c6cc00271d","","","0.71075","MoKα","","0.051","0.0445","","","0.1245","0.1413","","","","","","0.986","","","","has coordinates","181530","2020-10-21","18:00:00",""
"7118724","12.4078","0.0019","13.287","0.002","14.052","0.002","96.92","0.003","105.67","0.003","107.141","0.003","2080.5","0.5","173","2","173","2","","","","","","","","7","P 1","P 1","1","","","","- C39 H54 Cu F6 N4 O P -","- C39 H54 Cu F6 N4 O P -","- C78 H108 Cu2 F12 N8 O2 P2 -","2","2","","Cheung, Pui Man; Berger, Robert F.; Zakharov, Lev N.; Gilbertson, John D.","Square planar Cu(i) stabilized by a pyridinediimine ligand.","Chemical communications (Cambridge, England)","2016","52","22","4156","4159","10.1039/c6cc00271d","","","0.71073","MoKα","","0.1009","0.0525","","","0.1096","0.1311","","","","","","1.017","","","","has coordinates,has disorder","181530","2020-10-21","18:00:00",""
"7118725","14.8812","0.0019","17.179","0.002","15.5446","0.0018","90","","95.597","0.002","90","","3954.9","0.8","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H38 Cu F6 N6 P -","- C42 H38 Cu F6 N6 P -","- C168 H152 Cu4 F24 N24 P4 -","4","1","","Cheung, Pui Man; Berger, Robert F.; Zakharov, Lev N.; Gilbertson, John D.","Square planar Cu(i) stabilized by a pyridinediimine ligand.","Chemical communications (Cambridge, England)","2016","52","22","4156","4159","10.1039/c6cc00271d","","","0.71073","MoKα","","0.1076","0.0512","","","0.1086","0.1335","","","","","","1.008","","","","has coordinates","181530","2020-10-21","18:00:00",""
"7118726","32.313","0.003","19.769","0.002","3.7343","0.0003","90","","98.59","0.01","90","","2358.7","0.4","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 N9 Na O5 -","- C22 N9 Na O5 -","- C88 N36 Na4 O20 -","4","1","","Lee, Gil Ryeong; Ohtsu, Hiroyoshi; Koo, Jinyoung; Yakiyama, Yumi; Park, Moon Jeong; Inoue, Daishi; Hashizume, Daisuke; Kawano, Masaki","Crystallinity-dependence of ionic conductivity in the ion pairs of a multi-interactive anion.","Chemical communications (Cambridge, England)","2016","52","20","3962","3965","10.1039/c5cc10136k","powder diffraction","","1.3","","","0.04361","","","","","","0.03995","0.05395","1.277","","","","","","","has coordinates","177675","2020-10-21","18:00:00",""
"7118727","13.908","0.014","20.33","0.02","10.298","0.012","90","","90","","90","","2912","5","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C27 H32 N9 Na O5 -","- C27 H32 N9 Na O5 -","- C108 H128 N36 Na4 O20 -","4","0.5","","Lee, Gil Ryeong; Ohtsu, Hiroyoshi; Koo, Jinyoung; Yakiyama, Yumi; Park, Moon Jeong; Inoue, Daishi; Hashizume, Daisuke; Kawano, Masaki","Crystallinity-dependence of ionic conductivity in the ion pairs of a multi-interactive anion.","Chemical communications (Cambridge, England)","2016","52","20","3962","3965","10.1039/c5cc10136k","","","0.71073","MoKα","","0.0921","0.0485","","","0.1055","0.1252","","","","","","1.023","","","","has coordinates","177675","2020-10-21","18:00:00",""
"7118728","39.9667","0.0003","3.761","","35.3988","0.0004","90","","122.88","","90","","4468.59","0.06","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H16 N10 O3.75 -","- C22 H16 N10 O3.66 -","- C176 H128 N80 O29.28 -","8","1","","Lee, Gil Ryeong; Ohtsu, Hiroyoshi; Koo, Jinyoung; Yakiyama, Yumi; Park, Moon Jeong; Inoue, Daishi; Hashizume, Daisuke; Kawano, Masaki","Crystallinity-dependence of ionic conductivity in the ion pairs of a multi-interactive anion.","Chemical communications (Cambridge, England)","2016","52","20","3962","3965","10.1039/c5cc10136k","","","0.75","synchrotron","","0.0693","0.0496","","","0.1369","0.1492","","","","","","1.04","","","","has coordinates,has disorder","177675","2020-10-21","18:00:00",""
"7118729","21.6792","0.0001","21.6792","0.0001","9.235","","90","","90","","90","","4340.34","0.03","100","2","100","2","","","","","","","","4","P 42/n","-P 4bc","86","","","","- C22.88 H19 N10 O0.87 -","- C22.869 H19 N10 O0.869 -","- C182.952 H152 N80 O6.952 -","8","","","Lee, Gil Ryeong; Ohtsu, Hiroyoshi; Koo, Jinyoung; Yakiyama, Yumi; Park, Moon Jeong; Inoue, Daishi; Hashizume, Daisuke; Kawano, Masaki","Crystallinity-dependence of ionic conductivity in the ion pairs of a multi-interactive anion.","Chemical communications (Cambridge, England)","2016","52","20","3962","3965","10.1039/c5cc10136k","","","0.7","synchrotron","","0.0539","0.0508","","","0.1469","0.1498","","","","","","1.053","","","","has coordinates","177675","2020-10-21","18:00:00",""
"7118730","9.1833","0.0005","10.6603","0.0006","20.8558","0.0012","90","","90","","90","","2041.7","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 I2 N2 O3 -","- C17 H22 I2 N2 O3 -","- C68 H88 I8 N8 O12 -","4","1","","Huang, Hai; Tang, Luning; Han, Xiaobo; He, Guangke; Xi, Yang; Zhu, Hongjun","Regioselective iodoamination of terminal ynamides for the synthesis of α-amino-β,β-diiodo-enamides.","Chemical communications (Cambridge, England)","2016","52","23","4321","4324","10.1039/c6cc00370b","","","0.71073","MoKα","","0.0216","0.0202","","","0.0479","0.0487","","","","","","1.059","","","","has coordinates","181573","2020-10-21","18:00:00",""
"7118731","14.7831","0.0013","5.6288","0.0005","18.2621","0.0016","90","","98.364","0.008","90","","1503.4","0.2","298","2","298","2","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","Epalrestat","5-[(1Z, 2E)-2-methyl-3-phenylpropenylidene]-4-oxo2-thioxo-3-thiazolidineacetic acid","","- C15 H13 N O3 S2 -","- C15 H13 N O3 S2 -","- C60 H52 N4 O12 S8 -","4","1","","Swapna, Battini; Suresh, Kuthuru; Nangia, Ashwini","Color polymorphs of aldose reductase inhibitor epalrestat: configurational, conformational and synthon differences.","Chemical communications (Cambridge, England)","2016","52","21","4037","4040","10.1039/c6cc00697c","","","0.71073","MoKα","","0.0619","0.0427","","","0.0907","0.0996","","","","","","1.026","","","","has coordinates","177682","2020-10-21","18:00:00",""
"7118732","13.7384","0.0004","9.1063","0.0003","24.1429","0.0007","90","","100.747","0.003","90","","2967.44","0.16","298","2","298","2","","","","","","","synthetic","5","C 1 2/c 1","-C 2yc","15","Epalrestat","5-[(1Z, 2E)-2-methyl-3-phenylpropenylidene]-4-oxo2-thioxo-3-thiazolidineacetic acid","","- C15 H13 N O3 S2 -","- C15 H13 N O3 S2 -","- C120 H104 N8 O24 S16 -","8","1","","Swapna, Battini; Suresh, Kuthuru; Nangia, Ashwini","Color polymorphs of aldose reductase inhibitor epalrestat: configurational, conformational and synthon differences.","Chemical communications (Cambridge, England)","2016","52","21","4037","4040","10.1039/c6cc00697c","","","1.54184","CuKα","","0.0583","0.0558","","","0.1514","0.155","","","","","","1.087","","","","has coordinates","177682","2020-10-21","18:00:00",""
"7118733","8.1399","0.001","11.5584","0.0014","16.1506","0.0019","96.721","0.01","93.818","0.01","104.724","0.01","1452.2","0.3","298","2","298","2","","","","","","","synthetic","5","P -1","-P 1","2","Epalrestat","5-[(1Z, 2E)-2-methyl-3-phenylpropenylidene]-4-oxo2-thioxo-3-thiazolidineacetic acid","","- C15 H13 N O3 S2 -","- C15 H13 N O3 S2 -","- C60 H52 N4 O12 S8 -","4","2","","Swapna, Battini; Suresh, Kuthuru; Nangia, Ashwini","Color polymorphs of aldose reductase inhibitor epalrestat: configurational, conformational and synthon differences.","Chemical communications (Cambridge, England)","2016","52","21","4037","4040","10.1039/c6cc00697c","","","0.71073","MoKα","","0.138","0.0633","","","0.0779","0.1084","","","","","","0.983","","","","has coordinates","177682","2020-10-21","18:00:00",""
"7118734","11.4252","0.0005","6.9479","0.0003","19.4673","0.0009","90","","102.898","0.005","90","","1506.35","0.12","298","2","298","2","","","","","","","synthetic","5","P 1 21/c 1","-P 2ybc","14","Epalrestat","5-[(1Z, 2E)-2-methyl-3-phenylpropenylidene]-4-oxo2-thioxo-3-thiazolidineacetic acid","","- C15 H13 N O3 S2 -","- C15 H13 N O3 S2 -","- C60 H52 N4 O12 S8 -","4","1","","Swapna, Battini; Suresh, Kuthuru; Nangia, Ashwini","Color polymorphs of aldose reductase inhibitor epalrestat: configurational, conformational and synthon differences.","Chemical communications (Cambridge, England)","2016","52","21","4037","4040","10.1039/c6cc00697c","","","1.54184","CuKα","","0.0767","0.0543","","","0.1421","0.1604","","","","","","1.036","","","","has coordinates","177682","2020-10-21","18:00:00",""
"7118735","23.7527","0.0009","12.0648","0.0005","25.9809","0.0014","90","","113.065","0.001","90","","6850.2","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","W2(DippF)2Cl4Li","","- C66 H102 Cl4 Li N4 O4 W2 -","- C66 H102 Cl4 Li N4 O4 W2 -","- C264 H408 Cl16 Li4 N16 O16 W8 -","4","0.5","","Ventura, K.; Prat, J. R.; Aguirre Quintana, L. M.; Goos, A.; Villagran, D.","Unprecedented W2(0) quadruply bonded complex supported by π-donor ligands.","Chemical communications (Cambridge, England)","2016","52","20","3974","3976","10.1039/c5cc09972b","","","0.71073","MoKα","","0.117","0.1015","","","0.2071","0.2153","","","","","","1.226","","","","has coordinates","177677","2020-10-21","18:00:00",""
"7118736","10.879","0.002","13.364","0.003","23.272","0.005","96.119","0.006","99.34","0.006","105.7","0.006","3173.4","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","W2(DippF)2K2","","- C58 H88 K2 N4 O2 W2 -","- C58 H88 K2 N4 O2 W2 -","- C116 H176 K4 N8 O4 W4 -","2","1","","Ventura, K.; Prat, J. R.; Aguirre Quintana, L. M.; Goos, A.; Villagran, D.","Unprecedented W2(0) quadruply bonded complex supported by π-donor ligands.","Chemical communications (Cambridge, England)","2016","52","20","3974","3976","10.1039/c5cc09972b","","","0.71073","MoKα","","0.1165","0.074","","","0.2002","0.2446","","","","","","1.113","","","","has coordinates","211691","2020-10-21","18:00:00",""
"7118737","10.6334","0.0007","12.3442","0.0008","12.6391","0.0008","102.884","0.003","91.323","0.002","90.704","0.002","1616.56","0.18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H44 Br F10 P2 Pd S2 -","- C24 H44 Br F10 P2 Pd S2 -","- C48 H88 Br2 F20 P4 Pd2 S4 -","2","1","","Berg, Claudia; Braun, Thomas; Laubenstein, Reik; Braun, Beatrice","Palladium-mediated borylation of pentafluorosulfanyl functionalized compounds: the crucial role of metal fluorido complexes.","Chemical communications (Cambridge, England)","2016","52","20","3931","3934","10.1039/c5cc10219g","","","0.71073","MoKα","","0.0293","0.0272","","","0.0651","0.0661","","","","","","1.035","","","","has coordinates","177680","2020-10-21","18:00:00",""
"7118738","14.4952","0.0005","12.5053","0.0004","18.0453","0.0006","90","","112.244","0.001","90","","3027.59","0.18","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H46 F5 I P2 Pd S -","- C24 H46 F5 I P2 Pd S -","- C96 H184 F20 I4 P8 Pd4 S4 -","4","1","","Berg, Claudia; Braun, Thomas; Laubenstein, Reik; Braun, Beatrice","Palladium-mediated borylation of pentafluorosulfanyl functionalized compounds: the crucial role of metal fluorido complexes.","Chemical communications (Cambridge, England)","2016","52","20","3931","3934","10.1039/c5cc10219g","","","0.71073","MoKα","","0.0432","0.0317","","","0.0743","0.0805","","","","","","1.009","","","","has coordinates","177680","2020-10-21","18:00:00",""
"7118739","9.3877","0.0005","12.7766","0.0005","26.0735","0.0015","90","","108.762","0.004","90","","2961.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H46 Br F5 P2 Pd S -","- C24 H46 Br F5 P2 Pd S -","- C96 H184 Br4 F20 P8 Pd4 S4 -","4","1","","Berg, Claudia; Braun, Thomas; Laubenstein, Reik; Braun, Beatrice","Palladium-mediated borylation of pentafluorosulfanyl functionalized compounds: the crucial role of metal fluorido complexes.","Chemical communications (Cambridge, England)","2016","52","20","3931","3934","10.1039/c5cc10219g","","","0.71073","MoKα","","0.0564","0.0472","","","0.1328","0.1434","","","","","","0.954","","","","has coordinates","177680","2020-10-21","18:00:00",""
"7118740","12.1389","0.0018","8.7547","0.0012","13.5608","0.0019","90","","100.44","0.005","90","","1417.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 F10 S2 -","- C12 H8 F10 S2 -","- C48 H32 F40 S8 -","4","1","","Berg, Claudia; Braun, Thomas; Laubenstein, Reik; Braun, Beatrice","Palladium-mediated borylation of pentafluorosulfanyl functionalized compounds: the crucial role of metal fluorido complexes.","Chemical communications (Cambridge, England)","2016","52","20","3931","3934","10.1039/c5cc10219g","","","0.71073","MoKα","","0.0536","0.0394","","","0.0957","0.1022","","","","","","1.059","","","","has coordinates","177680","2020-10-21","18:00:00",""
"7118741","10.779","0.002","12.164","0.003","12.241","0.003","80.079","0.008","89.555","0.007","88.284","0.008","1580.3","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H45 F11 P2 Pd S2 -","- C24 H45 F11 P2 Pd S2 -","- C48 H90 F22 P4 Pd2 S4 -","2","1","","Berg, Claudia; Braun, Thomas; Laubenstein, Reik; Braun, Beatrice","Palladium-mediated borylation of pentafluorosulfanyl functionalized compounds: the crucial role of metal fluorido complexes.","Chemical communications (Cambridge, England)","2016","52","20","3931","3934","10.1039/c5cc10219g","","","0.71073","MoKα","","0.0328","0.0299","","","0.0749","0.0769","","","","","","1.063","","","","has coordinates","177680","2020-10-21","18:00:00",""
"7118742","9.9552","0.0009","11.159","0.0009","13.6383","0.0011","73.775","0.003","71.961","0.003","76.711","0.003","1366.1","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H18 B F20 O2 S4 -","- C18 H18 B F20 O2 S4 -","- C36 H36 B2 F40 O4 S8 -","2","1","","Berg, Claudia; Braun, Thomas; Laubenstein, Reik; Braun, Beatrice","Palladium-mediated borylation of pentafluorosulfanyl functionalized compounds: the crucial role of metal fluorido complexes.","Chemical communications (Cambridge, England)","2016","52","20","3931","3934","10.1039/c5cc10219g","","","0.71073","MoKα","","0.0356","0.0283","","","0.0692","0.0727","","","","","","1.042","","","","has coordinates","177680","2020-10-21","18:00:00",""
"7118743","17.7793","0.0007","18.0796","0.0007","22.8488","0.0016","83.835","0.006","84.664","0.006","61.434","0.004","6405.9","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Na6TBC[8](THF)7.(THF)5","","- C136 H191 Na6 O20 -","- C136 H191 Na6 O20 -","- C272 H382 Na12 O40 -","2","1","","Ryan, Jason D.; Gagnon, Kevin J.; Teat, Simon J.; McIntosh, Ruaraidh D.","Flexible macrocycles as versatile supports for catalytically active metal clusters.","Chemical communications (Cambridge, England)","2016","52","58","9071","9073","10.1039/c6cc00478d","","","0.71075","MoKα","","0.1634","0.112","","","0.3012","0.3388","","","","","","1.024","","","","has coordinates,has disorder","185104","2020-10-21","18:00:00",""
"7118744","42.023","0.003","18.0435","0.0014","30.746","0.002","90","","95.407","0.004","90","","23209","3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","C212H252O38Ti8","","- C200 H254 O24 Ti8 -","- C212 H254 O38 Ti8 -","- C848 H1016 O152 Ti32 -","4","0.5","","Ryan, Jason D.; Gagnon, Kevin J.; Teat, Simon J.; McIntosh, Ruaraidh D.","Flexible macrocycles as versatile supports for catalytically active metal clusters.","Chemical communications (Cambridge, England)","2016","52","58","9071","9073","10.1039/c6cc00478d","","","0.71073","MoKα","","0.5505","0.4271","","","0.7964","0.8408","","","","","","3.147","","","","has coordinates,has disorder","185104","2020-10-21","18:00:00",""
"7118745","14.496","0.002","16.122","0.002","17.367","0.003","77.94","0.009","70.572","0.008","63.959","0.008","3429.6","0.9","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Ti4TBC[8](OC3H7)4(THF)2","","- C140 H216 O23 Ti4 -","- C136 H208 O22 Ti4 -","- C136 H208 O22 Ti4 -","1","0.5","","Ryan, Jason D.; Gagnon, Kevin J.; Teat, Simon J.; McIntosh, Ruaraidh D.","Flexible macrocycles as versatile supports for catalytically active metal clusters.","Chemical communications (Cambridge, England)","2016","52","58","9071","9073","10.1039/c6cc00478d","","","0.71073","MoKα","","0.181","0.0921","","","0.2162","0.2501","","","","","","0.994","","","","has coordinates","185104","2020-10-21","18:00:00",""
"7118746","8.4914","0.0008","10.2896","0.0009","15.2108","0.0013","89.626","0.003","85.989","0.003","89.673","0.003","1325.7","0.2","103","","103","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 F5 N O -","- C14 H14 F5 N O -","- C56 H56 F20 N4 O4 -","4","2","","Katayev, D.; Václavík, J; Brüning, F; Commare, B.; Togni, A.","Synthesis of quaternary α-perfluoroalkyl lactams via electrophilic perfluoroalkylation.","Chemical communications (Cambridge, England)","2016","52","21","4049","4052","10.1039/c6cc00700g","","x-ray","0.71073","MoKα","","0.0769","0.0505","","","0.1028","0.1129","","","","","","1.162","","","","has coordinates","177685","2020-10-21","18:00:00",""
"7118747","6.2235","0.0004","9.799","0.0006","9.2211","0.0006","90","","97.094","0.002","90","","558.04","0.06","101","2","101","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H17 Br O2 -","- C10 H17 Br O2 -","- C20 H34 Br2 O4 -","2","1","","Verma, Ajay; Jana, Sadhan; Durga Prasad, Ch; Yadav, Abhimanyu; Kumar, Sangit","Organoselenium and DMAP co-catalysis: regioselective synthesis of medium-sized halolactones and bromooxepanes from unactivated alkenes.","Chemical communications (Cambridge, England)","2016","52","22","4179","4182","10.1039/c5cc10245f","","x-ray","0.71073","MoKα","","0.0553","0.0531","","","0.1427","0.1465","","","","","","1.063","","","","has coordinates","181527","2020-10-21","18:00:00",""
"7118748","13.176","0.003","7.6455","0.0017","15.656","0.004","90","","90","","90","","1577.1","0.6","302","2","302","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H11 Br O2 -","- C7 H11 Br O2 -","- C56 H88 Br8 O16 -","8","1","","Verma, Ajay; Jana, Sadhan; Durga Prasad, Ch; Yadav, Abhimanyu; Kumar, Sangit","Organoselenium and DMAP co-catalysis: regioselective synthesis of medium-sized halolactones and bromooxepanes from unactivated alkenes.","Chemical communications (Cambridge, England)","2016","52","22","4179","4182","10.1039/c5cc10245f","","x-ray","0.71073","MoKα","","0.0549","0.0446","","","0.1086","0.1145","","","","","","1.049","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7118749","6.1527","0.001","26.213","0.004","8.0982","0.0014","90","","95.797","0.005","90","","1299.4","0.4","301","2","301","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 O2 Se -","- C14 H14 O2 Se -","- C56 H56 O8 Se4 -","4","1","","Verma, Ajay; Jana, Sadhan; Durga Prasad, Ch; Yadav, Abhimanyu; Kumar, Sangit","Organoselenium and DMAP co-catalysis: regioselective synthesis of medium-sized halolactones and bromooxepanes from unactivated alkenes.","Chemical communications (Cambridge, England)","2016","52","22","4179","4182","10.1039/c5cc10245f","","x-ray","0.71073","MoKα","","0.0607","0.0491","","","0.11","0.1149","","","","","","1.139","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7118750","7.8195","0.0007","8.6185","0.0008","11.8731","0.0011","84.638","0.004","85.762","0.004","75.567","0.004","770.45","0.12","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 Br2 O2 Se -","- C14 H14 Br2 O2 Se -","- C28 H28 Br4 O4 Se2 -","2","1","","Verma, Ajay; Jana, Sadhan; Durga Prasad, Ch; Yadav, Abhimanyu; Kumar, Sangit","Organoselenium and DMAP co-catalysis: regioselective synthesis of medium-sized halolactones and bromooxepanes from unactivated alkenes.","Chemical communications (Cambridge, England)","2016","52","22","4179","4182","10.1039/c5cc10245f","","x-ray","0.71073","MoKα","","0.0454","0.0415","","","0.129","0.1324","","","","","","1.074","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7118751","10.6207","0.0004","8.4724","0.0003","12.7806","0.0005","90","","104.935","0.001","90","","1111.18","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 Br O4 -","- C11 H11 Br O4 -","- C44 H44 Br4 O16 -","4","1","","Verma, Ajay; Jana, Sadhan; Durga Prasad, Ch; Yadav, Abhimanyu; Kumar, Sangit","Organoselenium and DMAP co-catalysis: regioselective synthesis of medium-sized halolactones and bromooxepanes from unactivated alkenes.","Chemical communications (Cambridge, England)","2016","52","22","4179","4182","10.1039/c5cc10245f","","x-ray","0.71073","MoKα","","0.035","0.03","","","0.0708","0.0737","","","","","","1.064","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7118752","5.4464","0.0003","8.716","0.0005","25.2572","0.0014","90","","91.713","0.004","90","","1198.44","0.12","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 Br N O4 -","- C11 H12 Br N O4 -","- C44 H48 Br4 N4 O16 -","4","1","","Santra, Sourav Kumar; Banerjee, Arghya; Rajamanickam, Suresh; Khatun, Nilufa; Patel, Bhisma K.","Pd(II)/CuBr2 catalysed keto α-Csp3-H benzoxylation of N,N-dialkylamides directed by o-hydroxy groups.","Chemical communications (Cambridge, England)","2016","52","24","4501","4504","10.1039/c6cc00971a","","","0.71073","MoKα","","0.0779","0.0402","","","0.0928","0.1047","","","","","","1.039","","","","has coordinates","181545","2020-10-21","18:00:00",""
"7118753","6.9732","0.0002","15.0872","0.0003","14.2862","0.0004","90","","95.411","0.002","90","","1496.3","0.07","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Cl2 N4 O3 -","- C13 H16 Cl2 N4 O3 -","- C52 H64 Cl8 N16 O12 -","4","1","","Sashuk, Volodymyr; Butkiewicz, Helena; Fiałkowski, Marcin; Danylyuk, Oksana","Triggering autocatalytic reaction by host-guest interactions.","Chemical communications (Cambridge, England)","2016","52","22","4191","4194","10.1039/c5cc10063a","","","1.54184","CuKα","","0.0562","0.0532","","","0.1463","0.1474","","","","","","1.116","","","","has coordinates","181523","2020-10-21","18:00:00",""
"7118754","12.6037","0.0003","18.505","0.0006","14.088","0.0003","90","","97.74","0.002","90","","3255.83","0.15","100","0.1","100","0.1","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C49 H49 Cl N28 O29 -","- C49 H49 Cl N28 O28.849 -","- C98 H98 Cl2 N56 O57.698 -","2","1","","Sashuk, Volodymyr; Butkiewicz, Helena; Fiałkowski, Marcin; Danylyuk, Oksana","Triggering autocatalytic reaction by host-guest interactions.","Chemical communications (Cambridge, England)","2016","52","22","4191","4194","10.1039/c5cc10063a","","","1.54184","CuKα","","0.0904","0.085","","","0.2577","0.269","","","","","","1.236","","","","has coordinates,has disorder","181523","2020-10-21","18:00:00",""
"7118755","7.4885","0.0002","10.5846","0.0003","17.5033","0.0004","90","","98.615","0.002","90","","1371.71","0.06","100.1","0.1","100.1","0.1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C13 H15 Cl N4 O2 -","- C13 H15 Cl N4 O2 -","- C52 H60 Cl4 N16 O8 -","4","1","","Sashuk, Volodymyr; Butkiewicz, Helena; Fiałkowski, Marcin; Danylyuk, Oksana","Triggering autocatalytic reaction by host-guest interactions.","Chemical communications (Cambridge, England)","2016","52","22","4191","4194","10.1039/c5cc10063a","","","0.71073","MoKα","","0.0315","0.0287","","","0.079","0.0806","","","","","","1.063","","","","has coordinates","201913","2020-10-21","18:00:00",""
"7118756","12.6407","0.0002","15.8596","0.0002","12.6429","0.0002","90","","102.853","0.002","90","","2471.1","0.07","100","0.1","100","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C42 H42 N24 O21.5 -","- C42 H42 N24 O21.33 -","- C84 H84 N48 O42.66 -","2","1","","Sashuk, Volodymyr; Butkiewicz, Helena; Fiałkowski, Marcin; Danylyuk, Oksana","Triggering autocatalytic reaction by host-guest interactions.","Chemical communications (Cambridge, England)","2016","52","22","4191","4194","10.1039/c5cc10063a","","","1.54184","CuKα","","0.0526","0.0517","","","0.1438","0.1449","","","","","","1.008","","","","has coordinates,has disorder","181523","2020-10-21","18:00:00",""
"7118757","9.5705","0.0003","20.6075","0.0007","15.8172","0.0004","90","","90.295","0.003","90","","3119.49","0.16","173","","173","","","","","","","","","4","P 1 21 1","P 2yb","4","","Diarylmethine-substituted Oxindole 3ab","","- C38 H41 N O2 -","- C38 H41 N O2 -","- C152 H164 N4 O8 -","4","2","","Deng, Yu-Hua; Zhang, Xiang-Zhi; Yu, Ke-Yin; Yan, Xu; Du, Ji-Yuan; Huang, Hanmin; Fan, Chun-An","Bifunctional tertiary amine-squaramide catalyzed asymmetric catalytic 1,6-conjugate addition/aromatization of para-quinone methides with oxindoles.","Chemical communications (Cambridge, England)","2016","52","22","4183","4186","10.1039/c5cc10502a","","x-ray","1.54184","CuKα","","0.0374","0.0355","","","0.0895","0.0905","","","","","","1.059","","","","has coordinates","181528","2020-10-21","18:00:00",""
"7118758","21.2111","0.0008","21.2111","0.0008","21.2111","0.0008","90","","90","","90","","9543.1","0.6","100","2","100","2","","","","","","","","6","P m -3","-P 2 2 3","200","","","","- C160 H112 Cu6 F18 Ge3 N32 -","- C160.001 H112.001 Cu6 F18 Ge3 N31.9992 -","- C160.001 H112.001 Cu6 F18 Ge3 N31.9992 -","1","0.0416667","","Lusi, Matteo; Fechine, Pierre B. A.; Chen, Kai-Jie; Perry, John J.; Zaworotko, Michael J.","A rare cationic building block that generates a new type of polyhedral network with ""cross-linked"" pto topology.","Chemical communications (Cambridge, England)","2016","52","22","4160","4162","10.1039/c5cc10203k","","","1.54178","CuKα","","0.159","0.1513","","","0.4423","0.4511","","","","","","2.098","","","","has coordinates,has disorder","181529","2020-10-21","18:00:00",""
"7118759","21.1882","0.0004","21.1882","0.0004","21.1882","0.0004","90","","90","","90","","9512.2","0.3","446","2","446","2","","","","","","","","6","P m -3","-P 2 2 3","200","","","","- C160 H112 Cu6 F18 N32 Si3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Si3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Si3 -","1","0.0416667","","Lusi, Matteo; Fechine, Pierre B. A.; Chen, Kai-Jie; Perry, John J.; Zaworotko, Michael J.","A rare cationic building block that generates a new type of polyhedral network with ""cross-linked"" pto topology.","Chemical communications (Cambridge, England)","2016","52","22","4160","4162","10.1039/c5cc10203k","","","1.54178","CuKα","","0.195","0.1719","","","0.4021","0.4091","","","","","","2.772","","","","has coordinates,has disorder","181529","2020-10-21","18:00:00",""
"7118760","21.2379","0.001","21.2379","0.001","21.2379","0.001","90","","90","","90","","9579.3","0.8","100","2","100","2","","","","","","","","6","P m -3","-P 2 2 3","200","","","","- C160 H112 Cu6 F18 N32 Sn3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Sn3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Sn3 -","1","0.0416667","","Lusi, Matteo; Fechine, Pierre B. A.; Chen, Kai-Jie; Perry, John J.; Zaworotko, Michael J.","A rare cationic building block that generates a new type of polyhedral network with ""cross-linked"" pto topology.","Chemical communications (Cambridge, England)","2016","52","22","4160","4162","10.1039/c5cc10203k","","","1.54178","CuKα","","0.2349","0.1653","","","0.4324","0.4636","","","","","","1.34","","","","has coordinates,has disorder","181529","2020-10-21","18:00:00",""
"7118761","21.2174","0.0008","21.2174","0.0008","21.2174","0.0008","90","","90","","90","","9551.6","0.6","100","2","100","2","","","","","","","","6","P m -3","-P 2 2 3","200","","","","- C160 H112 Cu6 F18 N32 Ti3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Ti3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Ti3 -","1","0.0416667","","Lusi, Matteo; Fechine, Pierre B. A.; Chen, Kai-Jie; Perry, John J.; Zaworotko, Michael J.","A rare cationic building block that generates a new type of polyhedral network with ""cross-linked"" pto topology.","Chemical communications (Cambridge, England)","2016","52","22","4160","4162","10.1039/c5cc10203k","","","1.54178","CuKα","","0.2601","0.1732","","","0.4334","0.4642","","","","","","1.49","","","","has coordinates,has disorder","181529","2020-10-21","18:00:00",""
"7118762","21.165","0.002","21.165","0.002","21.165","0.002","90","","90","","90","","9481","1.6","102","2","102","2","","","","","","","","6","P m -3","-P 2 2 3","200","","","","- C160 H112 Cu6 F18 N32 Zr3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Zr3 -","- C160.001 H112.001 Cu6 F18 N31.9992 Zr3 -","1","0.0416667","","Lusi, Matteo; Fechine, Pierre B. A.; Chen, Kai-Jie; Perry, John J.; Zaworotko, Michael J.","A rare cationic building block that generates a new type of polyhedral network with ""cross-linked"" pto topology.","Chemical communications (Cambridge, England)","2016","52","22","4160","4162","10.1039/c5cc10203k","","","1.54178","CuKα","","0.3057","0.2351","","","0.5086","0.5336","","","","","","1.861","","","","has coordinates,has disorder","181529","2020-10-21","18:00:00",""
"7118763","12.1788","0.0004","13.6793","0.0005","24.891","0.0006","89.173","0.002","85.674","0.002","65.484","0.003","3761.5","0.2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C75 H81 Cl9 N6 O8 S2 -","- C75 H81 Cl9 N6 O8 S2 -","- C150 H162 Cl18 N12 O16 S4 -","2","1","","Huang, Guobao; Valkonen, Arto; Rissanen, Kari; Jiang, Wei","endo-Functionalized molecular tubes: selective encapsulation of neutral molecules in non-polar media.","Chemical communications (Cambridge, England)","2016","52","58","9078","9081","10.1039/c6cc00349d","","","1.54184","CuKα","","0.0502","0.0404","","","0.1002","0.1065","","","","","","1.021","","","","has coordinates,has disorder","185101","2020-10-21","18:00:00",""
"7118764","26.2252","0.0015","6.7734","0.0003","11.5919","0.0006","90","","115.831","0.003","90","","1853.37","0.17","296","2","296","2","","","","","","","","6","C 1 2 1","C 2y","5","(Ss)-(+)-N-[(R)-1-Cyano-2-(1?,2?-dicarba-closo-dodecaboranyl)ethyl]-tert-butylsulfinamide","21 b (EDM345)","","- C9 H24 B10 N2 O S -","- C9 H24 B10 N2 O S -","- C36 H96 B40 N8 O4 S4 -","4","1","","de Bruin, Gerjan; Mock, Elliot D.; Hoogendoorn, Sascha; van den Nieuwendijk, Adrianus M. C. H.; Mazurek, Jaroslaw; van der Marel, Gijsbert A.; Florea, Bogdan I.; Overkleeft, Herman S.","Enantioselective synthesis of adamantylalanine and carboranylalanine and their incorporation into the proteasome inhibitor bortezomib.","Chemical communications (Cambridge, England)","2016","52","21","4064","4067","10.1039/c6cc01156j","","","0.71073","MoKα","","0.0637","0.047","","","0.1033","0.1099","","","","","","1.079","","","","has coordinates","177686","2020-10-21","18:00:00",""
"7118765","6.7451","0.0003","11.1419","0.0006","26.4844","0.0018","90","","90","","90","","1990.39","0.19","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(Rs)-(+)-N-[(S)-1-Cyano-2-(1?,2?-dicarba-closo-dodecaboranyl)ethyl]-tert-butylsulfinamide","22 (EDM371)","","- C9 H26 B10 N2 O2 S -","- C9 H26 B10 N2 O2 S -","- C36 H104 B40 N8 O8 S4 -","4","1","","de Bruin, Gerjan; Mock, Elliot D.; Hoogendoorn, Sascha; van den Nieuwendijk, Adrianus M. C. H.; Mazurek, Jaroslaw; van der Marel, Gijsbert A.; Florea, Bogdan I.; Overkleeft, Herman S.","Enantioselective synthesis of adamantylalanine and carboranylalanine and their incorporation into the proteasome inhibitor bortezomib.","Chemical communications (Cambridge, England)","2016","52","21","4064","4067","10.1039/c6cc01156j","","","0.71073","MoKα","","0.0621","0.0552","","","0.1418","0.1468","","","","","","1.056","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7118766","11.5615","0.0003","10.114","0.0003","12.3397","0.0003","90","","100.223","0.003","90","","1420.01","0.07","130","0.1","130","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H47 N3 O6 -","- C28 H47 N3 O6 -","- C56 H94 N6 O12 -","2","1","","Zalewski, A. N.; Nathanael, J. G.; White, J. M.; Wille, U.","Oxidation of cholesterol and O-protected derivatives by the environmental pollutant NO2˙.","Chemical communications (Cambridge, England)","2016","52","21","4060","4063","10.1039/c5cc09663d","","x-ray","0.71073","MoKα","","0.0642","0.049","","","0.1259","0.1379","","","","","","1.061","","","","has coordinates","177687","2020-10-21","18:00:00",""
"7118767","8.3737","0.0003","12.3461","0.0004","23.8575","0.0007","90","","90","","90","","2466.45","0.14","103","2","103","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C28 H23 Cl N O P Pd S -","- C28 H23 Cl N O P Pd S -","- C112 H92 Cl4 N4 O4 P4 Pd4 S4 -","4","1","","Yang, Xiang-Yuan; Tay, Wee Shan; Li, Yongxin; Pullarkat, Sumod A.; Leung, Pak-Hing","The synthesis and efficient one-pot catalytic ""self-breeding"" of asymmetrical NC(sp(3))E-hybridised pincer complexes.","Chemical communications (Cambridge, England)","2016","52","22","4211","4214","10.1039/c6cc00763e","","","0.71073","MoKα","","0.0555","0.052","","","0.0992","0.1002","","","","","","1.25","","","","has coordinates,has disorder","181526","2020-10-21","18:00:00",""
"7118768","8.4079","0.0004","12.0255","0.0006","23.7756","0.0012","90","","90.682","0.003","90","","2403.8","0.2","103","2","103","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C28 H23 Cl N O2 P Pd -","- C28 H23 Cl N O2 P Pd -","- C112 H92 Cl4 N4 O8 P4 Pd4 -","4","2","","Yang, Xiang-Yuan; Tay, Wee Shan; Li, Yongxin; Pullarkat, Sumod A.; Leung, Pak-Hing","The synthesis and efficient one-pot catalytic ""self-breeding"" of asymmetrical NC(sp(3))E-hybridised pincer complexes.","Chemical communications (Cambridge, England)","2016","52","22","4211","4214","10.1039/c6cc00763e","","","0.71073","MoKα","","0.0661","0.0582","","","0.1223","0.1257","","","","","","1.074","","","","has coordinates","181526","2020-10-21","18:00:00",""
"7118769","11.0838","0.0003","50.0332","0.0009","10.6703","0.0002","90","","107.01","0.003","90","","5658.4","0.2","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H43 N3 O5 -","- C27 H43 N3 O5 -","- C216 H344 N24 O40 -","8","2","","Angelici, G.; Bhattacharjee, N.; Roy, O.; Faure, S.; Didierjean, C.; Jouffret, L.; Jolibois, F.; Perrin, L.; Taillefumier, C.","Weak backbone CHO[double bond, length as m-dash]C and side chain tButBu London interactions help promote helix folding of achiral NtBu peptoids.","Chemical communications (Cambridge, England)","2016","52","24","4573","4576","10.1039/c6cc00375c","","","1.5418","CuKα","","0.1086","0.0995","","","0.2141","0.2193","","","","","","1.128","","","","has coordinates","181550","2020-10-21","18:00:00",""
"7118770","11.149","0.001","17.2409","0.0015","11.1991","0.001","90","","116.772","0.004","90","","1921.9","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","GA104","","- C37 H64 N5 O6 -","- C37 H63 N5 O6 -","- C74 H126 N10 O12 -","2","1","","Angelici, G.; Bhattacharjee, N.; Roy, O.; Faure, S.; Didierjean, C.; Jouffret, L.; Jolibois, F.; Perrin, L.; Taillefumier, C.","Weak backbone CHO[double bond, length as m-dash]C and side chain tButBu London interactions help promote helix folding of achiral NtBu peptoids.","Chemical communications (Cambridge, England)","2016","52","24","4573","4576","10.1039/c6cc00375c","","","0.71073","MoKα","","0.0532","0.0461","","","0.123","0.1291","","","","","","1.057","","","","has coordinates","181550","2020-10-21","18:00:00",""
"7118771","5.1957","0.0002","24.5851","0.0011","16.0276","0.0007","90","","93.625","0.004","90","","2043.22","0.15","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 N2 O3 -","- C23 H26 N2 O3 -","- C92 H104 N8 O12 -","4","1","","Smith, Joshua J.; Best, Daniel; Lam, Hon Wai","Copper-catalyzed borylative coupling of vinylazaarenes and N-Boc imines.","Chemical communications (Cambridge, England)","2016","52","19","3770","3772","10.1039/c6cc00603e","","x-ray","1.54184","CuKα","","0.0981","0.0749","","","0.1999","0.2229","","","","","","1.054","","","","has coordinates","177701","2020-10-21","18:00:00",""
"7118772","5.28349","0.00011","9.9736","0.0002","36.4673","0.0006","90","","92.3374","0.0019","90","","1920.06","0.06","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 N2 O3 S -","- C21 H24 N2 O3 S -","- C84 H96 N8 O12 S4 -","4","1","","Smith, Joshua J.; Best, Daniel; Lam, Hon Wai","Copper-catalyzed borylative coupling of vinylazaarenes and N-Boc imines.","Chemical communications (Cambridge, England)","2016","52","19","3770","3772","10.1039/c6cc00603e","","x-ray","1.54184","CuKα","","0.0456","0.0412","","","0.1052","0.1088","","","","","","1.027","","","","has coordinates","177701","2020-10-21","18:00:00",""
"7118773","11.899","0.002","13.11","0.003","18.036","0.004","73.51","0.03","89.05","0.03","64.38","0.03","2414.2","1.2","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H19 B N -","- C28 H19 B N -","- C112 H76 B4 N4 -","4","2","","Huang, Huanan; Pan, Zexiong; Cui, Chunming","The synthesis of BN-embedded tetraphenes and their photophysical properties.","Chemical communications (Cambridge, England)","2016","52","22","4227","4230","10.1039/c6cc00161k","","","0.71073","MoKα","","0.1141","0.0693","","","0.1921","0.2158","","","","","","0.952","","","","has coordinates","181532","2020-10-21","18:00:00",""
"7118774","9.942","0.002","16.9","0.004","18.738","0.004","105.481","0.006","92.118","0.004","92.215","0.005","3028.2","1.1","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H24 B N -","- C36 H24 B N -","- C144 H96 B4 N4 -","4","2","","Huang, Huanan; Pan, Zexiong; Cui, Chunming","The synthesis of BN-embedded tetraphenes and their photophysical properties.","Chemical communications (Cambridge, England)","2016","52","22","4227","4230","10.1039/c6cc00161k","","","0.71073","MoKα","","0.145","0.0769","","","0.1833","0.209","","","","","","1.06","","","","has coordinates","181532","2020-10-21","18:00:00",""
"7118775","37.4027","0.0012","7.01569","0.00012","6.36593","0.0001","90","","90","","90","","1670.46","0.07","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(AuSPhCO2Me)n","","- C8 H7 Au O2 S -","- C8 H4 Au O2 S -","- C64 H32 Au8 O16 S8 -","8","1","","Lavenn, Christophe; Guillou, Nathalie; Monge, Miguel; Podbevšek, Darjan; Ledoux, Gilles; Fateeva, Alexandra; Demessence, Aude","Shedding light on an ultra-bright photoluminescent lamellar gold thiolate coordination polymer [Au(p-SPhCO2Me)]n.","Chemical communications (Cambridge, England)","2016","52","58","9063","9066","10.1039/c5cc10448c","powder diffraction","","1.5406","CuKa1radiation","","","","","","","","","0.038","6.41","","","","","","","has coordinates","185098","2020-10-21","18:00:00",""
"7118776","5.9165","0.0004","7.6653","0.0005","17.819","0.001","79.997","0.005","85.946","0.005","75.915","0.006","771.57","0.09","150","","150","","","","","","","","","4","P -1","-P 1","2","","(SPhCO2Me)2","","- C16 H14 O4 S2 -","- C16 H14 O4 S2 -","- C32 H28 O8 S4 -","2","1","","Lavenn, Christophe; Guillou, Nathalie; Monge, Miguel; Podbevšek, Darjan; Ledoux, Gilles; Fateeva, Alexandra; Demessence, Aude","Shedding light on an ultra-bright photoluminescent lamellar gold thiolate coordination polymer [Au(p-SPhCO2Me)]n.","Chemical communications (Cambridge, England)","2016","52","58","9063","9066","10.1039/c5cc10448c","","","1.5418","CuKα","","0.04","0.0351","","0.0633","0.0605","0.0633","","","","","","0.9835","","","","has coordinates","185098","2020-10-21","18:00:00",""
"7118777","6.582","0.004","10.854","0.006","15.521","0.008","90","","94.787","0.005","90","","1105","1.1","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H34 N2 O7 -","- C22 H34 N2 O7 -","- C44 H68 N4 O14 -","2","1","","Wang, Siyuan; Taniguchi, Tohru; Monde, Kenji; Kawahata, Masatoshi; Yamaguchi, Kentaro; Otani, Yuko; Ohwada, Tomohiko","Hydrogen bonding to carbonyl oxygen of nitrogen-pyramidalized amide - detection of pyramidalization direction preference by vibrational circular dichroism spectroscopy.","Chemical communications (Cambridge, England)","2016","52","21","4018","4021","10.1039/c6cc00284f","","","0.71073","MoKα","","0.0297","0.0267","","","0.0715","0.0811","","","","","","1.154","","","","has coordinates","177681","2020-10-21","18:00:00",""
"7118778","12.4687","0.0013","15.731","0.0016","17.5343","0.0019","67.02","0.004","80.866","0.005","70.636","0.004","2985.5","0.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C63 H66 B N2 O3 P2 Ru -","- C63 H66 B N2 O3 P2 Ru -","- C126 H132 B2 N4 O6 P4 Ru2 -","2","1","","Janes, Trevor; Osten, Kimberly M.; Pantaleo, Adam; Yan, Ellen; Yang, Yanxin; Song, Datong","Insertion of CO2 into the carbon-boron bond of a boronic ester ligand.","Chemical communications (Cambridge, England)","2016","52","22","4148","4151","10.1039/c6cc01257d","","","0.71073","MoKα","","0.1001","0.0506","","","0.1013","0.1129","","","","","","0.953","","","","has coordinates","181531","2020-10-21","18:00:00",""
"7118779","10.4711","0.0004","10.4711","0.0004","44.073","0.004","90","","90","","90","","4832.3","0.5","150","2","150","2","","","","","","","","7","P 41","P 4w","76","","","","- C55 H49 B N2 O5 P2 Ru -","- C55 H49 B N2 O5 P2 Ru -","- C220 H196 B4 N8 O20 P8 Ru4 -","4","1","","Janes, Trevor; Osten, Kimberly M.; Pantaleo, Adam; Yan, Ellen; Yang, Yanxin; Song, Datong","Insertion of CO2 into the carbon-boron bond of a boronic ester ligand.","Chemical communications (Cambridge, England)","2016","52","22","4148","4151","10.1039/c6cc01257d","","","0.71073","MoKα","","0.1088","0.078","","","0.1662","0.1791","","","","","","1.072","","","","has coordinates,has disorder","181531","2020-10-21","18:00:00",""
"7118780","14.4273","0.0007","14.5211","0.001","21.5927","0.0015","100.551","0.002","91.968","0.002","102.418","0.002","4330.3","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H47 B N4 O2 Zn -","- C40 H47 B N4 O2 Zn -","- C160 H188 B4 N16 O8 Zn4 -","4","2","","Janes, Trevor; Osten, Kimberly M.; Pantaleo, Adam; Yan, Ellen; Yang, Yanxin; Song, Datong","Insertion of CO2 into the carbon-boron bond of a boronic ester ligand.","Chemical communications (Cambridge, England)","2016","52","22","4148","4151","10.1039/c6cc01257d","","","0.71073","MoKα","","0.1285","0.0554","","","0.1088","0.125","","","","","","0.883","","","","has coordinates,has disorder","181531","2020-10-21","18:00:00",""
"7118781","15.0418","0.0007","21.3952","0.0011","28.2235","0.0014","90","","90","","90","","9083","0.8","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C41 H47 B N4 O4 Zn -","- C41 H47 B N4 O4 Zn -","- C328 H376 B8 N32 O32 Zn8 -","8","1","","Janes, Trevor; Osten, Kimberly M.; Pantaleo, Adam; Yan, Ellen; Yang, Yanxin; Song, Datong","Insertion of CO2 into the carbon-boron bond of a boronic ester ligand.","Chemical communications (Cambridge, England)","2016","52","22","4148","4151","10.1039/c6cc01257d","","","0.71073","MoKα","","0.145","0.0737","","","0.1949","0.2156","","","","","","0.984","","","","has coordinates,has disorder","181531","2020-10-21","18:00:00",""
"7118782","21.309","0.0019","10.0652","0.0009","29.168","0.003","90","","108.052","0.004","90","","5948","1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H36 N4 Zn -","- C34 H36 N4 Zn -","- C272 H288 N32 Zn8 -","8","1","","Janes, Trevor; Osten, Kimberly M.; Pantaleo, Adam; Yan, Ellen; Yang, Yanxin; Song, Datong","Insertion of CO2 into the carbon-boron bond of a boronic ester ligand.","Chemical communications (Cambridge, England)","2016","52","22","4148","4151","10.1039/c6cc01257d","","","0.71073","MoKα","","0.0821","0.0434","","","0.0882","0.099","","","","","","1.002","","","","has coordinates","181531","2020-10-21","18:00:00",""
"7118783","13.97","0.006","25.545","0.01","8.975","0.004","90","","97.362","0.005","90","","3176","2","108","","108","","","","","","","","","5","C 1 c 1","C -2yc","9","","1_Pen","","- C30 H50 O4 Rh2 S2 -","- C30 H50 O4 Rh2 S2 -","- C120 H200 O16 Rh8 S8 -","4","1","","Nakai, Hidetaka; Matsuba, Kengo; Akimoto, Masataka; Nozaki, Tomonori; Matsumoto, Takahiro; Isobe, Kiyoshi; Irie, Masahiro; Ogo, Seiji","Photoinduced bending of rod-like millimetre-size crystals of a rhodium dithionite complex with n-pentyl moieties.","Chemical communications (Cambridge, England)","2016","52","23","4349","4352","10.1039/c6cc00059b","","","0.71075","MoKα","","0.0338","0.0311","","","0.0649","0.0664","","","","","","1.061","","","","has coordinates","181574","2020-10-21","18:00:00",""
"7118784","13.333","0.012","5.705","0.005","13.908","0.012","90","","91.316","0.008","90","","1057.6","1.6","273","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,6-ditosyl-1,5,2,6-dithiadiazocane","","- C9 H11 N O2 S2 -","- C9 H11 N O2 S2 -","- C36 H44 N4 O8 S8 -","4","1","","Javorskis, Tomas; Bagdžiūnas, Gintautas; Orentas, Edvinas","N-Tosyl-1,5,2,6-dithiadiazocane: a waste-free electrophilic sulfur reagent for the efficient synthesis of medium-ring S,N-heterocycles.","Chemical communications (Cambridge, England)","2016","52","23","4325","4328","10.1039/c6cc01068g","","","0.71075","MoKα","","","0.1423","","","","0.3845","","","","","","1.132","","","","has coordinates","181576","2020-10-21","18:00:00",""
"7118785","9.92","0.008","17.616","0.012","10.628","0.008","90","","111.511","0.009","90","","1728","2","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-tosyl-2,3-dihydro-1H-naphtho[2,1-b][1,4]thiazine","","- C19 H17 N O2 S2 -","- C19 H17 N O2 S2 -","- C76 H68 N4 O8 S8 -","4","1","","Javorskis, Tomas; Bagdžiūnas, Gintautas; Orentas, Edvinas","N-Tosyl-1,5,2,6-dithiadiazocane: a waste-free electrophilic sulfur reagent for the efficient synthesis of medium-ring S,N-heterocycles.","Chemical communications (Cambridge, England)","2016","52","23","4325","4328","10.1039/c6cc01068g","","","0.71075","MoKα","","","0.0466","","","","0.1371","","","","","","1.063","","","","has coordinates","181576","2020-10-21","18:00:00",""
"7118786","19.1433","0.0003","20.6439","0.0004","27.4002","0.0005","77.864","0.005","80.791","0.006","66.5","0.005","9673.2","0.5","80","2","80","2","","","","","","","","6","P -1","-P 1","2","","","","- C279 H156 Co18 N124 O83 W12 -","- C279 H156 Co18 N124 O83 W12 -","- C279 H156 Co18 N124 O83 W12 -","1","0.5","","Chorazy, Szymon; Rams, Michał; Hoczek, Anna; Czarnecki, Bernard; Sieklucka, Barbara; Ohkoshi, Shin-Ichi; Podgajny, Robert","Structural anisotropy of cyanido-bridged {CoW} single-molecule magnets induced by bidentate ligands: towards the rational enhancement of an energy barrier.","Chemical communications (Cambridge, England)","2016","52","26","4772","4775","10.1039/c5cc10371a","","x-ray","0.71075","MoKα","","0.1138","0.0953","","","0.1788","0.1852","","","","","","1.268","","","","has coordinates,has disorder","181538","2020-10-21","18:00:00",""
"7118787","17.367","0.003","17.367","0.003","13.73","0.003","90","","90","","90","","4141.1","1.4","293","2","293","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C68 H86 N12 O17 Ti4 -","- C68 H28 N12 O17 Ti4 -","- C136 H56 N24 O34 Ti8 -","2","0.25","","Su, Hu-Chao; Wu, Yin-Yin; Hou, Jin-Le; Zhang, Guang-Ling; Zhu, Qin-Yu; Dai, Jie","Dye molecule bonded titanium alkoxide: a possible new type of dye for sensitized solar cells.","Chemical communications (Cambridge, England)","2016","52","21","4072","4075","10.1039/c6cc00551a","","","0.71073","MoKα","","0.094","0.0807","","","0.1827","0.1887","","","","","","1.141","","","","has coordinates,has disorder","177684","2020-10-21","18:00:00",""
"7118788","23.2328","0.0016","9.5152","0.0006","20.7638","0.0014","90","","112.516","0.003","90","","4240.2","0.5","123","","123","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H35 F24 N13 P4 -","- C28 H35 F24 N13 P4 -","- C112 H140 F96 N52 P16 -","4","0.5","","Altmann, Philipp J.; Pöthig, Alexander","Capsoplexes: encapsulating complexes via guest recognition.","Chemical communications (Cambridge, England)","2016","52","58","9089","9092","10.1039/c6cc00507a","","x-ray","0.71073","MoKα","","0.0479","0.0406","","","0.1081","0.1154","","","","","","1.044","","","","has coordinates","211179","2020-10-21","18:00:00",""
"7118789","15.613","0.003","13.757","0.002","16.854","0.003","90","","96.309","0.009","90","","3598.1","1.1","100","","100","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H29 F12 N13 Ni2 P2 -","- C28 H29 F12 N13 Ni2 P2 -","- C112 H116 F48 N52 Ni8 P8 -","4","1","","Altmann, Philipp J.; Pöthig, Alexander","Capsoplexes: encapsulating complexes via guest recognition.","Chemical communications (Cambridge, England)","2016","52","58","9089","9092","10.1039/c6cc00507a","","x-ray","0.71073","MoKα","","0.0542","0.043","","","0.1108","0.1176","","","","","","1.072","","","","has coordinates,has disorder","211179","2020-10-21","18:00:00",""
"7118790","15.985","0.002","30.833","0.004","15.2616","0.0018","90","","93.494","0.008","90","","7507.9","1.6","100","","100","","","","","","","","see text","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H64 Br F18 N28 Ni4 P3 -","- C60 H64 Br F18 N28 Ni4 P3 -","- C240 H256 Br4 F72 N112 Ni16 P12 -","4","0.5","","Altmann, Philipp J.; Pöthig, Alexander","Capsoplexes: encapsulating complexes via guest recognition.","Chemical communications (Cambridge, England)","2016","52","58","9089","9092","10.1039/c6cc00507a","","x-ray","0.71073","MoKα","","0.0625","0.0443","","","0.1099","0.1191","","","","","","1.106","","","","has coordinates,has disorder","211179","2020-10-21","18:00:00",""
"7118791","16.233","0.003","31.342","0.005","15.432","0.002","90","","95.632","0.01","90","","7814","2","100","","100","","","","","","","","see text","8","C 1 2/c 1","-C 2yc","15","","","","- C64 H80 Cl F18 N28 Ni4 O4 P3 -","- C64 H80 Cl F18 N28 Ni4 O4 P3 -","- C256 H320 Cl4 F72 N112 Ni16 O16 P12 -","4","0.5","","Altmann, Philipp J.; Pöthig, Alexander","Capsoplexes: encapsulating complexes via guest recognition.","Chemical communications (Cambridge, England)","2016","52","58","9089","9092","10.1039/c6cc00507a","","x-ray","0.71073","MoKα","","0.0898","0.0453","","","0.0849","0.0984","","","","","","1.01","","","","has coordinates,has disorder","211179","2020-10-21","18:00:00",""
"7118792","33.231","0.003","33.231","0.003","28.78","0.002","90","","90","","90","","31782","5","100","2","100","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C336 H312 N48 O38 Pd6 -","- C336 H312 N48 O38 Pd6 -","- C672 H624 N96 O76 Pd12 -","2","0.125","","Roy, Bijan; Zangrando, Ennio; Mukherjee, Partha Sarathi","Self-assembly of a redox active water soluble Pd6L8 'molecular dice'.","Chemical communications (Cambridge, England)","2016","52","24","4489","4492","10.1039/c6cc00042h","","","0.77","synchrotron","","0.0973","0.08","","","0.2384","0.2563","","","","","","1.104","","","","has coordinates","181551","2020-10-21","18:00:00",""
"7118793","19.4538","0.0005","32.5779","0.0007","22.6155","0.0006","90","","103.876","0.002","90","","13914.6","0.6","100.01","0.1","100.01","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H26.5 Cu4 I4 N9 O3 -","- C33 H26.5 Cu4 I4 N9 O3 -","- C264 H212 Cu32 I32 N72 O24 -","8","2","","Zhao, Chao-Wei; Ma, Jian-Ping; Liu, Qi-Kui; Wang, Xue-Ru; Liu, Yi; Yang, Jing; Yang, Jia-Shi; Dong, Yu-Bin","An in situ self-assembled Cu4I4-MOF-based mixed matrix membrane: a highly sensitive and selective naked-eye sensor for gaseous HCl.","Chemical communications (Cambridge, England)","2016","52","30","5238","5241","10.1039/c6cc00189k","","x-ray","1.54184","CuKα","","0.1099","0.0946","","","0.2549","0.2755","","","","","","1.034","","","","has coordinates","182600","2020-10-21","18:00:00",""
"7118794","13.3756","0.0019","14.865","0.002","24.544","0.003","90","","91.671","0.003","90","","4878","1.1","115","","115","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H54 B2 F4 N8 O5 -","- C54 H54 B2 F4 N8 O5 -","- C216 H216 B8 F16 N32 O20 -","4","1","","Doulain, Pierre-Emmanuel; Goze, Christine; Bodio, Ewen; Richard, Philippe; Decréau, Richard A","BODIPY atropisomer interconversion, face discrimination, and superstructure appending.","Chemical communications (Cambridge, England)","2016","52","24","4474","4477","10.1039/c5cc10526a","","x-ray","0.71073","MoKα","","0.1503","0.0533","","","0.1015","0.1349","","","","","","0.983","","","","has coordinates,has disorder","181546","2020-10-21","18:00:00",""
"7118795","29.0096","0.0005","19.0252","0.0003","24.8069","0.0004","90","","111.599","0.001","90","","12729.9","0.4","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C123 H116 B4 F16 Ir2 N22 O7 Zn3 -","- C123 H114 B4 F16 Ir2 N22 O7.01 Zn3 -","- C492 H456 B16 F64 Ir8 N88 O28.04 Zn12 -","4","1","","Li, Xuezhao; Wu, Jinguo; He, Cheng; Zhang, Rong; Duan, Chunying","Multicomponent self-assembly of a pentanuclear Ir-Zn heterometal-organic polyhedron for carbon dioxide fixation and sulfite sequestration.","Chemical communications (Cambridge, England)","2016","52","29","5104","5107","10.1039/c6cc00064a","","","0.71073","MoKα","","0.099","0.052","","","0.1435","0.1648","","","","","","1.026","","","","has coordinates,has disorder","181560","2020-10-21","18:00:00",""
"7118796","29.505","0.0011","19.1096","0.0005","24.976","0.0008","90","","112.295","0.002","90","","13029.4","0.7","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Ir-Zn1","","- C116 H98 B4 F17 Ir2 N25 O3 Zn3 -","- C116.02 H93.03 B4 F17 Ir2 N25.01 O3 Zn3 -","- C464.08 H372.12 B16 F68 Ir8 N100.04 O12 Zn12 -","4","1","","Li, Xuezhao; Wu, Jinguo; He, Cheng; Zhang, Rong; Duan, Chunying","Multicomponent self-assembly of a pentanuclear Ir-Zn heterometal-organic polyhedron for carbon dioxide fixation and sulfite sequestration.","Chemical communications (Cambridge, England)","2016","52","29","5104","5107","10.1039/c6cc00064a","","","0.71073","MoKα","","0.1303","0.0749","","","0.2126","0.2446","","","","","","1.021","","","","has coordinates,has disorder","181560","2020-10-21","18:00:00",""
"7118797","29.347","0.003","18.8722","0.0016","25.16","0.002","90","","112.374","0.005","90","","12886","2","200","2","200","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","Ir-Zn3","","- C118 H104 B4 F16 Ir2 N24 O6 S Zn3 -","- C118 H100 B4 F16 Ir2 N24 O6 S Zn3 -","- C472 H400 B16 F64 Ir8 N96 O24 S4 Zn12 -","4","1","","Li, Xuezhao; Wu, Jinguo; He, Cheng; Zhang, Rong; Duan, Chunying","Multicomponent self-assembly of a pentanuclear Ir-Zn heterometal-organic polyhedron for carbon dioxide fixation and sulfite sequestration.","Chemical communications (Cambridge, England)","2016","52","29","5104","5107","10.1039/c6cc00064a","","","0.71073","MoKα","","0.1414","0.0737","","","0.1797","0.203","","","","","","1.012","","","","has coordinates,has disorder","181560","2020-10-21","18:00:00",""
"7118798","11.7938","0.0002","13.6822","0.0002","20.7195","0.0014","76.314","0.005","74.412","0.005","83.443","0.006","3124.4","0.2","293","2","293.15","","","","","","","","","7","P -1","-P 1","2","","","","- C45 H48 Au3 F18 N12 O P3 -","- C45 H48 Au3 F18 N12 O P3 -","- C90 H96 Au6 F36 N24 O2 P6 -","2","1","","Xiao, Xin-Shan; Zou, Chao; Guan, Xiangguo; Yang, Chen; Lu, Wei; Che, Chi-Ming","Homoleptic gold(i) N-heterocyclic allenylidene complexes: excited-state properties and lyotropic chromonics.","Chemical communications (Cambridge, England)","2016","52","28","4983","4986","10.1039/c5cc09571a","","","1.54187","CuKα","","0.059","0.05","","","0.1283","0.1467","","","","","","1.058","","","","has coordinates","181568","2020-10-21","18:00:00",""
"7118799","7.3239","0.0001","13.6625","0.0003","21.1998","0.0015","90","","90","","90","","2121.31","0.16","295","","295","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 Au F6 N2 O2 P -","- C16 H22 Au F6 N2 O2 P -","- C64 H88 Au4 F24 N8 O8 P4 -","4","1","","Xiao, Xin-Shan; Zou, Chao; Guan, Xiangguo; Yang, Chen; Lu, Wei; Che, Chi-Ming","Homoleptic gold(i) N-heterocyclic allenylidene complexes: excited-state properties and lyotropic chromonics.","Chemical communications (Cambridge, England)","2016","52","28","4983","4986","10.1039/c5cc09571a","","","1.54178","CuKα","","0.057","0.0445","","","0.1016","0.1367","","","","","","1.172","","","","has coordinates","181568","2020-10-21","18:00:00",""
"7118800","15.7075","0.0007","6.8525","0.0003","20.3447","0.001","90","","90","","90","","2189.81","0.17","100","","100","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C20 H21 Au F6 N3 P -","- C20 H21 Au F6 N3 P -","- C80 H84 Au4 F24 N12 P4 -","4","0.5","","Xiao, Xin-Shan; Zou, Chao; Guan, Xiangguo; Yang, Chen; Lu, Wei; Che, Chi-Ming","Homoleptic gold(i) N-heterocyclic allenylidene complexes: excited-state properties and lyotropic chromonics.","Chemical communications (Cambridge, England)","2016","52","28","4983","4986","10.1039/c5cc09571a","","","1.54178","CuKα","","0.056","0.0559","","","0.1323","0.1324","","","","","","1.123","","","","has coordinates,has disorder","181568","2020-10-21","18:00:00",""
"7118801","18.999","0.004","13.938","0.003","18.33","0.004","90","","100.52","0.03","90","","4772.3","1.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Compound S2","","- C45 H44 Cl Ir N4 O S2 -","- C45 H44 Cl Ir N4 O S2 -","- C180 H176 Cl4 Ir4 N16 O4 S8 -","4","1","","Tian, Cheng; Gong, Lei; Meggers, Eric","Chiral-at-metal iridium complex for efficient enantioselective transfer hydrogenation of ketones.","Chemical communications (Cambridge, England)","2016","52","22","4207","4210","10.1039/c6cc00972g","","","0.71073","MoKα","","0.0751","0.0597","","","0.1642","0.1909","","","","","","0.999","","","","has coordinates","181524","2020-10-21","18:00:00",""
"7118802","10.307","0.002","6.9664","0.0013","20.194","0.004","90","","92.558","0.003","90","","1448.5","0.5","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","6-methoxy-9-phenyl-3H-xanthen-3-one","","- C20 H14 O3 -","- C20 H14 O3 -","- C80 H56 O12 -","4","1","","Sezukuri, Kyohei; Suzuki, Mitsuharu; Hayashi, Hironobu; Kuzuhara, Daiki; Aratani, Naoki; Yamada, Hiroko","A laterally π-expanded fluorone dye as an efficient near infrared fluorophore.","Chemical communications (Cambridge, England)","2016","52","27","4872","4875","10.1039/c6cc00237d","","","0.71073","MoKα","","0.0931","0.0483","","","0.1064","0.1292","","","","","","1.002","","","","has coordinates","181553","2020-10-21","18:00:00",""
"7118803","6.4553","0.0014","15.35","0.003","15.588","0.003","90","","90","","90","","1544.6","0.5","90","","90","","","","","","","","","4","P n n a","-P 2a 2bc","52","","6-methoxy-9-phenyl-3H-xanthen-3-one, HBr complex","","- C19 H13 Br O3 -","- C19 H13 Br O3 -","- C76 H52 Br4 O12 -","4","0.5","","Sezukuri, Kyohei; Suzuki, Mitsuharu; Hayashi, Hironobu; Kuzuhara, Daiki; Aratani, Naoki; Yamada, Hiroko","A laterally π-expanded fluorone dye as an efficient near infrared fluorophore.","Chemical communications (Cambridge, England)","2016","52","27","4872","4875","10.1039/c6cc00237d","","","0.71073","MoKα","","0.045","0.0279","","","0.07","0.0791","","","","","","1.05","","","","has coordinates","181553","2020-10-21","18:00:00",""
"7118804","22.6443","0.0006","6.8474","0.0002","30.763","0.0008","90","","100.073","0.007","90","","4696.4","0.2","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","13-(2,6-difluorophenyl)-9-methoxy-3H-dibenzo[b,i]xanthen-3-one","","- C29 H18 Cl2 F2 O3 -","- C29 H18 Cl2 F2 O3 -","- C232 H144 Cl16 F16 O24 -","8","1","","Sezukuri, Kyohei; Suzuki, Mitsuharu; Hayashi, Hironobu; Kuzuhara, Daiki; Aratani, Naoki; Yamada, Hiroko","A laterally π-expanded fluorone dye as an efficient near infrared fluorophore.","Chemical communications (Cambridge, England)","2016","52","27","4872","4875","10.1039/c6cc00237d","","","0.71075","MoKα","","0.0894","0.0628","","","0.1588","0.1747","","","","","","1.046","","","","has coordinates,has disorder","181553","2020-10-21","18:00:00",""
"7118805","13.0764","0.0003","6.7268","0.0001","26.5912","0.0018","90","","99.083","0.007","90","","2309.69","0.17","85","2","85","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Phenobarbital","","","- C12 H12 N2 O3 -","- C12 H12 N2 O3 -","- C96 H96 N16 O24 -","8","2","","Roy, Saikat; Goud, N. Rajesh; Matzger, Adam J.","Polymorphism in phenobarbital: discovery of a new polymorph and crystal structure of elusive form V.","Chemical communications (Cambridge, England)","2016","52","23","4389","4392","10.1039/c6cc00959j","","","1.54187","CuKα","","0.1093","0.0876","","","0.2194","0.2379","","","","","","1.401","","","","has coordinates","181575","2020-10-21","18:00:00",""
"7118806","14.5744","0.0004","6.88","0.00019","22.9964","0.0016","90","","93.987","0.007","90","","2300.31","0.18","95","2","95","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Phenobarbital","","","- C12 H12 N2 O3 -","- C12 H12 N2 O3 -","- C96 H96 N16 O24 -","8","2","","Roy, Saikat; Goud, N. Rajesh; Matzger, Adam J.","Polymorphism in phenobarbital: discovery of a new polymorph and crystal structure of elusive form V.","Chemical communications (Cambridge, England)","2016","52","23","4389","4392","10.1039/c6cc00959j","","","1.54187","CuKα","","0.1831","0.0818","","","0.157","0.2328","","","","","","1.171","","","","has coordinates","181575","2020-10-21","18:00:00",""
"7118807","9.09127","0.00013","10.54359","0.00015","30.6974","0.0005","90","","90","","90","","2942.49","0.08","293","2","293.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H34 N2 O9 -","- C30 H34 N2 O9 -","- C120 H136 N8 O36 -","4","1","","Yu, Kuan; Gao, Beiling; Liu, Zhaobo; Ding, Hanfeng","Enantioselective total synthesis and structural reassignment of (+)-alsmaphorazine E via a traceless chirality transfer strategy.","Chemical communications (Cambridge, England)","2016","52","24","4485","4488","10.1039/c6cc00930a","","","1.54184","CuKα","","0.0357","0.0318","","","0.0773","0.0803","","","","","","1.046","","","","has coordinates","181552","2020-10-21","18:00:00",""
"7118808","7.323","0.0004","9.703","0.0006","13.3813","0.0008","90","","93.357","0.006","90","","949.18","0.1","169.6","","169.6","","","","","","","","","4","P 1 n 1","P -2yac","7","","C19-epi-ent-3","","- C21 H26 N2 O6 -","- C21 H26 N2 O6 -","- C42 H52 N4 O12 -","2","1","","Yu, Kuan; Gao, Beiling; Liu, Zhaobo; Ding, Hanfeng","Enantioselective total synthesis and structural reassignment of (+)-alsmaphorazine E via a traceless chirality transfer strategy.","Chemical communications (Cambridge, England)","2016","52","24","4485","4488","10.1039/c6cc00930a","","","0.71073","MoKα","","0.0442","0.039","","","0.0923","0.0968","","","","","","1.066","","","","has coordinates","181552","2020-10-21","18:00:00",""
"7118809","10.6315","0.0018","25.473","0.004","14.959","0.003","90","","90.028","0.003","90","","4051.1","1.2","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H40 Br2 Cl6 Fe N2 P2 -","- C36 H40 Br2 Cl6 Fe N2 P2 -","- C144 H160 Br8 Cl24 Fe4 N8 P8 -","4","1","","Ghosh, Chandrani; Groy, Thomas L.; Bowman, Amanda C.; Trovitch, Ryan J.","Two-step C-H, C-P bond activation at an α-diimine iron dinitrogen complex.","Chemical communications (Cambridge, England)","2016","52","24","4553","4556","10.1039/c5cc09167e","","","0.71073","MoKα","","0.0382","0.0331","","","0.0817","0.084","","","","","","1.031","","","","has coordinates","181548","2020-10-21","18:00:00",""
"7118810","9.2948","0.0005","12.9539","0.0007","13.7381","0.0007","79.3091","0.0008","77.1334","0.0009","72.6186","0.0008","1526.31","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H38 Fe N4 P2 -","- C34 H38 Fe N4 P2 -","- C68 H76 Fe2 N8 P4 -","2","1","","Ghosh, Chandrani; Groy, Thomas L.; Bowman, Amanda C.; Trovitch, Ryan J.","Two-step C-H, C-P bond activation at an α-diimine iron dinitrogen complex.","Chemical communications (Cambridge, England)","2016","52","24","4553","4556","10.1039/c5cc09167e","","","0.71073","MoKα","","0.0511","0.0373","","","0.0861","0.0925","","","","","","1.021","","","","has coordinates","181548","2020-10-21","18:00:00",""
"7118811","13.1669","0.0006","21.8049","0.0009","22.842","0.001","109.42","0.0007","104.575","0.0007","105.963","0.0007","5504.3","0.4","123","2","123","2","","","","","","","","5","P -1","-P 1","2","Ghosh_CG_002_141","","","- C61.84 H70.97 Fe2 N4 P4 -","- C61.838 H70.972 Fe2 N4 P4 -","- C247.352 H283.888 Fe8 N16 P16 -","4","2","","Ghosh, Chandrani; Groy, Thomas L.; Bowman, Amanda C.; Trovitch, Ryan J.","Two-step C-H, C-P bond activation at an α-diimine iron dinitrogen complex.","Chemical communications (Cambridge, England)","2016","52","24","4553","4556","10.1039/c5cc09167e","","","0.71073","MoKα","","0.0779","0.0448","","","0.0874","0.0977","","","","","","1.018","","","","has coordinates,has disorder","181548","2020-10-21","18:00:00",""
"7118812","18.281","0.003","7.3569","0.0012","19.925","0.004","90","","104.092","0.012","90","","2599.1","0.8","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H19 Br -","- C16 H19 Br -","- C128 H152 Br8 -","8","1","","Su, Xiang; Sun, Yihua; Yao, Jiannian; Chen, Hui; Chen, Chao","Acid-promoted bicyclization of arylacetylenes to benzobicyclo[3.2.1]octanes through cationic rearrangements.","Chemical communications (Cambridge, England)","2016","52","24","4537","4540","10.1039/c6cc00452k","","","0.71073","MoKα","","0.0697","0.0434","","","0.0876","0.0995","","","","","","1.279","","","","has coordinates","181549","2020-10-21","18:00:00",""
"7118813","17.283","0.003","19.422","0.003","15.933","0.003","90","","92.103","0.008","90","","5344.6","1.6","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H42 Fe N P3 -","- C26 H42 Fe N P3 -","- C208 H336 Fe8 N8 P24 -","8","2","","Lindley, Brian M.; Jacobs, Brian P.; MacMillan, Samantha N.; Wolczanski, Peter T.","Neutral Fe(iv) alkylidenes, including some that bind dinitrogen.","Chemical communications (Cambridge, England)","2016","52","20","3891","3894","10.1039/c5cc08825a","","","0.71073","MoKα","","0.0698","0.0468","","","0.1196","0.1331","","","","","","1.04","","","","has coordinates,has disorder","177100","2020-10-21","18:00:00",""
"7118814","10.6131","0.0006","14.2296","0.0009","19.7148","0.0012","90","","97.83","0.003","90","","2949.6","0.3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H41 Fe N3 P2 -","- C30 H41 Fe N3 P2 -","- C120 H164 Fe4 N12 P8 -","4","1","","Lindley, Brian M.; Jacobs, Brian P.; MacMillan, Samantha N.; Wolczanski, Peter T.","Neutral Fe(iv) alkylidenes, including some that bind dinitrogen.","Chemical communications (Cambridge, England)","2016","52","20","3891","3894","10.1039/c5cc08825a","","","0.71073","MoKα","","0.0571","0.0416","","","0.1076","0.1183","","","","","","1.032","","","","has coordinates","177100","2020-10-21","18:00:00",""
"7118815","20.0634","0.0015","17.3159","0.0012","15.642","0.002","90","","124.211","0.001","90","","4494","0.7","200","2","200","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C60 H54 Cl2 Cu4 N12 O35 W10 -","- C60 H48 Cl2 Cu4 N12 O35 W10 -","- C120 H96 Cl4 Cu8 N24 O70 W20 -","2","0.25","","Shi, Dongying; He, Cheng; Sun, Wenlong; Ming, Zheng; Meng, Changgong; Duan, Chunying","A photosensitizing decatungstate-based MOF as heterogeneous photocatalyst for the selective C-H alkylation of aliphatic nitriles.","Chemical communications (Cambridge, England)","2016","52","25","4714","4717","10.1039/c6cc00862c","","","0.71073","MoKα","","0.0683","0.0392","","","0.1038","0.1125","","","","","","1.072","","","","has coordinates","181542","2020-10-21","18:00:00",""
"7118816","20.0299","0.0016","17.2261","0.0014","15.8221","0.0013","90","","125.919","0.001","90","","4421.1","0.6","226","2","226","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C63 H53 Cl2 Cu4 N13 O33 W10 -","- C63 H51 Cl2 Cu4 N13 O33 W10 -","- C126 H102 Cl4 Cu8 N26 O66 W20 -","2","0.25","","Shi, Dongying; He, Cheng; Sun, Wenlong; Ming, Zheng; Meng, Changgong; Duan, Chunying","A photosensitizing decatungstate-based MOF as heterogeneous photocatalyst for the selective C-H alkylation of aliphatic nitriles.","Chemical communications (Cambridge, England)","2016","52","25","4714","4717","10.1039/c6cc00862c","","","0.71073","MoKα","","0.064","0.0405","","","0.1134","0.1306","","","","","","1.006","","","","has coordinates,has disorder","181542","2020-10-21","18:00:00",""
"7118817","22.5211","0.0011","12.1599","0.0006","7.8427","0.0004","90","","90","","90","","2147.76","0.19","100","","100","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Cp*H)Rh(bpy)Cl","","- C21 H26 Cl3 N2 Rh -","- C21 H26 Cl3 N2 Rh -","- C84 H104 Cl12 N8 Rh4 -","4","0.5","","Pitman, C. L.; Finster, O. N. L.; Miller, A. J. M.","Cyclopentadiene-mediated hydride transfer from rhodium complexes.","Chemical communications (Cambridge, England)","2016","52","58","9105","9108","10.1039/c6cc00575f","","","1.54178","CuKα","","0.0224","0.022","","","0.0549","0.0551","","","","","","1.113","","","","has coordinates,has disorder","185099","2020-10-21","18:00:00",""
"7118818","24.392","0.001","24.392","0.001","4.8236","0.0003","90","","90","","90","","2869.9","0.2","296","2","296","2","","","","","","","","4","I 41/a","-I 4ad","88","","dipyrrolo[1,2-b:1 ,2 -g][2,6]naphthyridine-5,11-dione","","- C18 H16 N2 O2 -","- C18 H16 N2 O2 -","- C144 H128 N16 O16 -","8","","","Grzybowski, Marek; Deperasińska, Irena; Chotkowski, Maciej; Banasiewicz, Marzena; Makarewicz, Artur; Kozankiewicz, Bolesław; Gryko, Daniel T.","Dipyrrolonaphthyridinediones - structurally unique cross-conjugated dyes.","Chemical communications (Cambridge, England)","2016","52","29","5108","5111","10.1039/c6cc01017b","","","1.54178","CuKα","","0.0538","0.0401","","","0.1033","0.1108","","","","","","1.045","","","","has coordinates","181562","2020-10-21","18:00:00",""
"7118819","11.1641","0.0001","16.6308","0.0001","17.5587","0.0001","90","","94.787","0.001","90","","3248.72","0.04","150","2","150","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H41 Fe N2 O4 P Si3 -","- C25 H41 Fe N2 O4 P Si3 -","- C100 H164 Fe4 N8 O16 P4 Si12 -","4","1","","Breit, Nora C.; Eisenhut, Carsten; Inoue, Shigeyoshi","Phosphinosilylenes as a novel ligand system for heterobimetallic complexes.","Chemical communications (Cambridge, England)","2016","52","32","5523","5526","10.1039/c6cc00601a","","x-ray","1.54184","CuKα","","0.0338","0.0304","","","0.0789","0.081","","","","","","1.029","","","","has coordinates,has disorder","182615","2020-10-21","18:00:00",""
"7118820","25.6547","0.0002","10.4018","0.0001","24.8836","0.0002","90","","91.797","0.001","90","","6637.05","0.1","150","2","150","0.1","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C53 H62 Fe2 N4 O18 P2 Si2 W2 -","- C53 H62 Fe2 N4 O18 P2 Si2 W2 -","- C212 H248 Fe8 N16 O72 P8 Si8 W8 -","4","0.5","","Breit, Nora C.; Eisenhut, Carsten; Inoue, Shigeyoshi","Phosphinosilylenes as a novel ligand system for heterobimetallic complexes.","Chemical communications (Cambridge, England)","2016","52","32","5523","5526","10.1039/c6cc00601a","","x-ray","1.54184","CuKα","","0.0334","0.031","","","0.0803","0.0827","","","","","","1.055","","","","has coordinates,has disorder","182615","2020-10-21","18:00:00",""
"7118821","12.5723","0.0001","13.3184","0.0001","13.6939","0.0001","90","","90","","90","","2292.95","0.03","150","0.1","150","0.1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 Fe N2 O4 P Si -","- C19 H25 Fe N2 O4 P Si -","- C76 H100 Fe4 N8 O16 P4 Si4 -","4","1","","Breit, Nora C.; Eisenhut, Carsten; Inoue, Shigeyoshi","Phosphinosilylenes as a novel ligand system for heterobimetallic complexes.","Chemical communications (Cambridge, England)","2016","52","32","5523","5526","10.1039/c6cc00601a","","x-ray","1.54184","CuKα","","0.0333","0.0301","","","0.0756","0.0774","","","","","","1.041","","","","has coordinates","182615","2020-10-21","18:00:00",""
"7118822","16.0853","0.0015","28.696","0.003","7.0062","0.0006","90","","96.758","0.003","90","","3211.5","0.5","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe(cinammic hydroxamate)3]","","","- C28.8 H30.2 Fe N3 O7.3 -","- C28.8 H30.2 Fe N3 O7.3 -","- C115.2 H120.8 Fe4 N12 O29.2 -","4","1","","Breit, Nora C.; Eisenhut, Carsten; Inoue, Shigeyoshi","Phosphinosilylenes as a novel ligand system for heterobimetallic complexes.","Chemical communications (Cambridge, England)","2016","52","32","5523","5526","10.1039/c6cc00601a","","","0.71073","MoKα","","0.1101","0.0729","","","0.1747","0.1899","","","","","","1.105","","","","has coordinates,has disorder","182615","2020-10-21","18:00:00",""
"7118823","11.936","0.0008","16.0501","0.0011","16.5597","0.0012","90","","90","","90","","3172.4","0.4","228","2","228","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 N5 O7 -","- C26 H44 N5 O7 -","- C104 H176 N20 O28 -","4","1","","Metrano, A. J.; Abascal, N. C.; Mercado, B. Q.; Paulson, E. K.; Miller, S. J.","Structural studies of β-turn-containing peptide catalysts for atroposelective quinazolinone bromination.","Chemical communications (Cambridge, England)","2016","52","26","4816","4819","10.1039/c6cc01428c","","","1.54178","CuKα","","0.0534","0.0504","","","0.1454","0.1513","","","","","","1.023","","","","has coordinates,has disorder","181535","2020-10-21","18:00:00",""
"7118824","11.7899","0.0008","15.9908","0.0011","16.3363","0.0011","90","","90","","90","","3079.9","0.4","93","2","93","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H48 N6 O6 -","- C27 H48 N6 O6 -","- C108 H192 N24 O24 -","4","1","","Metrano, A. J.; Abascal, N. C.; Mercado, B. Q.; Paulson, E. K.; Miller, S. J.","Structural studies of β-turn-containing peptide catalysts for atroposelective quinazolinone bromination.","Chemical communications (Cambridge, England)","2016","52","26","4816","4819","10.1039/c6cc01428c","","","1.54178","CuKα","","0.0307","0.0287","","","0.0784","0.0792","","","","","","1.06","","","","has coordinates","181535","2020-10-21","18:00:00",""
"7118825","15.268","0.0008","11.6042","0.0004","15.6622","0.0008","90","","115.596","0.007","90","","2502.6","0.2","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H30 N2 O4 -","- C29 H30 N2 O4 -","- C116 H120 N8 O16 -","4","1","","Li, Zhenghua; Sharma, Nandini; Sharma, Upendra K.; Jacobs, Jeroen; Van Meervelt, Luc; Van der Eycken, Erik V.","Ligand-controlled product selectivity in palladium-catalyzed domino post-Ugi construction of (spiro)polyheterocycles.","Chemical communications (Cambridge, England)","2016","52","32","5516","5519","10.1039/c6cc00784h","","","0.71073","MoKα","","0.0498","0.042","","","0.1005","0.1053","","","","","","1.101","","","","has coordinates","182611","2020-10-21","18:00:00",""
"7118826","9.0977","0.0004","16.6165","0.0007","17.6","0.0008","90","","96.066","0.004","90","","2645.7","0.2","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H32 F N3 O3 -","- C31 H32 F N3 O3 -","- C124 H128 F4 N12 O12 -","4","1","","Li, Zhenghua; Sharma, Nandini; Sharma, Upendra K.; Jacobs, Jeroen; Van Meervelt, Luc; Van der Eycken, Erik V.","Ligand-controlled product selectivity in palladium-catalyzed domino post-Ugi construction of (spiro)polyheterocycles.","Chemical communications (Cambridge, England)","2016","52","32","5516","5519","10.1039/c6cc00784h","","","0.71073","MoKα","","0.0517","0.0427","","","0.1026","0.1079","","","","","","1.066","","","","has coordinates","182611","2020-10-21","18:00:00",""
"7118827","9.0851","0.0003","16.648","0.0005","17.522","0.0005","90","","98.553","0.003","90","","2620.71","0.14","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H32 F N3 O3 -","- C31 H32 F N3 O3 -","- C124 H128 F4 N12 O12 -","4","1","","Li, Zhenghua; Sharma, Nandini; Sharma, Upendra K.; Jacobs, Jeroen; Van Meervelt, Luc; Van der Eycken, Erik V.","Ligand-controlled product selectivity in palladium-catalyzed domino post-Ugi construction of (spiro)polyheterocycles.","Chemical communications (Cambridge, England)","2016","52","32","5516","5519","10.1039/c6cc00784h","","","0.71073","MoKα","","0.0555","0.0479","","","0.1084","0.1124","","","","","","1.13","","","","has coordinates","182611","2020-10-21","18:00:00",""
"7118828","10.23","0.004","4.7903","0.0017","14.674","0.005","90","","108.855","0.008","90","","680.5","0.4","100","2","100","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 -","- C18 H18 -","- C36 H36 -","2","0.5","","Lungerich, Dominik; Nizovtsev, Alexey V.; Heinemann, Frank W.; Hampel, Frank; Meyer, Karsten; Majetich, George; Schleyer, Paul V. R.; Jux, Norbert","[18]Annulene put into a new perspective.","Chemical communications (Cambridge, England)","2016","52","25","4710","4713","10.1039/c6cc01309k","","","0.71073","MoKα","","0.061","0.0404","","","0.0881","0.0982","","","","","","1.072","","","","has coordinates,has disorder","181543","2020-10-21","18:00:00",""
"7118829","21.6492","0.0002","21.6492","0.0002","14.6312","0.0002","90","","90","","90","","6857.47","0.13","173.1","0.6","173.1","0.6","","","","","","","","2","I 41/a c d","-I 4bd 2c","142","","","","- C24 H12 -","- C24 H12 -","- C384 H192 -","16","","","Lungerich, Dominik; Nizovtsev, Alexey V.; Heinemann, Frank W.; Hampel, Frank; Meyer, Karsten; Majetich, George; Schleyer, Paul V. R.; Jux, Norbert","[18]Annulene put into a new perspective.","Chemical communications (Cambridge, England)","2016","52","25","4710","4713","10.1039/c6cc01309k","","x-ray","1.54184","CuKα","","0.045","0.0388","","","0.112","0.1203","","","","","","1.068","","","","has coordinates","181543","2020-10-21","18:00:00",""
"7118830","40.6845","0.0016","40.6845","0.0016","34.133","0.003","90","","90","","120","","48929","5","173","2","173","2","","","","","","","","6","P 63","P 6c","173","","","","- C192 H240 B6.25 F25 Fe4 N38 -","- C192 H240 B6.25 F25 Fe4 N36 -","- C1536 H1920 B50 F200 Fe32 N288 -","8","1.33333","","Zhang, Feng-Li; Chen, Jia-Qian; Qin, Long-Fang; Tian, Lei; Li, Zaijun; Ren, Xuehong; Gu, Zhi-Guo","Metal-center exchange of tetrahedral cages: single crystal to single crystal and spin-crossover properties.","Chemical communications (Cambridge, England)","2016","52","26","4796","4799","10.1039/c6cc00711b","","","0.71073","MoKα","","0.1977","0.1209","","","0.302","0.3466","","","","","","1.061","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7118831","23.2474","0.0007","23.2474","0.0007","23.2474","0.0007","90","","90","","90","","12563.9","0.7","173","2","173","2","","","","","","","","6","I 2 3","I 2 2 3","197","","","","- C192 H240 B4 F16 N36 Ni4 -","- C192 H240 B4 F16 N36 Ni1.32 -","- C384 H480 B8 F32 N72 Ni2.64 -","2","0.0833333","","Zhang, Feng-Li; Chen, Jia-Qian; Qin, Long-Fang; Tian, Lei; Li, Zaijun; Ren, Xuehong; Gu, Zhi-Guo","Metal-center exchange of tetrahedral cages: single crystal to single crystal and spin-crossover properties.","Chemical communications (Cambridge, England)","2016","52","26","4796","4799","10.1039/c6cc00711b","","","0.71073","MoKα","","0.1197","0.0702","","","0.1609","0.1812","","","","","","1.015","","","","has coordinates,has disorder","181537","2020-10-21","18:00:00",""
"7118832","23.2506","0.0008","23.2506","0.0008","23.2506","0.0008","90","","90","","90","","12569.1","0.7","173","2","173","2","","","","","","","","7","I 2 3","I 2 2 3","197","","","","- C192 H240 B4 F16 Fe0.8 N36 Ni3.2 -","- C192 H240 B4 F16 Fe0.8 N36 Ni3.2 -","- C384 H480 B8 F32 Fe1.6 N72 Ni6.4 -","2","0.0833333","","Zhang, Feng-Li; Chen, Jia-Qian; Qin, Long-Fang; Tian, Lei; Li, Zaijun; Ren, Xuehong; Gu, Zhi-Guo","Metal-center exchange of tetrahedral cages: single crystal to single crystal and spin-crossover properties.","Chemical communications (Cambridge, England)","2016","52","26","4796","4799","10.1039/c6cc00711b","","","0.71073","MoKα","","0.1429","0.0912","","","0.2277","0.247","","","","","","1.198","","","","has coordinates,has disorder","181537","2020-10-21","18:00:00",""
"7118833","13.9256","0.0009","10.3322","0.0007","17.0868","0.0011","90","","94.647","0.001","90","","2450.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-4-(4-methoxyphenyl)-1-(methylsulfonyl)-2-(tosylmethylene)-2,3-dihydro-1H-benzo[b]azepine","","- C26 H25 N O5 S2 -","- C26 H25 N O5 S2 -","- C104 H100 N4 O20 S8 -","4","1","","Undeela, Sridhar; Ravikumar, Gurram; Nanubolu, Jagadeesh Babu; Singarapu, Kiran Kumar; Menon, Rajeev S.","The facile synthesis of 1-benzoazepine derivatives via gold-catalyzed regioselective cycloisomerization reactions of N-(o-alkynylaryl)-N-vinyl sulfonamides.","Chemical communications (Cambridge, England)","2016","52","26","4824","4827","10.1039/c6cc01061j","","","0.71073","MoKα","","0.0529","0.0469","","","0.1193","0.1243","","","","","","1.084","","","","has coordinates","181533","2020-10-21","18:00:00",""
"7118834","9.7246","0.0006","11.0418","0.0006","12.8181","0.0007","70.832","0.001","71.93","0.001","88.331","0.001","1231.88","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","7-chloro-4-(4-methoxyphenyl)-1-(methylsulfonyl)-2-(tosylmethyl)-1H-benzo[b]azepine","","- C26 H24 Cl N O5 S2 -","- C26 H24 Cl N O5 S2 -","- C52 H48 Cl2 N2 O10 S4 -","2","1","","Undeela, Sridhar; Ravikumar, Gurram; Nanubolu, Jagadeesh Babu; Singarapu, Kiran Kumar; Menon, Rajeev S.","The facile synthesis of 1-benzoazepine derivatives via gold-catalyzed regioselective cycloisomerization reactions of N-(o-alkynylaryl)-N-vinyl sulfonamides.","Chemical communications (Cambridge, England)","2016","52","26","4824","4827","10.1039/c6cc01061j","","","0.71073","MoKα","","0.0463","0.0404","","","0.1035","0.1075","","","","","","1.026","","","","has coordinates","181533","2020-10-21","18:00:00",""
"7118835","23.8009","0.0006","3.8485","0.0001","26.3591","0.0008","90","","113.997","0.0018","90","","2205.75","0.11","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,5-di(pyren-2-yl)thiophene","BPyT","","- C36 H20 S -","- C36 H20 S -","- C144 H80 S4 -","4","1","","Oniwa, Kazuaki; Kikuchi, Hiromasa; Shimotani, Hidekazu; Ikeda, Susumu; Asao, Naoki; Yamamoto, Yoshinori; Tanigaki, Katsumi; Jin, Tienan","2-Positional pyrene end-capped oligothiophenes for high performance organic field effect transistors.","Chemical communications (Cambridge, England)","2016","52","26","4800","4803","10.1039/c6cc00948d","","","1.54187","CuKα","","0.0564","0.0532","","","0.1465","0.1526","","","","","","1.102","","","","has coordinates","181534","2020-10-21","18:00:00",""
"7118836","22.725","0.007","3.8289","0.0009","15.667","0.005","90","","109.481","0.015","90","","1285.2","0.7","90","","90","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5,5'-di(pyren-2-yl)-2,2'-bithiophene","BPy2T","","- C40 H22 S2 -","- C40 H22 S2 -","- C80 H44 S4 -","2","0.5","","Oniwa, Kazuaki; Kikuchi, Hiromasa; Shimotani, Hidekazu; Ikeda, Susumu; Asao, Naoki; Yamamoto, Yoshinori; Tanigaki, Katsumi; Jin, Tienan","2-Positional pyrene end-capped oligothiophenes for high performance organic field effect transistors.","Chemical communications (Cambridge, England)","2016","52","26","4800","4803","10.1039/c6cc00948d","","","1.54187","CuKα","","","0.0716","","","","0.2278","","","","","","1.077","","","","has coordinates","181534","2020-10-21","18:00:00",""
"7118837","13.666","0.003","15.154","0.003","15.228","0.003","90","","101.24","0.03","90","","3093.1","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H9 Dy N2 O6.5 -","- C15 H8 Dy N2 O6.5 -","- C120 H64 Dy8 N16 O52 -","8","1","","Liu, Cai-Ming; Zhang, De-Qing; Zhu, Dao-Ben","A 3D MOF constructed from dysprosium(iii) oxalate and capping ligands: ferromagnetic coupling and field-induced two-step magnetic relaxation.","Chemical communications (Cambridge, England)","2016","52","26","4804","4807","10.1039/c6cc00498a","","","0.71073","MoKα","","0.0337","0.0308","","","0.0638","0.0654","","","","","","1.106","","","","has coordinates","181536","2020-10-21","18:00:00",""
"7118838","6.799","0.003","8.219","0.003","13.376","0.004","82.308","0.009","75.542","0.007","83.754","0.01","715.1","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","azaheptalene","","- C38 H12 F10 N4 -","- C38 H12 F10 N4 -","- C38 H12 F10 N4 -","1","0.5","","Gadekar, Santosh C.; Reddy, Baddigam K.; Panchal, Santosh P.; Anand, Venkataramanarao G.","Metal assisted cyclomerization of benzodipyrrins into expanded norroles, aza-heptalene and acyclic dimers.","Chemical communications (Cambridge, England)","2016","52","24","4565","4568","10.1039/c5cc10356h","","","0.71073","MoKα","","0.1656","0.1119","","","0.3271","0.3393","","","","","","1.923","","","","has coordinates","181547","2020-10-21","18:00:00",""
"7118839","9.9304","0.0018","12.231","0.002","14.545","0.003","75.314","0.004","82.512","0.004","80.77","0.004","1679.3","0.5","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C41 H22 F10 N4 O -","- C41 H22 F10 N4 O -","- C82 H44 F20 N8 O2 -","2","1","","Gadekar, Santosh C.; Reddy, Baddigam K.; Panchal, Santosh P.; Anand, Venkataramanarao G.","Metal assisted cyclomerization of benzodipyrrins into expanded norroles, aza-heptalene and acyclic dimers.","Chemical communications (Cambridge, England)","2016","52","24","4565","4568","10.1039/c5cc10356h","","","0.71073","MoKα","","0.1342","0.0524","","","0.1091","0.1372","","","","","","0.941","","","","has coordinates","181547","2020-10-21","18:00:00",""
"7118840","10.144","0.002","12.998","0.003","25.579","0.005","90","","96.312","0.004","90","","3352.2","1.2","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H18 F10 N4 -","- C46 H18 F10 N4 -","- C184 H72 F40 N16 -","4","1","","Gadekar, Santosh C.; Reddy, Baddigam K.; Panchal, Santosh P.; Anand, Venkataramanarao G.","Metal assisted cyclomerization of benzodipyrrins into expanded norroles, aza-heptalene and acyclic dimers.","Chemical communications (Cambridge, England)","2016","52","24","4565","4568","10.1039/c5cc10356h","","","0.71073","MoKα","","0.1357","0.0586","","","0.1449","0.183","","","","","","0.972","","","","has coordinates","181547","2020-10-21","18:00:00",""
"7118841","12.261","0.006","13.38","0.006","14.218","0.006","77.74","0.009","81.518","0.01","89.721","0.012","2253.5","1.8","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C57 H36 N6 O4 -","- C57 H36 N6 O4 -","- C114 H72 N12 O8 -","2","1","","Gadekar, Santosh C.; Reddy, Baddigam K.; Panchal, Santosh P.; Anand, Venkataramanarao G.","Metal assisted cyclomerization of benzodipyrrins into expanded norroles, aza-heptalene and acyclic dimers.","Chemical communications (Cambridge, England)","2016","52","24","4565","4568","10.1039/c5cc10356h","","","0.71073","MoKα","","0.2447","0.1061","","","0.2889","0.3764","","","","","","1","","","","has coordinates","181547","2020-10-21","18:00:00",""
"7118842","8.6387","0.0019","14.094","0.003","42.764","0.01","90","","91.418","0.005","90","","5205","2","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62 H21 F15 N6 O3 -","- C62 H21 F15 N6 O3 -","- C248 H84 F60 N24 O12 -","4","1","","Gadekar, Santosh C.; Reddy, Baddigam K.; Panchal, Santosh P.; Anand, Venkataramanarao G.","Metal assisted cyclomerization of benzodipyrrins into expanded norroles, aza-heptalene and acyclic dimers.","Chemical communications (Cambridge, England)","2016","52","24","4565","4568","10.1039/c5cc10356h","","","0.71073","MoKα","","0.1785","0.1046","","","0.2612","0.2842","","","","","","1.554","","","","has coordinates","181547","2020-10-21","18:00:00",""
"7118843","14.1965","0.0004","21.9607","0.0007","16.3804","0.0005","90","","111.904","0.0015","90","","4738.2","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C86 H132 N16 O16 -","- C86 H132 N16 O16 -","- C172 H264 N32 O32 -","2","1","","Bandyopadhyay, Anupam; Misra, Rajkumar; Gopi, Hosahudya N.","Structural features and molecular aggregations of designed triple-stranded β-sheets in single crystals.","Chemical communications (Cambridge, England)","2016","52","27","4938","4941","10.1039/c6cc00127k","","","1.54178","CuKα","","0.0919","0.0719","","","0.1932","0.2196","","","","","","0.824","","","","has coordinates","181555","2020-10-21","18:00:00",""
"7118844","12.367","0.003","13.818","0.003","16.091","0.005","105.224","0.006","97.197","0.006","113.827","0.004","2342.2","1.1","100","2","100","2","","","","","","","","4","P 1","P 1","1","Alpha-gamma hybrid peptide","","","- C79 H134 N16 O16 -","- C79 H134 N16 O16 -","- C79 H134 N16 O16 -","1","1","","Bandyopadhyay, Anupam; Misra, Rajkumar; Gopi, Hosahudya N.","Structural features and molecular aggregations of designed triple-stranded β-sheets in single crystals.","Chemical communications (Cambridge, England)","2016","52","27","4938","4941","10.1039/c6cc00127k","","","0.71073","MoKα","","0.0957","0.064","","","0.1578","0.1734","","","","","","0.993","","","","has coordinates","181555","2020-10-21","18:00:00",""
"7118845","9.024","0.003","15.783","0.008","12.907","0.005","90","","96.65","0.02","90","","1825.9","1.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 B2 F2 -","- C20 H26 B2 F2 -","- C80 H104 B8 F8 -","4","1","","Arnold, Nicole; Braunschweig, Holger; Damme, Alexander; Dewhurst, Rian D.; Pentecost, Leanne; Radacki, Krzysztof; Stellwag-Konertz, Sascha; Thiess, Torsten; Trumpp, Alexandra; Vargas, Alfredo","New outcomes of Lewis base addition to diboranes(4): electronic effects override strong steric disincentives.","Chemical communications (Cambridge, England)","2016","52","27","4898","4901","10.1039/c6cc01493c","","","0.71073","MoKα","","0.0558","0.041","","","0.1001","0.1082","","","","","","1.043","","","","has coordinates","181556","2020-10-21","18:00:00",""
"7118846","8.463","0.002","14.865","0.0019","32.625","0.011","90","","90","","90","","4104.3","1.8","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H31 B2 F2 P -","- C21 H31 B2 F2 P -","- C168 H248 B16 F16 P8 -","8","1","","Arnold, Nicole; Braunschweig, Holger; Damme, Alexander; Dewhurst, Rian D.; Pentecost, Leanne; Radacki, Krzysztof; Stellwag-Konertz, Sascha; Thiess, Torsten; Trumpp, Alexandra; Vargas, Alfredo","New outcomes of Lewis base addition to diboranes(4): electronic effects override strong steric disincentives.","Chemical communications (Cambridge, England)","2016","52","27","4898","4901","10.1039/c6cc01493c","","","0.71073","MoKα","","0.0594","0.0435","","","0.0991","0.1059","","","","","","1.065","","","","has coordinates,has disorder","181556","2020-10-21","18:00:00",""
"7118847","10.3","0.006","14.375","0.01","15.204","0.009","90","","104.85","0.014","90","","2176","2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H31 B2 F2 O3 P -","- C21 H31 B2 F2 O3 P -","- C84 H124 B8 F8 O12 P4 -","4","1","","Arnold, Nicole; Braunschweig, Holger; Damme, Alexander; Dewhurst, Rian D.; Pentecost, Leanne; Radacki, Krzysztof; Stellwag-Konertz, Sascha; Thiess, Torsten; Trumpp, Alexandra; Vargas, Alfredo","New outcomes of Lewis base addition to diboranes(4): electronic effects override strong steric disincentives.","Chemical communications (Cambridge, England)","2016","52","27","4898","4901","10.1039/c6cc01493c","","","0.71073","MoKα","","0.0758","0.0545","","","0.1343","0.1455","","","","","","1.059","","","","has coordinates,has disorder","181556","2020-10-21","18:00:00",""
"7118848","11.043","0.002","11.083","0.004","14.473","0.003","92.267","0.009","92.359","0.01","113.535","0.01","1619.6","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H44 B2 Cl2 F2 N4 -","- C33 H44 B2 Cl2 F2 N4 -","- C66 H88 B4 Cl4 F4 N8 -","2","1","","Arnold, Nicole; Braunschweig, Holger; Damme, Alexander; Dewhurst, Rian D.; Pentecost, Leanne; Radacki, Krzysztof; Stellwag-Konertz, Sascha; Thiess, Torsten; Trumpp, Alexandra; Vargas, Alfredo","New outcomes of Lewis base addition to diboranes(4): electronic effects override strong steric disincentives.","Chemical communications (Cambridge, England)","2016","52","27","4898","4901","10.1039/c6cc01493c","","","0.71073","MoKα","","0.0666","0.0603","","","0.1703","0.1768","","","","","","1.055","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7118849","11.253","0.002","11.41","0.002","14.135","0.003","69.313","0.003","74.449","0.003","84.848","0.004","1635.7","0.5","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H14 B2 Cl2 F15 N O2 -","- C32 H14 B2 Cl2 F15 N O2 -","- C64 H28 B4 Cl4 F30 N2 O4 -","2","1","","Zheng, Junhao; Fan, Xiaoting; Zhou, Benyu; Li, Zhen Hua; Wang, Huadong","Tautomerization of 2,6-lutidines in the presence of B(C6F5)3 using catecholborane as a precatalyst.","Chemical communications (Cambridge, England)","2016","52","25","4655","4658","10.1039/c6cc00347h","","","0.71073","MoKα","","0.1992","0.108","","","0.2991","0.3546","","","","","","1.024","","","","has coordinates,has disorder","181541","2020-10-21","18:00:00",""
"7118850","7.69","0.005","18.994","0.011","15.963","0.01","90","","92.675","0.008","90","","2329","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H9 B F15 N -","- C25 H9 B F15 N -","- C100 H36 B4 F60 N4 -","4","1","","Zheng, Junhao; Fan, Xiaoting; Zhou, Benyu; Li, Zhen Hua; Wang, Huadong","Tautomerization of 2,6-lutidines in the presence of B(C6F5)3 using catecholborane as a precatalyst.","Chemical communications (Cambridge, England)","2016","52","25","4655","4658","10.1039/c6cc00347h","","","0.71073","MoKα","","0.0781","0.0444","","","0.1081","0.1219","","","","","","0.961","","","","has coordinates","181541","2020-10-21","18:00:00",""
"7118851","11.3397","0.0013","20.295","0.002","13.45","0.0016","90","","114.44","0.004","90","","2818","0.5","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","triethyl 3-(4-chlorophenyl)-5-fluoro-1-tosyl-1H-pyrrole-2,2,4(3H)-tricarboxylate","","- C26 H27 Cl F N O8 S -","- C26 H27 Cl F N O8 S -","- C104 H108 Cl4 F4 N4 O32 S4 -","4","1","","Yang, Jieru; Zhou, Xiaofan; Zeng, Yu; Huang, Chaoqian; Xiao, Yuanjing; Zhang, Junliang","Synthesis of 2-fluoro-2-pyrrolines via tandem reaction of α-trifluoromethyl-α,β-unsaturated carbonyl compounds with N-tosylated 2-aminomalonates.","Chemical communications (Cambridge, England)","2016","52","27","4922","4925","10.1039/c6cc00831c","","","0.71073","MoKα","","0.0946","0.054","","","0.1386","0.1664","","","","","","1.021","","","","has coordinates","181554","2020-10-21","18:00:00",""
"7118852","19.7366","0.0015","11.0069","0.0008","14.8933","0.0011","90","","130.433","0.001","90","","2462.7","0.3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H10 N2 O2 -","- C15 H10 N2 O2 -","- C120 H80 N16 O16 -","8","1","","Fan, Liwen; Wang, Tao; Tian, Ying; Xiong, Fei; Wu, Simei; Liang, Qingjin; Zhao, Junfeng","Copper-catalyzed oxidative coupling between quinazoline 3-oxides and unactivated aldehydes: an efficient approach to functionalized quinazolines.","Chemical communications (Cambridge, England)","2016","52","31","5375","5378","10.1039/c6cc00946h","","","0.71073","MoKα","","0.0621","0.0443","","","0.1258","0.1394","","","","","","1.046","","","","has coordinates","182602","2020-10-21","18:00:00",""
"7118853","6.8611","0.0004","18.3584","0.0011","9.5657","0.0006","90","","90.0894","0.0007","90","","1204.88","0.13","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 N2 O3 -","- C15.045 H10 N2.006 O3.009 -","- C60.18 H40 N8.024 O12.036 -","4","1","","Fan, Liwen; Wang, Tao; Tian, Ying; Xiong, Fei; Wu, Simei; Liang, Qingjin; Zhao, Junfeng","Copper-catalyzed oxidative coupling between quinazoline 3-oxides and unactivated aldehydes: an efficient approach to functionalized quinazolines.","Chemical communications (Cambridge, England)","2016","52","31","5375","5378","10.1039/c6cc00946h","","","0.71073","MoKα","","0.0517","0.0477","","","0.1218","0.1251","","","","","","1.043","","","","has coordinates,has disorder","182602","2020-10-21","18:00:00",""
"7118854","8.9379","0.0013","10.7203","0.0016","11.0337","0.0016","118.687","0.002","110.073","0.002","93.964","0.002","835.3","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H17 N O4 -","- C19 H17 N O4 -","- C38 H34 N2 O8 -","2","1","","Tiwari, Dipak Kumar; Phanindrudu, Mandalaparthi; Aravilli, Vinod Kumar; Sridhar, B.; Likhar, Pravin R.; Tiwari, Dharmendra Kumar","Magnetically recoverable Cu(0)/Fe3O4 catalyzed highly regioselective synthesis of 2,3,4-trisubstituted pyrroles from unactivated terminal alkynes and isocyanides.","Chemical communications (Cambridge, England)","2016","52","25","4675","4678","10.1039/c6cc00459h","","","0.71073","MoKα","","0.0669","0.058","","","0.2109","0.2191","","","","","","1.122","","","","has coordinates","181544","2020-10-21","18:00:00",""
"7118855","19.9224","0.0008","14.1721","0.0006","10.3924","0.0004","90","","111.833","0.002","90","","2723.75","0.19","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H21 K N5 O10 Yb -","- C23 H21 K N5 O10 Yb -","- C92 H84 K4 N20 O40 Yb4 -","4","0.5","","Chen, Wanmin; Tang, Xiaoliang; Dou, Wei; Ju, Zhenghua; Xu, Benhua; Xu, Wenxuan; Liu, Weisheng","K(+)-Induced in situ self-assembly of near-infrared luminescent membrane material armored with bigger Yb(iii) complex crystallites.","Chemical communications (Cambridge, England)","2016","52","29","5124","5127","10.1039/c6cc01938b","","","0.71073","MoKα","","0.0225","0.0202","","","0.0525","0.054","","","","","","1.006","","","","has coordinates","181565","2020-10-21","18:00:00",""
"7118856","10.5784","0.0006","17.3413","0.001","16.6413","0.0009","90","","104.996","0.003","90","","2948.8","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H29 Li N5 O12 Yb -","- C25 H29 Li N5 O12 Yb -","- C100 H116 Li4 N20 O48 Yb4 -","4","1","","Chen, Wanmin; Tang, Xiaoliang; Dou, Wei; Ju, Zhenghua; Xu, Benhua; Xu, Wenxuan; Liu, Weisheng","K(+)-Induced in situ self-assembly of near-infrared luminescent membrane material armored with bigger Yb(iii) complex crystallites.","Chemical communications (Cambridge, England)","2016","52","29","5124","5127","10.1039/c6cc01938b","","","0.71073","MoKα","","0.0466","0.0297","","","0.0638","0.071","","","","","","1.017","","","","has coordinates,has disorder","181565","2020-10-21","18:00:00",""
"7118857","10.5784","0.0006","17.3413","0.001","16.6413","0.0009","90","","104.996","0.003","90","","2948.8","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H29 N5 Na O12 Yb -","- C25 H29 N5 Na O12 Yb -","- C100 H116 N20 Na4 O48 Yb4 -","4","1","","Chen, Wanmin; Tang, Xiaoliang; Dou, Wei; Ju, Zhenghua; Xu, Benhua; Xu, Wenxuan; Liu, Weisheng","K(+)-Induced in situ self-assembly of near-infrared luminescent membrane material armored with bigger Yb(iii) complex crystallites.","Chemical communications (Cambridge, England)","2016","52","29","5124","5127","10.1039/c6cc01938b","","","0.71073","MoKα","","0.0434","0.0292","","","0.0599","0.0649","","","","","","1.015","","","","has coordinates","181565","2020-10-21","18:00:00",""
"7118858","12.2689","0.001","13.8207","0.0011","16.0314","0.0015","89.063","0.004","84.408","0.005","88.521","0.004","2704.3","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H84 N20 O40 Rb4 Yb4 -","- C92 H84 N20 O40 Rb4 Yb4 -","- C92 H84 N20 O40 Rb4 Yb4 -","1","0.5","","Chen, Wanmin; Tang, Xiaoliang; Dou, Wei; Ju, Zhenghua; Xu, Benhua; Xu, Wenxuan; Liu, Weisheng","K(+)-Induced in situ self-assembly of near-infrared luminescent membrane material armored with bigger Yb(iii) complex crystallites.","Chemical communications (Cambridge, England)","2016","52","29","5124","5127","10.1039/c6cc01938b","","","0.71073","MoKα","","0.1492","0.0666","","","0.1275","0.1465","","","","","","1.004","","","","has coordinates,has disorder","181565","2020-10-21","18:00:00",""
"7118859","18.668","0.018","17.357","0.017","16.785","0.017","90","","102.458","0.011","90","","5311","9","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H42 N9 O17 Rb Yb2 -","- C46 H42 N9 O17 Rb Yb2 -","- C184 H168 N36 O68 Rb4 Yb8 -","4","0.5","","Chen, Wanmin; Tang, Xiaoliang; Dou, Wei; Ju, Zhenghua; Xu, Benhua; Xu, Wenxuan; Liu, Weisheng","K(+)-Induced in situ self-assembly of near-infrared luminescent membrane material armored with bigger Yb(iii) complex crystallites.","Chemical communications (Cambridge, England)","2016","52","29","5124","5127","10.1039/c6cc01938b","","","0.71073","MoKα","","0.0945","0.043","","","0.0862","0.1016","","","","","","1.01","","","","has coordinates,has disorder","181565","2020-10-21","18:00:00",""
"7118860","23.108","0.003","23.108","0.003","56.327","0.011","90","","90","","120","","26048","7","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C232.5 H275.5 Cl8 Cu32 N67.5 O57 -","- C222.654 H237.09 Cl8 Cu32 N64.218 O42 -","- C667.962 H711.27 Cl24 Cu96 N192.654 O126 -","3","0.166667","","Feng, Sisi; Jia, Fei; Lu, Liping; Li, Zhongping; Zhang, Shuo","An unusual 32-membered copper(ii) metallomacrocube based on a Cu4O3X cubic core: photocatalytic, electrocatalytic, and magnetic properties.","Chemical communications (Cambridge, England)","2016","52","23","4294","4297","10.1039/c6cc00399k","","","0.72","synchrotron","","0.1204","0.078","","","0.231","0.2585","","","","","","0.996","","","","has coordinates,has disorder","178124","2020-10-21","18:00:00",""
"7118861","14.7059","0.0003","18.0236","0.0004","19.3772","0.0004","90","","90","","90","","5135.99","0.19","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C50 H73 Br N3 Na O10 -","- C50 H73 Br N3 Na O10 -","- C200 H292 Br4 N12 Na4 O40 -","4","1","","Shi, Qiuyan; Li, Yu; Bo, Shaowei; Li, Xiaofei; Zhao, Peng; Liu, Qi; Yang, Zhigang; Cong, Hengjiang; Deng, Hexiang; Chen, Mingnan; Chen, Shizhen; Zhou, Xin; Ding, Hong; Jiang, Zhong-Xing","Discovery of a (19)F MRI sensitive salinomycin derivative with high cytotoxicity towards cancer cells.","Chemical communications (Cambridge, England)","2016","52","29","5136","5139","10.1039/c6cc01508e","","","1.54178","CuKα","","0.0431","0.042","","","0.1185","0.1198","","","","","","1.035","","","","has coordinates,has disorder","181558","2020-10-21","18:00:00",""
"7118862","13.5526","0.0001","13.5526","0.0001","57.9362","0.0006","90","","90","","90","","10641.3","0.16","296","2","296","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C50 H75 Br K N3 O11 -","- C50 H75 Br K N3 O11 -","- C400 H600 Br8 K8 N24 O88 -","8","1","","Shi, Qiuyan; Li, Yu; Bo, Shaowei; Li, Xiaofei; Zhao, Peng; Liu, Qi; Yang, Zhigang; Cong, Hengjiang; Deng, Hexiang; Chen, Mingnan; Chen, Shizhen; Zhou, Xin; Ding, Hong; Jiang, Zhong-Xing","Discovery of a (19)F MRI sensitive salinomycin derivative with high cytotoxicity towards cancer cells.","Chemical communications (Cambridge, England)","2016","52","29","5136","5139","10.1039/c6cc01508e","","","1.54178","CuKα","","0.0445","0.0416","","","0.1132","0.1157","","","","","","1.038","","","","has coordinates,has disorder","181558","2020-10-21","18:00:00",""
"7118863","10.5042","0.0009","12.4115","0.0011","22.3482","0.0019","75.394","0.001","77.732","0.001","86.444","0.001","2754.9","0.4","90","2","90","2","","","","","","","","6","P -1","-P 1","2","Ru(dppe)2(CCPy)2","Ru(dppe)2(CCPy)2","","- C67 H58 Cl2 N2 P4 Ru -","- C67 H58 Cl2 N2 P4 Ru -","- C134 H116 Cl4 N4 P8 Ru2 -","2","1","","Sugimoto, Kaho; Tanaka, Yuya; Fujii, Shintaro; Tada, Tomofumi; Kiguchi, Manabu; Akita, Munetaka","Organometallic molecular wires as versatile modules for energy-level alignment of the metal-molecule-metal junction.","Chemical communications (Cambridge, England)","2016","52","34","5796","5799","10.1039/c6cc01705c","","","0.71073","MoKα","","0.0458","0.035","","","0.109","0.1195","","","","","","0.929","","","","has coordinates","182606","2020-10-21","18:00:00",""
"7118864","11.91371","0.00017","15.9042","0.0002","21.6218","0.0004","90","","91.0689","0.0014","90","","4096.14","0.11","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H30 Bi2 Br13 N3 -","- C21 H30 Bi2 Br13 N3 -","- C84 H120 Bi8 Br52 N12 -","4","0.5","","Adonin, Sergey A.; Gorokh, Igor D.; Samsonenko, Denis G.; Sokolov, Maxim N.; Fedin, Vladimir P.","Bi(iii) polybromides: a new chapter in coordination chemistry of bismuth.","Chemical communications (Cambridge, England)","2016","52","28","5061","5063","10.1039/c6cc01704e","","x-ray","0.71073","MoKα","","0.0577","0.0494","","","0.1707","0.1822","","","","","","1.064","","","","has coordinates","181567","2020-10-21","18:00:00",""
"7118865","9.5341","0.0003","21.4727","0.0006","35.055","0.001","90","","97.093","0.003","90","","7121.6","0.4","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Bi2 Br11 N3 -","- C18 H24 Bi2 Br11 N3 -","- C144 H192 Bi16 Br88 N24 -","8","2","","Adonin, Sergey A.; Gorokh, Igor D.; Samsonenko, Denis G.; Sokolov, Maxim N.; Fedin, Vladimir P.","Bi(iii) polybromides: a new chapter in coordination chemistry of bismuth.","Chemical communications (Cambridge, England)","2016","52","28","5061","5063","10.1039/c6cc01704e","","x-ray","0.71073","MoKα","","0.0761","0.0496","","","0.1039","0.1185","","","","","","1.036","","","","has coordinates","181567","2020-10-21","18:00:00",""
"7118866","14.1671","0.0003","19.7299","0.0004","7.74397","0.00016","90","","90","","90","","2164.56","0.08","130","2","130","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C12 H14 Bi Br7 N2 -","- C12 H14 Bi Br7 N2 -","- C48 H56 Bi4 Br28 N8 -","4","0.25","","Adonin, Sergey A.; Gorokh, Igor D.; Samsonenko, Denis G.; Sokolov, Maxim N.; Fedin, Vladimir P.","Bi(iii) polybromides: a new chapter in coordination chemistry of bismuth.","Chemical communications (Cambridge, England)","2016","52","28","5061","5063","10.1039/c6cc01704e","","x-ray","0.71073","MoKα","","0.0336","0.0302","","","0.076","0.0782","","","","","","1.074","","","","has coordinates","181567","2020-10-21","18:00:00",""
"7118867","16.0606","0.0004","13.9864","0.0003","19.4745","0.0004","90","","90","","90","","4374.56","0.17","130","2","130","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C28 H36 Bi Br13 N4 -","- C28 H36 Bi Br13 N4 -","- C112 H144 Bi4 Br52 N16 -","4","0.5","","Adonin, Sergey A.; Gorokh, Igor D.; Samsonenko, Denis G.; Sokolov, Maxim N.; Fedin, Vladimir P.","Bi(iii) polybromides: a new chapter in coordination chemistry of bismuth.","Chemical communications (Cambridge, England)","2016","52","28","5061","5063","10.1039/c6cc01704e","","x-ray","0.71073","MoKα","","0.0346","0.0227","","","0.0339","0.0362","","","","","","1.031","","","","has coordinates","181567","2020-10-21","18:00:00",""
"7118868","17.2568","0.0016","14.4839","0.0011","18.3034","0.0018","90","","96.454","0.001","90","","4545.9","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C92 H28 Cl8 F40 N8 O2 -","- C92 H28 Cl8 F40 N8 O2 -","- C184 H56 Cl16 F80 N16 O4 -","2","0.5","","Zhang, Kai; Savage, Mathew; Li, Xin; Jiang, Yu; Ishida, Masatoshi; Mitsuno, Koki; Karasawa, Satoru; Kato, Tatsuhisa; Zhu, Weihua; Yang, Sihai; Furuta, Hiroyuki; Xie, Yongshu","Rational syntheses of helical π-conjugated oligopyrrins with a bipyrrole linkage: geometry control of bis-copper(ii) coordination.","Chemical communications (Cambridge, England)","2016","52","29","5148","5151","10.1039/c6cc00707d","","","0.71073","MoKα","","0.167","0.0694","","","0.1738","0.2426","","","","","","1.02","","","","has coordinates","181561","2020-10-21","18:00:00",""
"7118869","11.1752","0.0005","16.3892","0.0008","37.51","0.003","90","","93.375","0.001","90","","6858.1","0.7","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C70 H24 Cu2 F30 N6 O4 S2 -","- C70 H24 Cu2 F30 N6 O4 S2 -","- C280 H96 Cu8 F120 N24 O16 S8 -","4","1","","Zhang, Kai; Savage, Mathew; Li, Xin; Jiang, Yu; Ishida, Masatoshi; Mitsuno, Koki; Karasawa, Satoru; Kato, Tatsuhisa; Zhu, Weihua; Yang, Sihai; Furuta, Hiroyuki; Xie, Yongshu","Rational syntheses of helical π-conjugated oligopyrrins with a bipyrrole linkage: geometry control of bis-copper(ii) coordination.","Chemical communications (Cambridge, England)","2016","52","29","5148","5151","10.1039/c6cc00707d","","","0.71073","MoKα","","0.1466","0.0673","","","0.151","0.1697","","","","","","1.015","","","","has coordinates,has disorder","181561","2020-10-21","18:00:00",""
"7118870","15.2047","0.0018","23.71","0.003","25.959","0.003","90","","103.577","0.002","90","","9096.8","1.9","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C83 H23 Cu2 F35 N10 O2 -","- C83 H23 Cu2 F35 N10 O2 -","- C332 H92 Cu8 F140 N40 O8 -","4","1","","Zhang, Kai; Savage, Mathew; Li, Xin; Jiang, Yu; Ishida, Masatoshi; Mitsuno, Koki; Karasawa, Satoru; Kato, Tatsuhisa; Zhu, Weihua; Yang, Sihai; Furuta, Hiroyuki; Xie, Yongshu","Rational syntheses of helical π-conjugated oligopyrrins with a bipyrrole linkage: geometry control of bis-copper(ii) coordination.","Chemical communications (Cambridge, England)","2016","52","29","5148","5151","10.1039/c6cc00707d","","","0.71073","MoKα","","0.1056","0.0668","","","0.1866","0.2036","","","","","","1.077","","","","has coordinates,has disorder","181561","2020-10-21","18:00:00",""
"7118871","17.0506","0.0017","14.6158","0.0013","23.435","0.002","90","","129.005","0.002","90","","4538.4","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C92 H24 Cl8 Cu2 F40 N8 O2 -","- C92 H24 Cl8 Cu2 F40 N8 O2 -","- C184 H48 Cl16 Cu4 F80 N16 O4 -","2","0.5","","Zhang, Kai; Savage, Mathew; Li, Xin; Jiang, Yu; Ishida, Masatoshi; Mitsuno, Koki; Karasawa, Satoru; Kato, Tatsuhisa; Zhu, Weihua; Yang, Sihai; Furuta, Hiroyuki; Xie, Yongshu","Rational syntheses of helical π-conjugated oligopyrrins with a bipyrrole linkage: geometry control of bis-copper(ii) coordination.","Chemical communications (Cambridge, England)","2016","52","29","5148","5151","10.1039/c6cc00707d","","","0.71073","MoKα","","0.2788","0.1071","","","0.2203","0.3196","","","","","","1.032","","","","has coordinates","181561","2020-10-21","18:00:00",""
"7118872","13.133","0.0014","16.1932","0.0013","20.7009","0.0016","81.317","0.001","86.431","0.002","83.348","0.001","4318.1","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C94 H29 F40 N11 O2 Zn2 -","- C94 H25 F40 N11 O2 Zn2 -","- C188 H50 F80 N22 O4 Zn4 -","2","1","","Zhang, Kai; Savage, Mathew; Li, Xin; Jiang, Yu; Ishida, Masatoshi; Mitsuno, Koki; Karasawa, Satoru; Kato, Tatsuhisa; Zhu, Weihua; Yang, Sihai; Furuta, Hiroyuki; Xie, Yongshu","Rational syntheses of helical π-conjugated oligopyrrins with a bipyrrole linkage: geometry control of bis-copper(ii) coordination.","Chemical communications (Cambridge, England)","2016","52","29","5148","5151","10.1039/c6cc00707d","","","0.71073","MoKα","","0.1359","0.0702","","","0.1349","0.1647","","","","","","1.005","","","","has coordinates","181561","2020-10-21","18:00:00",""
"7118873","17.0545","0.0011","29.3289","0.0019","35.668","0.002","85.911","0.004","89.317","0.004","86.562","0.004","17762.8","1.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Au25-xAgx(SC6H11)18-","","- C140 H266 Ag19.4 Au5.6 N S18 -","- C124 H226.5 Ag19.4 Au5.6 N0.5 S18 -","- C496 H906 Ag77.6 Au22.4 N2 S72 -","4","2","","Li, Qi; Wang, Shuxin; Kirschbaum, Kristin; Lambright, Kelly J.; Das, Anindita; Jin, Rongchao","Heavily doped Au25-xAgx(SC6H11)18(-) nanoclusters: silver goes from the core to the surface.","Chemical communications (Cambridge, England)","2016","52","29","5194","5197","10.1039/c6cc01243d","","","1.54178","CuKα","","0.1674","0.1159","","","0.2973","0.332","","","","","","1.092","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7118874","13.5677","0.001","13.0684","0.0009","20.6626","0.0016","90","","105.603","0.001","90","","3528.6","0.4","113","2","113","2","","","","","","","","8","P 1 21 1","P 2yb","4","","Ir-SBAP-Me","","- C76 H66 B F24 Ir N O P -","- C76 H66 B F24 Ir N O P -","- C152 H132 B2 F48 Ir2 N2 O2 P2 -","2","1","","Yu, Yan-Bo; Cheng, Lei; Li, Yi-Pan; Fu, Yue; Zhu, Shou-Fei; Zhou, Qi-Lin","Enantioselective iridium-catalyzed hydrogenation of β,β-disubstituted nitroalkenes.","Chemical communications (Cambridge, England)","2016","52","26","4812","4815","10.1039/c6cc01273f","","","0.71073","MoKα","","0.017","0.0151","","","0.0312","0.0314","","","","","","0.705","","","","has coordinates,has disorder","181539","2020-10-21","18:00:00",""
"7118875","17.4201","0.0003","13.4798","0.00019","12.0817","0.0002","90","","102.537","0.0017","90","","2769.37","0.08","293.15","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[1,4-C6H4{PPh2(AuCl)}2]","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0318","0.0238","","","0.0465","0.0497","","","","","","1.035","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118876","17.4151","0.0005","13.4808","0.0005","12.079","0.0006","90","","102.508","0.004","90","","2768.48","0.19","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0353","0.0238","","","0.0429","0.046","","","","","","1.07","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118877","17.2129","0.0005","13.3158","0.0005","11.79","0.0005","90","","102.848","0.004","90","","2634.65","0.17","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0449","0.0287","","","0.0495","0.0545","","","","","","1.077","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118878","17.0509","0.0005","13.1824","0.0005","11.579","0.0005","90","","103.183","0.004","90","","2534.04","0.17","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0393","0.0256","","","0.0469","0.051","","","","","","1.102","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118879","16.8213","0.0016","13.0052","0.0017","11.2967","0.0018","90","","103.502","0.012","90","","2403","0.6","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.1321","0.0591","","","0.077","0.0957","","","","","","1.077","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118880","16.6333","0.0006","12.8767","0.0006","11.1124","0.0007","90","","103.804","0.005","90","","2311.3","0.2","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0324","0.0234","","","0.0459","0.0497","","","","","","1.086","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118881","16.5181","0.0004","12.7957","0.0005","10.9986","0.0005","90","","103.959","0.004","90","","2256.02","0.15","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0376","0.0273","","","0.0577","0.0642","","","","","","1.095","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118882","16.3552","0.0004","12.6807","0.0005","10.8457","0.0005","90","","104.192","0.004","90","","2180.7","0.15","293","2","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0299","0.0226","","","0.0496","0.0525","","","","","","1.092","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118883","16.1848","0.0004","12.5654","0.0005","10.6996","0.0005","90","","104.452","0.004","90","","2107.11","0.14","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0328","0.0264","","","0.0572","0.0605","","","","","","1.081","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118884","16.1185","0.0006","12.5191","0.0007","10.6485","0.0006","90","","104.564","0.005","90","","2079.71","0.19","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0287","0.0234","","","0.0518","0.0543","","","","","","1.06","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118885","15.9507","0.0006","12.4062","0.0007","10.5188","0.0007","90","","104.813","0.005","90","","2012.4","0.2","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.028","0.0212","","","0.049","0.0516","","","","","","1.071","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118886","15.9198","0.0006","12.3906","0.0007","10.5027","0.0007","90","","104.853","0.005","90","","2002.5","0.2","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0296","0.0233","","","0.051","0.0538","","","","","","1.059","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118887","15.8861","0.0004","12.3656","0.0005","10.4819","0.0005","90","","104.901","0.004","90","","1989.83","0.14","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0293","0.0225","","","0.0491","0.0515","","","","","","1.049","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118888","15.8107","0.0007","12.3314","0.0008","10.4704","0.0008","90","","104.924","0.007","90","","1972.5","0.2","293","2","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Au2 Cl2 P2 -","- C30 H24 Au2 Cl2 P2 -","- C120 H96 Au8 Cl8 P8 -","4","0.5","","O'Connor, Alice E; Mirzadeh, Nedaossadat; Bhargava, Suresh K.; Easun, Timothy L.; Schröder, Martin; Blake, Alexander J.","Aurophilicity under pressure: a combined crystallographic and in situ spectroscopic study.","Chemical communications (Cambridge, England)","2016","52","41","6769","6772","10.1039/c6cc00923a","","x-ray","0.71073","MoKα","","0.0386","0.0272","","","0.0528","0.0613","","","","","","1.125","","","","has coordinates","185105","2020-10-21","18:00:00",""
"7118889","10.115","0.0019","4.5875","0.0011","11.876","0.003","90","","90.026","0.018","90","","551.1","0.2","93","","93","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C5 H6 F4 -","- C5 H6 F4 -","- C20 H24 F16 -","4","1","","Fang, Zeguo; Al-Maharik, Nawaf; Slawin, Alexandra M. Z.; Bühl, Michael; O'Hagan, David","Polar alicyclic rings: synthesis and structure of all cis-1,2,3,4-tetrafluorocyclopentane.","Chemical communications (Cambridge, England)","2016","52","29","5116","5119","10.1039/c6cc01348a","","","0.71075","MoKα","","0.0638","0.0605","","","0.1575","0.161","","","","","","1.049","","","","has coordinates","181559","2020-10-21","18:00:00",""
"7118890","9.5809","0.0004","13.6588","0.0006","22.8484","0.0009","90","","90","","90","","2990","0.2","100","1","100","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C144 H152 N8 O16 -","8","1","","Nandi, Raj Kumar; Ratsch, Friederike; Beaud, Rodolphe; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume","Intermolecular dearomative C2-arylation of N-Ac indoles activated by FeCl3.","Chemical communications (Cambridge, England)","2016","52","30","5328","5331","10.1039/c6cc01654e","","x-ray","0.71073","MoKα","","0.0537","0.0446","","","0.1269","0.1351","","","","","","1.068","","","","has coordinates","182597","2020-10-21","18:00:00",""
"7118891","7.7189","0.0004","9.7482","0.0005","29.5931","0.0014","90","","94.235","0.002","90","","2220.66","0.19","100","1","100","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H25 N O3 -","- C28 H25 N O3 -","- C112 H100 N4 O12 -","4","1","","Nandi, Raj Kumar; Ratsch, Friederike; Beaud, Rodolphe; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume","Intermolecular dearomative C2-arylation of N-Ac indoles activated by FeCl3.","Chemical communications (Cambridge, England)","2016","52","30","5328","5331","10.1039/c6cc01654e","","","0.71073","MoKα","","0.0597","0.049","","","0.1188","0.1247","","","","","","1.07","","","","has coordinates","182597","2020-10-21","18:00:00",""
"7118892","7.9573","0.0003","9.6303","0.0003","10.5963","0.0003","68.147","0.001","75.128","0.002","69.312","0.001","697.7","0.04","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Br N O -","- C18 H16 Br N O -","- C36 H32 Br2 N2 O2 -","2","1","","Nandi, Raj Kumar; Ratsch, Friederike; Beaud, Rodolphe; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume","Intermolecular dearomative C2-arylation of N-Ac indoles activated by FeCl3.","Chemical communications (Cambridge, England)","2016","52","30","5328","5331","10.1039/c6cc01654e","","x-ray","0.71073","MoKα","","0.0362","0.0285","","","0.067","0.0694","","","","","","1.068","","","","has coordinates","182597","2020-10-21","18:00:00",""
"7118893","13.0136","0.001","15.5458","0.0012","20.433","0.0015","90","","90.546","0.001","90","","4133.5","0.5","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H75 Cl N4 Pu Si3 -","- C33 H75 Cl N4 Pu Si3 -","- C132 H300 Cl4 N16 Pu4 Si12 -","4","1","","Brown, Jessie L.; Gaunt, Andrew J.; King, David M.; Liddle, Stephen T.; Reilly, Sean D.; Scott, Brian L.; Wooles, Ashley J.","Neptunium and plutonium complexes with a sterically encumbered triamidoamine (TREN) scaffold.","Chemical communications (Cambridge, England)","2016","52","31","5428","5431","10.1039/c6cc01656a","","","0.71073","MoKα","","0.0374","0.0291","","","0.0764","0.0838","","","","","","1.904","","","","has coordinates","182605","2020-10-21","18:00:00",""
"7118894","12.9845","0.001","15.6008","0.0012","20.4035","0.0015","90","","90.648","0.001","90","","4132.8","0.5","140","1","140","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H75 Cl N4 Np Si3 -","- C33 H75 Cl N4 Np Si3 -","- C132 H300 Cl4 N16 Np4 Si12 -","4","1","","Brown, Jessie L.; Gaunt, Andrew J.; King, David M.; Liddle, Stephen T.; Reilly, Sean D.; Scott, Brian L.; Wooles, Ashley J.","Neptunium and plutonium complexes with a sterically encumbered triamidoamine (TREN) scaffold.","Chemical communications (Cambridge, England)","2016","52","31","5428","5431","10.1039/c6cc01656a","","","0.71073","MoKα","","0.0357","0.0241","","","0.0448","0.0474","","","","","","1.114","","","","has coordinates","182605","2020-10-21","18:00:00",""
"7118897","22.4","0.0009","29.9961","0.0013","9.5945","0.0004","90","","90","","90","","6446.7","0.5","122","","122","","","","","","","","synthesis","4","P 21 21 2","P 2 2ab","18","","BocN-(ACPC)6-(Leu)2-OBn","","- C61 H95 N8 O12 -","- C60.737 H94.856 N8 O11.783 -","- C242.948 H379.424 N32 O47.132 -","4","1","","Yoon, Eunyoung; Gong, Jintaek; Jung, Yoonchul; Lee, Wonchul; Driver, Russell W.; Lee, Hee-Seung","Unambiguous characterization of anisotropic foldamer packing in a foldecture with an elongated hexagonal plate shape.","Chemical communications (Cambridge, England)","2016","52","30","5250","5253","10.1039/c6cc00502k","","","0.71073","MoKα","","0.0529","0.0508","","0.1334","0.1317","0.1334","","","","","","0.9351","","","","has coordinates,has disorder","182594","2020-10-21","18:00:00",""
"7118898","20.6782","0.001","11.2433","0.0005","23.3822","0.0011","90","","108.634","0.002","90","","5151.2","0.4","150","2","150","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C12 H96 K3 Mo16 N O74 S16 -","- C8 K3 Mo16 O73.6 S16 -","- C16 K6 Mo32 O147.2 S32 -","2","0.25","","Zang, Hongying; Surman, Andrew; Long, Deliang; Cronin, Leroy; Miras, Haralampos N.","Exploiting the equilibrium dynamics in the self-assembly of inorganic macrocycles based upon polyoxothiometalate building blocks.","Chemical communications (Cambridge, England)","2016","52","58","9109","9112","10.1039/c6cc01041e","","","0.71073","MoKα","","0.0501","0.0462","","","0.128","0.134","","","","","","1.039","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7118899","38.31","0.002","17.3787","0.0009","12.5611","0.0007","90","","91.431","0.005","90","","8360.3","0.8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H90 Mo12 N2 O52 S12 -","- C12 H30 Mo12 N2 O48.8 S12 -","- C48 H120 Mo48 N8 O195.2 S48 -","4","0.5","","Zang, Hongying; Surman, Andrew; Long, Deliang; Cronin, Leroy; Miras, Haralampos N.","Exploiting the equilibrium dynamics in the self-assembly of inorganic macrocycles based upon polyoxothiometalate building blocks.","Chemical communications (Cambridge, England)","2016","52","58","9109","9112","10.1039/c6cc01041e","","","0.71073","MoKα","","0.0807","0.067","","","0.1794","0.1864","","","","","","1.116","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7118900","9.1654","0.0005","9.1839","0.0008","10.0995","0.001","113.841","0.009","100.43","0.006","108.001","0.007","692.27","0.13","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0572","0.0379","","","0.0771","0.0915","","","","","","1.096","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118901","9.1564","0.0006","9.1703","0.0008","10.0589","0.0008","113.561","0.007","100.692","0.007","107.883","0.007","689.26","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0461","0.0365","","","0.0835","0.0915","","","","","","1.084","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118902","9.1806","0.0011","9.3566","0.0009","10.3153","0.001","114.93","0.009","99.18","0.01","108.364","0.01","717.25","0.17","300","0.1","300","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0684","0.042","","","0.0865","0.1042","","","","","","1.028","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118903","9.2555","0.0004","9.6136","0.0004","15.3533","0.0007","81.5317","0.0009","75.7689","0.0009","65.7138","0.0008","1205.36","0.09","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H14 Cl2 I6 N4 Pt -","- C8 H14 Cl2 I6 N4 Pt -","- C16 H28 Cl4 I12 N8 Pt2 -","2","1","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0423","0.0322","","","0.0703","0.0738","","","","","","1.026","","","","has coordinates,has disorder","182609","2020-10-21","18:00:00",""
"7118904","9.2558","0.0006","9.3667","0.0007","15.2697","0.0011","75.799","0.006","81.826","0.006","65.21","0.007","1163.95","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H28 Cl7 I9 N8 Pt2 -","- C16 H28 Cl7 I9 N8 Pt2 -","- C16 H28 Cl7 I9 N8 Pt2 -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0382","0.03","","","0.0581","0.0609","","","","","","1.206","","","","has coordinates,has disorder","182609","2020-10-21","18:00:00",""
"7118905","5.7573","0.0004","11.8165","0.0006","9.2197","0.0007","90","","108.047","0.008","90","","596.37","0.07","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H12 Br2 N4 Pt -","- C6 H12 Br2 N4 Pt -","- C12 H24 Br4 N8 Pt2 -","2","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0465","0.0328","","","0.0639","0.071","","","","","","1.066","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118906","9.28","0.0006","9.8201","0.0006","15.7209","0.001","81.037","0.0013","75.8368","0.0013","65.7179","0.0012","1263.74","0.14","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H14 Br2 I6 N4 Pt -","- C8 H14 Br2 I6 N4 Pt -","- C16 H28 Br4 I12 N8 Pt2 -","2","1","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0426","0.0351","","","0.0874","0.0908","","","","","","1.041","","","","has coordinates,has disorder","182609","2020-10-21","18:00:00",""
"7118907","8.2473","0.0006","8.7723","0.0006","11.3779","0.0006","104.013","0.005","98.93","0.005","116.223","0.007","683.18","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H22 Cl2 I6 N4 Pt -","- C12 H22 Cl2 I6 N4 Pt -","- C12 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0394","0.03","","","0.0651","0.0701","","","","","","1.029","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118908","9.9496","0.0003","9.35436","0.00018","14.6232","0.0004","90","","103.295","0.002","90","","1324.54","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Cl2 I6 N4 Pt -","- C12 H18 Cl2 I6 N4 Pt -","- C24 H36 Cl4 I12 N8 Pt2 -","2","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0269","0.0226","","","0.0463","0.0479","","","","","","1.098","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118909","9.129","0.0008","9.1612","0.0008","10.0487","0.0008","100.776","0.007","113.593","0.008","107.793","0.008","685.71","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0446","0.0345","","","0.0652","0.0719","","","","","","1.031","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118910","9.1465","0.0011","9.1681","0.0011","10.068","0.0012","113.589","0.002","100.676","0.002","107.808","0.002","689.34","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0415","0.0302","","","0.0653","0.0695","","","","","","1.002","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118911","9.168","0.0015","9.1918","0.0015","10.109","0.0016","113.897","0.003","100.373","0.003","107.948","0.003","693.9","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0496","0.0333","","","0.0694","0.0749","","","","","","0.961","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118912","9.1724","0.0012","9.2419","0.0012","10.1625","0.0013","114.172","0.002","100.036","0.002","108.096","0.002","700.48","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0533","0.0344","","","0.0724","0.0798","","","","","","0.99","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118913","9.1743","0.0013","9.2939","0.0012","10.2287","0.0014","114.48","0.002","99.652","0.002","108.236","0.002","707.88","0.17","250","2","250","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0551","0.0344","","","0.0724","0.0785","","","","","","1.024","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118914","9.158","0.0014","9.3355","0.0014","10.2955","0.0016","114.801","0.003","99.221","0.003","108.383","0.003","713.2","0.19","300","2","300","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","- C14 H22 Cl2 I6 N4 Pt -","1","0.5","","Ivanov, Daniil M.; Novikov, Alexander S.; Ananyev, Ivan V.; Kirina, Yulia V.; Kukushkin, Vadim Yu","Halogen bonding between metal centers and halocarbons.","Chemical communications (Cambridge, England)","2016","52","32","5565","5568","10.1039/c6cc01107a","","","0.71073","MoKα","","0.0584","0.0348","","","0.0719","0.0792","","","","","","1.04","","","","has coordinates","182609","2020-10-21","18:00:00",""
"7118915","27.646","0.005","27.646","0.005","17.306","0.003","90","","90","","90","","13227","4","107","2","107","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C145 H161 Co24 N9 O101 -","- C145 H161 Co24 N9 O101 -","- C290 H322 Co48 N18 O202 -","2","0.25","","Liang, Guang-Ming; Ni, Qing-Ling; Zou, Hua-Hong; Gui, Liu-Cheng; Wang, Xiu-Jian","Rare double spin canting antiferromagnetic behaviours in a [Co24] cluster.","Chemical communications (Cambridge, England)","2016","52","30","5293","5296","10.1039/c6cc00568c","","","0.75","synchrotron","","0.0695","0.0662","","","0.1834","0.1883","","","","","","1.038","","","","has coordinates","182596","2020-10-21","18:00:00",""
"7118916","10.0317","0.0003","12.1017","0.0004","13.3609","0.0004","97.647","0.001","94.311","0.001","95.342","0.001","1594.3","0.09","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C38 H36 Cu2 P2 -","- C38 H36 Cu2 P2 -","- C76 H72 Cu4 P4 -","2","1","","Molteni, Roberto; Bertermann, Rüdiger; Edkins, Katharina; Steffen, Andreas","An unexpected transmetalation intermediate: isolation and structural characterization of a solely CH3 bridged di-copper(i) complex.","Chemical communications (Cambridge, England)","2016","52","28","5019","5022","10.1039/c6cc01510g","","x-ray","0.71073","MoKα","","0.0291","0.0247","","","0.0799","0.0916","","","","","","1.0486","","","","has coordinates","181566","2020-10-21","18:00:00",""
"7118917","5.4475","0.0004","12.1951","0.0011","12.2971","0.001","114.682","0.002","98.556","0.002","98.672","0.002","713.13","0.1","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 F3 N2 O -","- C16 H13 F3 N2 O -","- C32 H26 F6 N4 O2 -","2","1","","Tomakinian, Terry; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume","Synthesis of benzofuro[3,2-b]indoline amines via deamination-interrupted Fischer indolization and their unexpected reactivity towards nucleophiles.","Chemical communications (Cambridge, England)","2016","52","31","5443","5446","10.1039/c6cc00365f","","x-ray","0.71073","MoKα","","0.0627","0.0457","","","0.1127","0.1247","","","","","","1.039","","","","has coordinates","182603","2020-10-21","18:00:00",""
"7118918","9.2208","0.0002","9.2881","0.0002","11.3189","0.0003","92.755","0.001","107.193","0.001","106.506","0.001","878.64","0.04","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C17 H18 N2 O5 S2 -","- C17 H18 N2 O5 S2 -","- C34 H36 N4 O10 S4 -","2","1","","Tomakinian, Terry; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume","Synthesis of benzofuro[3,2-b]indoline amines via deamination-interrupted Fischer indolization and their unexpected reactivity towards nucleophiles.","Chemical communications (Cambridge, England)","2016","52","31","5443","5446","10.1039/c6cc00365f","","x-ray","0.71073","MoKα","","0.043","0.0338","","","0.0896","0.0952","","","","","","1.038","","","","has coordinates","182603","2020-10-21","18:00:00",""
"7118919","13.5204","0.0007","12.9163","0.0007","17.273","0.0008","90","","90","","90","","3016.4","0.3","100","1","100","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H16 B F2 N O -","- C18 H16 B F2 N O -","- C144 H128 B8 F16 N8 O8 -","8","1","","Tomakinian, Terry; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume","Synthesis of benzofuro[3,2-b]indoline amines via deamination-interrupted Fischer indolization and their unexpected reactivity towards nucleophiles.","Chemical communications (Cambridge, England)","2016","52","31","5443","5446","10.1039/c6cc00365f","","x-ray","0.71073","MoKα","","0.0842","0.0702","","","0.1805","0.1892","","","","","","1.027","","","","has coordinates","182603","2020-10-21","18:00:00",""
"7118920","21.0329","0.0015","12.5972","0.0009","12.0333","0.0008","90","","90","","90","","3188.3","0.4","100","0.1","100","0.1","","","","","","","","5","P m m a","-P 2a 2a","51","","","","- C17.09 H116.4 Br N O38 -","- C17.0779 H85.3136 Br N4 O38 -","- C34.1558 H170.627 Br2 N8 O76 -","2","0.25","","Muromachi, Sanehiro; Udachin, Konstantin A.; Alavi, Saman; Ohmura, Ryo; Ripmeester, John A.","Selective occupancy of methane by cage symmetry in TBAB ionic clathrate hydrate.","Chemical communications (Cambridge, England)","2016","52","32","5621","5624","10.1039/c6cc00264a","","","0.7107","MoKα","","0.0592","0.0549","","","0.1649","0.167","","","","","","1.175","","","","has coordinates,has disorder","182610","2020-10-21","18:00:00",""
"7118921","11.353","0.007","16.909","0.012","8.235","0.005","90","","90","","90","","1580.9","1.8","296","2","296","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C22 H16 O3 -","- C22 H16 O3 -","- C88 H64 O12 -","4","1","","Mao, Wenbin; Zhu, Chen","Synthesis of highly substituted γ-hydroxybutenolides through the annulation of keto acids with alkynes and subsequent hydroxyl transposition.","Chemical communications (Cambridge, England)","2016","52","30","5269","5272","10.1039/c6cc01554a","","","0.71073","MoKα","","0.0348","0.0315","","","0.075","0.0771","","","","","","1.059","","","","has coordinates","182598","2020-10-21","18:00:00",""
"7118922","15.3088","0.0009","17.993","0.0011","19.4932","0.0012","90","","92.57","0.002","90","","5364","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34.5 H25 Cl N2 O2 -","- C34.5 H25 Cl N2 O2 -","- C276 H200 Cl8 N16 O16 -","8","1","","Wang, Huan; Zhang, Zhiyun; Zhou, Haitao; Wang, Tonghai; Su, Jianhua; Tong, Xiaofeng; Tian, He","Cu-catalyzed C-H amination/Ullmann N-arylation domino reaction: a straightforward synthesis of 9,14-diaryl-9,14-dihydrodibenzo[a,c]phenazine.","Chemical communications (Cambridge, England)","2016","52","31","5459","5462","10.1039/c6cc01569g","","","0.71073","MoKα","","0.071","0.0581","","","0.1653","0.178","","","","","","1.019","","","","has coordinates","182604","2020-10-21","18:00:00",""
"7118923","14.0547","0.0018","19.251","0.003","18.41","0.002","90","","90.832","0.003","90","","4980.6","1.1","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C36 H24 N2 -","- C36 H24 N2 -","- C288 H192 N16 -","8","1","","Wang, Huan; Zhang, Zhiyun; Zhou, Haitao; Wang, Tonghai; Su, Jianhua; Tong, Xiaofeng; Tian, He","Cu-catalyzed C-H amination/Ullmann N-arylation domino reaction: a straightforward synthesis of 9,14-diaryl-9,14-dihydrodibenzo[a,c]phenazine.","Chemical communications (Cambridge, England)","2016","52","31","5459","5462","10.1039/c6cc01569g","","","0.71073","MoKα","","0.0549","0.0398","","","0.1038","0.1145","","","","","","1.023","","","","has coordinates","182604","2020-10-21","18:00:00",""
"7118924","11.4684","0.0006","18.005","0.0009","13.845","0.0007","90","","92.989","0.001","90","","2854.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C42 H26 N2 -","- C42 H26 N2 -","- C168 H104 N8 -","4","1","","Wang, Huan; Zhang, Zhiyun; Zhou, Haitao; Wang, Tonghai; Su, Jianhua; Tong, Xiaofeng; Tian, He","Cu-catalyzed C-H amination/Ullmann N-arylation domino reaction: a straightforward synthesis of 9,14-diaryl-9,14-dihydrodibenzo[a,c]phenazine.","Chemical communications (Cambridge, England)","2016","52","31","5459","5462","10.1039/c6cc01569g","","","0.71073","MoKα","","0.0703","0.0486","","","0.1257","0.1407","","","","","","1.023","","","","has coordinates","182604","2020-10-21","18:00:00",""
"7118925","13.67","0.002","10.7087","0.0018","16.477","0.003","90","","98.766","0.004","90","","2383.9","0.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C33 H24 N2 -","- C33 H24 N2 -","- C132 H96 N8 -","4","1","","Wang, Huan; Zhang, Zhiyun; Zhou, Haitao; Wang, Tonghai; Su, Jianhua; Tong, Xiaofeng; Tian, He","Cu-catalyzed C-H amination/Ullmann N-arylation domino reaction: a straightforward synthesis of 9,14-diaryl-9,14-dihydrodibenzo[a,c]phenazine.","Chemical communications (Cambridge, England)","2016","52","31","5459","5462","10.1039/c6cc01569g","","","0.71073","MoKα","","0.1028","0.0653","","","0.1363","0.1521","","","","","","1.095","","","","has coordinates","182604","2020-10-21","18:00:00",""
"7118926","7.326","0.005","10.134","0.007","12.489","0.008","80.774","0.011","82.54","0.012","77.77","0.011","890","1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H19 N O3 S -","- C20 H19 N O3 S -","- C40 H38 N2 O6 S2 -","2","1","","Huang, Hai; Tang, Luning; Liu, Qi; Xi, Yang; He, Guangke; Zhu, Hongjun","Formation of α-chalcogenyl acrylamides through unprecedented chalcogen-mediated metal-free oxyfunctionalization of ynamides with DMSO as an oxidant.","Chemical communications (Cambridge, England)","2016","52","32","5605","5608","10.1039/c5cc10517j","","","0.71073","MoKα","","0.0572","0.0417","","","0.1127","0.1248","","","","","","1.066","","","","has coordinates","182612","2020-10-21","18:00:00",""
"7118927","13.598","0.0008","5.7831","0.0003","14.8716","0.0008","90","","111.469","0.002","90","","1088.34","0.1","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H25 N O3 S -","- C23 H25 N O3 S -","- C46 H50 N2 O6 S2 -","2","1","","Huang, Hai; Tang, Luning; Liu, Qi; Xi, Yang; He, Guangke; Zhu, Hongjun","Formation of α-chalcogenyl acrylamides through unprecedented chalcogen-mediated metal-free oxyfunctionalization of ynamides with DMSO as an oxidant.","Chemical communications (Cambridge, England)","2016","52","32","5605","5608","10.1039/c5cc10517j","","","0.71073","MoKα","","0.0489","0.0429","","","0.1192","0.1234","","","","","","1.053","","","","has coordinates","182612","2020-10-21","18:00:00",""
"7118928","12.8698","0.0016","13.262","0.0015","15.0271","0.0018","90","","92.583","0.004","90","","2562.2","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 N O3 S2 -","- C27 H29 N O3 S2 -","- C108 H116 N4 O12 S8 -","4","1","","Huang, Hai; Tang, Luning; Liu, Qi; Xi, Yang; He, Guangke; Zhu, Hongjun","Formation of α-chalcogenyl acrylamides through unprecedented chalcogen-mediated metal-free oxyfunctionalization of ynamides with DMSO as an oxidant.","Chemical communications (Cambridge, England)","2016","52","32","5605","5608","10.1039/c5cc10517j","","","0.71073","MoKα","","0.0837","0.0596","","","0.1564","0.1731","","","","","","1.028","","","","has coordinates","182612","2020-10-21","18:00:00",""
"7118929","17.1168","0.0003","17.1168","0.0003","17.1168","0.0003","90","","90","","90","","5014.96","0.15","293","2","293","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C4 H6 N8 O0 Zn -","- C4 H6 N8 Zn -","- C48 H72 N96 Zn12 -","12","0.25","","Tang, Yu-Huan; Wang, Fei; Liu, Jin-Xiu; Zhang, Jian","Diverse tetrahedral tetrazolate frameworks with N-rich surface.","Chemical communications (Cambridge, England)","2016","52","32","5625","5628","10.1039/c6cc00589f","","","0.71073","MoKα","","0.0454","0.0389","","","0.0952","0.1016","","","","","","0.973","","","","has coordinates","182613","2020-10-21","18:00:00",""
"7118930","17.0293","0.0004","17.0293","0.0004","17.0293","0.0004","90","","90","","90","","4938.4","0.2","293","2","293","2","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C4 H6 N8 O0 Zn -","- C4 H6 N8 Zn -","- C48 H72 N96 Zn12 -","12","0.25","","Tang, Yu-Huan; Wang, Fei; Liu, Jin-Xiu; Zhang, Jian","Diverse tetrahedral tetrazolate frameworks with N-rich surface.","Chemical communications (Cambridge, England)","2016","52","32","5625","5628","10.1039/c6cc00589f","","","0.71073","MoKα","","0.0548","0.0479","","","0.1064","0.1128","","","","","","1.013","","","","has coordinates","182613","2020-10-21","18:00:00",""
"7118931","15.7886","0.0013","15.9425","0.0009","16.3286","0.0007","90","","90","","90","","4110.1","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H45 N15 O8 S2 Zn2 -","- C18 H45 N15 O8 S2 Zn2 -","- C72 H180 N60 O32 S8 Zn8 -","4","1","","Tang, Yu-Huan; Wang, Fei; Liu, Jin-Xiu; Zhang, Jian","Diverse tetrahedral tetrazolate frameworks with N-rich surface.","Chemical communications (Cambridge, England)","2016","52","32","5625","5628","10.1039/c6cc00589f","","","0.71073","MoKα","","0.1086","0.0793","","","0.1912","0.2203","","","","","","0.999","","","","has coordinates","182613","2020-10-21","18:00:00",""
"7118932","22.3819","0.0003","22.3819","0.0003","22.3819","0.0003","90","","90","","90","","11212.2","0.3","293","2","","","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C24 H52 B3 F12 N48 O8 Zn7 -","- C24 H51.9998 B3 F12 N48 O8 Zn7 -","- C96 H207.999 B12 F48 N192 O32 Zn28 -","4","0.0833333","","Tang, Yu-Huan; Wang, Fei; Liu, Jin-Xiu; Zhang, Jian","Diverse tetrahedral tetrazolate frameworks with N-rich surface.","Chemical communications (Cambridge, England)","2016","52","32","5625","5628","10.1039/c6cc00589f","","","0.71073","MoKα","","0.0886","0.0877","","","0.2665","0.2706","","","","","","1.2923","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7118933","6.211","0.003","40.769","0.017","9.646","0.004","90","","96.104","0.007","90","","2428.7","1.8","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","NIT-2-Pm","","","- C11 H15 N4 O2 -","- C11 H15 N4 O2 -","- C88 H120 N32 O16 -","8","2","","Wang, Jian; Li, Jia-Nan; Zhang, Shao-Liang; Zhao, Xin-Hua; Shao, Dong; Wang, Xin-Yi","Syntheses and magnetic properties of a pyrimidyl-substituted nitronyl nitroxide radical and its cobalt(ii) complexes.","Chemical communications (Cambridge, England)","2016","52","28","5033","5036","10.1039/c6cc00915h","","","0.71073","MoKα","","0.1756","0.0719","","","0.1658","0.2113","","","","","","0.94","","","","has coordinates","181570","2020-10-21","18:00:00",""
"7118934","14.967","0.003","15.106","0.003","15.938","0.003","69.812","0.002","62.763","0.002","66.38","0.002","2877.1","1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","(NIT-2-Pm)Co(hfac)2","","","- C21 H19 Co F12 N4 O6 -","- C21 H19 Co F12 N4 O6 -","- C84 H76 Co4 F48 N16 O24 -","4","2","","Wang, Jian; Li, Jia-Nan; Zhang, Shao-Liang; Zhao, Xin-Hua; Shao, Dong; Wang, Xin-Yi","Syntheses and magnetic properties of a pyrimidyl-substituted nitronyl nitroxide radical and its cobalt(ii) complexes.","Chemical communications (Cambridge, England)","2016","52","28","5033","5036","10.1039/c6cc00915h","","","0.71073","MoKα","","0.1056","0.0768","","","0.2426","0.2769","","","","","","1.054","","","","has coordinates","181570","2020-10-21","18:00:00",""
"7118935","12.6019","0.0007","20.7451","0.0012","17.6713","0.0011","90","","104.665","0.001","90","","4469.3","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(NIT-2-Pm)Co2(hfac)4","","","- C31 H23 Co2 F24 N4 O10 -","- C31 H23 Co2 F24 N4 O10 -","- C124 H92 Co8 F96 N16 O40 -","4","1","","Wang, Jian; Li, Jia-Nan; Zhang, Shao-Liang; Zhao, Xin-Hua; Shao, Dong; Wang, Xin-Yi","Syntheses and magnetic properties of a pyrimidyl-substituted nitronyl nitroxide radical and its cobalt(ii) complexes.","Chemical communications (Cambridge, England)","2016","52","28","5033","5036","10.1039/c6cc00915h","","","0.71073","MoKα","","0.0814","0.0624","","","0.1921","0.21","","","","","","1.058","","","","has coordinates","181570","2020-10-21","18:00:00",""
"7118936","9.7416","0.0016","10.1024","0.0017","16.6","0.003","92.408","0.004","106.474","0.004","105.593","0.004","1496.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 B N O2 -","- C36 H40 B N O2 -","- C72 H80 B2 N2 O4 -","2","1","","Jiang, Han-Chun; Tang, Xiang-Ying; Shi, Min","Copper-catalyzed regio- and enantioselective aminoboration of alkylidenecyclopropanes: the synthesis of cyclopropane-containing β-aminoalkylboranes.","Chemical communications (Cambridge, England)","2016","52","30","5273","5276","10.1039/c6cc01631f","","","0.71073","MoKα","","0.0842","0.0569","","","0.1388","0.1557","","","","","","1.02","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7118937","10.5305","0.0018","11.491","0.002","13.29","0.002","68.577","0.004","71.096","0.003","63.363","0.003","1313.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H36 B N O2 -","- C30 H36 B N O2 -","- C60 H72 B2 N2 O4 -","2","1","","Jiang, Han-Chun; Tang, Xiang-Ying; Shi, Min","Copper-catalyzed regio- and enantioselective aminoboration of alkylidenecyclopropanes: the synthesis of cyclopropane-containing β-aminoalkylboranes.","Chemical communications (Cambridge, England)","2016","52","30","5273","5276","10.1039/c6cc01631f","","","0.71073","MoKα","","0.0765","0.0569","","","0.1475","0.1631","","","","","","1.049","","","","has coordinates,has disorder","182599","2020-10-21","18:00:00",""
"7118938","11.3403","0.0003","11.3403","0.0003","15.1182","0.0005","90","","90","","120","","1683.76","0.08","173","2","173","2","","","","","","","","5","P -3","-P 3","147","","","","- C18 H48 Li3 N6 P7 -","- C18 H48 Li3 N6 P7 -","- C36 H96 Li6 N12 P14 -","2","0.333333","","Bhattacharyya, Koyel X.; Dreyfuss, Sébastien; Saffon-Merceron, Nathalie; Mézailles, Nicolas","P4 functionalization by hydrides: direct synthesis of P-H bonds.","Chemical communications (Cambridge, England)","2016","52","29","5179","5182","10.1039/c6cc01683a","","","0.71073","MoKα","","0.0634","0.0445","","","0.105","0.1151","","","","","","1.065","","","","has coordinates","181563","2020-10-21","18:00:00",""
"7118939","8.8161","0.0004","13.0764","0.0006","29.5577","0.0014","90","","94.937","0.002","90","","3394.9","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","IP60precipitado","","- C50 H32 O2 -","- C50 H32 O2 -","- C200 H128 O8 -","4","1","","Pozo, Iago; Cobas, Agustín; Peña, Diego; Guitián, Enrique; Pérez, Dolores","1,7-Naphthodiyne: a new platform for the synthesis of novel, sterically congested PAHs.","Chemical communications (Cambridge, England)","2016","52","32","5534","5537","10.1039/c6cc01214k","","x-ray","0.71073","MoKα","","0.0625","0.0457","","","0.109","0.1194","","","","","","1.021","","","","has coordinates","182614","2020-10-21","18:00:00",""
"7118940","14.0105","0.0005","13.0164","0.0005","16.1008","0.0006","90","","102.591","0.002","90","","2865.63","0.19","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","IP101F2_B","","- C39 H25 Cl3 -","- C39 H25 Cl3 -","- C156 H100 Cl12 -","4","1","","Pozo, Iago; Cobas, Agustín; Peña, Diego; Guitián, Enrique; Pérez, Dolores","1,7-Naphthodiyne: a new platform for the synthesis of novel, sterically congested PAHs.","Chemical communications (Cambridge, England)","2016","52","32","5534","5537","10.1039/c6cc01214k","","x-ray","0.71073","MoKα","","0.0821","0.0476","","","0.097","0.1102","","","","","","1.044","","","","has coordinates,has disorder","182614","2020-10-21","18:00:00",""
"7118941","16.526","0.002","9.874","0.002","18.038","0.003","90","","115.24","0.02","90","","2662.4","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H43 Li N4 -","- C27 H43 Li N4 -","- C108 H172 Li4 N16 -","4","1","","Finkelmeier, Nils; Visscher, Arne; Wandtke, Sebastian; Herbst-Irmer, Regine; Stalke, Dietmar","CH3-deprotonation of 9-methylanthracene under mild conditions.","Chemical communications (Cambridge, England)","2016","52","31","5440","5442","10.1039/c6cc01261b","","","0.71073","MoKα","","0.1732","0.0839","","","0.1691","0.2106","","","","","","1.06","","","","has coordinates,has disorder","182601","2020-10-21","18:00:00",""
"7118942","9.486","0.002","34.841","0.003","19.391","0.002","90","","93.77","0.02","90","","6394.9","1.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C69 H98 Li2 N8 -","- C69 H97.997 Li2 N8 -","- C276 H391.988 Li8 N32 -","4","1","","Finkelmeier, Nils; Visscher, Arne; Wandtke, Sebastian; Herbst-Irmer, Regine; Stalke, Dietmar","CH3-deprotonation of 9-methylanthracene under mild conditions.","Chemical communications (Cambridge, England)","2016","52","31","5440","5442","10.1039/c6cc01261b","","","0.71073","MoKα","","0.0703","0.0545","","","0.1466","0.1595","","","","","","1.032","","","","has coordinates,has disorder","182601","2020-10-21","18:00:00",""
"7118943","6.4272","0.0001","11.7684","0.0002","18.3674","0.0004","90","","90","","90","","1389.27","0.04","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 N2 O -","- C16 H14 N2 O -","- C64 H56 N8 O4 -","4","1","","Laugeois, Maxime; Ponra, Sudipta; Ratovelomanana-Vidal, Virginie; Michelet, Véronique; Vitale, Maxime R.","Asymmetric preparation of polysubstituted cyclopentanes by synergistic Pd(0)/amine catalyzed formal [3+2] cycloadditions of vinyl cyclopropanes with enals.","Chemical communications (Cambridge, England)","2016","52","30","5332","5335","10.1039/c6cc01775d","","","1.54178","CuKα","","0.0289","0.0278","","","0.0737","0.0746","","","","","","1.068","","","","has coordinates","182595","2020-10-21","18:00:00",""
"7118944","9.0535","0.0002","7.4148","0.0002","10.4203","0.0003","90","","104.406","0.001","90","","677.52","0.03","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H14 N2 O -","- C16 H14 N2 O -","- C32 H28 N4 O2 -","2","1","","Laugeois, Maxime; Ponra, Sudipta; Ratovelomanana-Vidal, Virginie; Michelet, Véronique; Vitale, Maxime R.","Asymmetric preparation of polysubstituted cyclopentanes by synergistic Pd(0)/amine catalyzed formal [3+2] cycloadditions of vinyl cyclopropanes with enals.","Chemical communications (Cambridge, England)","2016","52","30","5332","5335","10.1039/c6cc01775d","","","1.54178","CuKα","","0.0255","0.0253","","","0.0644","0.0646","","","","","","1.138","","","","has coordinates","182595","2020-10-21","18:00:00",""
"7118945","6.9841","0.0007","12.5978","0.0013","15.735","0.0016","90","","97.885","0.006","90","","1371.3","0.2","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(1S,5R,6R,8S)-2-imino-8-phenyl-6-vinyl-3-oxabicyclo[3.2.1]octane-1-carbonitrile","","- C16 H16 N2 O -","- C16 H16 N2 O -","- C64 H64 N8 O4 -","4","2","","Laugeois, Maxime; Ponra, Sudipta; Ratovelomanana-Vidal, Virginie; Michelet, Véronique; Vitale, Maxime R.","Asymmetric preparation of polysubstituted cyclopentanes by synergistic Pd(0)/amine catalyzed formal [3+2] cycloadditions of vinyl cyclopropanes with enals.","Chemical communications (Cambridge, England)","2016","52","30","5332","5335","10.1039/c6cc01775d","","","1.54178","CuKα","","0.0998","0.0772","","","0.2313","0.2498","","","","","","1.091","","","","has coordinates","182595","2020-10-21","18:00:00",""
"7118946","16.698","0.003","5.9368","0.001","15.65","0.003","90","","97.783","0.006","90","","1537.1","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 N O3 -","- C20 H15 N O3 -","- C80 H60 N4 O12 -","4","1","","Rathore, Kuldeep Singh; Lad, Bapurao Sudam; Chennamsetti, Haribabu; Katukojvala, Sreenivas","An unprecedented benzannulation of oxindoles with enalcarbenoids: a regioselective approach to functionalized carbazoles.","Chemical communications (Cambridge, England)","2016","52","34","5812","5815","10.1039/c5cc10637k","","","0.71073","MoKα","","0.172","0.0586","","","0.0992","0.1254","","","","","","1.011","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7118947","6.977","0.0005","8.8337","0.0006","14.5708","0.0011","93.367","0.003","102.682","0.003","108.417","0.002","823.26","0.1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H14 Cl N O3 -","- C20 H14 Cl N O3 -","- C40 H28 Cl2 N2 O6 -","2","1","","Rathore, Kuldeep Singh; Lad, Bapurao Sudam; Chennamsetti, Haribabu; Katukojvala, Sreenivas","An unprecedented benzannulation of oxindoles with enalcarbenoids: a regioselective approach to functionalized carbazoles.","Chemical communications (Cambridge, England)","2016","52","34","5812","5815","10.1039/c5cc10637k","","","0.71073","MoKα","","0.072","0.0592","","","0.1582","0.1683","","","","","","1.05","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7118948","16.024","0.005","15.055","0.004","6.3189","0.0018","90","","101.11","0.009","90","","1495.8","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H12 Cl N O2 -","- C19 H12 Cl N O2 -","- C76 H48 Cl4 N4 O8 -","4","1","","Rathore, Kuldeep Singh; Lad, Bapurao Sudam; Chennamsetti, Haribabu; Katukojvala, Sreenivas","An unprecedented benzannulation of oxindoles with enalcarbenoids: a regioselective approach to functionalized carbazoles.","Chemical communications (Cambridge, England)","2016","52","34","5812","5815","10.1039/c5cc10637k","","","0.71073","MoKα","","0.233","0.0675","","","0.1006","0.1357","","","","","","0.908","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7118949","21.845","0.003","16.43","0.002","20.014","0.003","90","","107.937","0.002","90","","6834.2","1.6","187","2","187","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C113 H38 N2 O2 S2 -","- C113 H38 N2 O2 S2 -","- C452 H152 N8 O8 S8 -","4","0.5","","Li, Shu-Hui; Li, Zong-Jun; Nakagawa, Takafumi; Jeon, Il; Ju, Zheng; Matsuo, Yutaka; Gao, Xiang","Multifunctionalization of C70 at the two polar regions with a high regioselectivity via oxazolination and benzylation reactions.","Chemical communications (Cambridge, England)","2016","52","33","5710","5713","10.1039/c6cc00997b","","","0.71073","MoKα","","0.1549","0.0817","","","0.1779","0.2145","","","","","","1.039","","","","has coordinates","182608","2020-10-21","18:00:00",""
"7118957","29.1376","0.0018","15.0037","0.0008","18.0317","0.0012","90","","109.95","0.002","90","","7409.9","0.8","200","2","200","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C76 H68 Cl8 Fe2 N4 O4 P4 Pt -","- C76 H68 Cl8 Fe2 N4 O4 P4 Pt -","- C304 H272 Cl32 Fe8 N16 O16 P16 Pt4 -","4","0.5","","Masaki Ito; Masato Iseki; Masumi Itazaki; Hiroshi Nakazawa","Tetrahedral cage complex with planar vertices: selective synthesis of Pt4L6 cage complexes involving hydrogen bonds driven by halide binding","Chem.Commun.","2016","52","","7205","","","","","0.7107","MoKα","","0.0494","0.0424","","","0.0883","0.0931","","","","","","1.065","","","","has coordinates,has disorder","183167","2020-10-21","18:00:00",""
"7118958","21.3085","0.0007","22.6838","0.0007","31.6313","0.0006","90.2849","0.001","90.4102","0.0006","117.182","0.0013","13599.8","0.7","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C224 H188 Cl32 Fe6 N12 O12 P12 Pt4 -","- C224 H188 Cl32 Fe6 N12 O12 P12 Pt4 -","- C448 H376 Cl64 Fe12 N24 O24 P24 Pt8 -","2","1","","Masaki Ito; Masato Iseki; Masumi Itazaki; Hiroshi Nakazawa","Tetrahedral cage complex with planar vertices: selective synthesis of Pt4L6 cage complexes involving hydrogen bonds driven by halide binding","Chem.Commun.","2016","52","","7205","","","","","0.71075","MoKα","","0.1003","0.0801","","","0.2359","0.2603","","","","","","1.058","","","","has coordinates","183167","2020-10-21","18:00:00",""
"7118959","21.4683","0.0001","23.594","0.0001","32.9537","0.0008","88.034","0.003","89.129","0.003","65.458","0.002","15174.9","0.5","200","2","200","2","","","","","","","","9","P -1","-P 1","2","","","","- C237 H201 Br8 Cl63 Fe6 N12 O12 P12 Pt4 -","- C224 H188 Br8 Cl24 Fe6 N12 O12 P12 Pt4 -","- C448 H376 Br16 Cl48 Fe12 N24 O24 P24 Pt8 -","2","1","","Masaki Ito; Masato Iseki; Masumi Itazaki; Hiroshi Nakazawa","Tetrahedral cage complex with planar vertices: selective synthesis of Pt4L6 cage complexes involving hydrogen bonds driven by halide binding","Chem.Commun.","2016","52","","7205","","","","","0.71075","MoKα","","0.0823","0.07","","","0.1895","0.2063","","","","","","1.07","","","","has coordinates","183167","2020-10-21","18:00:00",""
"7118960","11.7999","0.0001","12.6886","0.0002","19.4168","0.0002","83.953","0.003","73.888","0.003","87.375","0.002","2777.02","0.07","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H58 Cl2 N3 O4 P3 Pt -","- C61 H58 Cl2 N3 O4 P3 Pt -","- C122 H116 Cl4 N6 O8 P6 Pt2 -","2","1","","Masaki Ito; Masato Iseki; Masumi Itazaki; Hiroshi Nakazawa","Tetrahedral cage complex with planar vertices: selective synthesis of Pt4L6 cage complexes involving hydrogen bonds driven by halide binding","Chem.Commun.","2016","52","","7205","","","","","0.7107","MoKα","","0.033","0.0301","","","0.0643","0.0675","","","","","","1.101","","","","has coordinates","183167","2020-10-21","18:00:00",""
"7118961","13.7346","0.0013","11.888","0.001","9.9583","0.001","90","","104.743","0.005","90","","1572.4","0.3","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Fe N2 O2 P2 -","- C36 H30 Fe N2 O2 P2 -","- C72 H60 Fe2 N4 O4 P4 -","2","0.5","","Masaki Ito; Masato Iseki; Masumi Itazaki; Hiroshi Nakazawa","Tetrahedral cage complex with planar vertices: selective synthesis of Pt4L6 cage complexes involving hydrogen bonds driven by halide binding","Chem.Commun.","2016","52","","7205","","","","","0.710747","MoKα","","0.06","0.0433","","","0.0924","0.0997","","","","","","1.067","","","","has coordinates","183167","2020-10-21","18:00:00",""
"7118962","3.8289","0.0002","14.522","0.0006","12.2527","0.0005","90","","95.836","0.002","90","","677.76","0.05","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H3 Cl F2 O -","- C7 H3 Cl F2 O -","- C28 H12 Cl4 F8 O4 -","4","1","","Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra","'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids","Chem.Commun.","2016","52","","7225","","","","","0.71073","MoKα","","0.0304","0.0277","","","0.0734","0.0763","","","","","","1.089","","","","has coordinates","183168","2020-10-21","18:00:00",""
"7118963","7.4814","0.0004","8.5648","0.0004","10.7372","0.0006","100.231","0.003","95.404","0.003","91.365","0.003","673.48","0.06","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H3 Cl F2 O -","- C7 H3 Cl F2 O -","- C28 H12 Cl4 F8 O4 -","4","2","","Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra","'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids","Chem.Commun.","2016","52","","7225","","","","","0.71073","MoKα","","0.0375","0.0345","","","0.0964","0.0992","","","","","","1.099","","","","has coordinates","183168","2020-10-21","18:00:00",""
"7118964","7.4388","0.0002","15.7661","0.0003","11.8282","0.0002","90","","93.597","0.001","90","","1384.49","0.05","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H3 Cl F2 O -","- C7 H3 Cl F2 O -","- C56 H24 Cl8 F16 O8 -","8","2","","Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra","'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids","Chem.Commun.","2016","52","","7225","","","","","0.71073","MoKα","","0.0275","0.0262","","","0.0658","0.0672","","","","","","1.032","","","","has coordinates","183168","2020-10-21","18:00:00",""
"7118965","13.8205","0.0006","12.5452","0.0006","3.8197","0.0002","90","","90","","90","","662.26","0.06","110","2","110","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C7 H4 Cl F O -","- C7 H4 Cl F O -","- C28 H16 Cl4 F4 O4 -","4","1","","Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra","'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids","Chem.Commun.","2016","52","","7225","","","","","0.71073","MoKα","","0.0323","0.0268","","","0.0601","0.0673","","","","","","1.096","","","","has coordinates","183168","2020-10-21","18:00:00",""
"7118966","7.4704","0.0005","3.9581","0.0002","22.3439","0.0012","90","","93.566","0.003","90","","659.4","0.07","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H5 Cl O -","- C7 H5 Cl O -","- C28 H20 Cl4 O4 -","4","1","","Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra","'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids","Chem.Commun.","2016","52","","7225","","","","","0.71073","MoKα","","0.0559","0.0514","","","0.1507","0.1544","","","","","","1.112","","","","has coordinates","183168","2020-10-21","18:00:00",""
"7118967","6.859","0.0001","7.2006","0.0001","8.0365","0.0001","94.613","0.001","104.275","0.001","115.906","0.001","337.85","0.009","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H3 Cl F2 O -","- C7 H3 Cl F2 O -","- C14 H6 Cl2 F4 O2 -","2","1","","Dhananjay Dey; Subhrajyoti Bhandary; Abhishek Sirohiwal; Venkatesha R. Hathwar; Deepak Chopra","'Conformational lock' via unusual intramolecular C-F^...^O[double bond, length as m-dash]C and C-H^...^Cl-C parallel dipoles observed in in situ cryocrystallized liquids","Chem.Commun.","2016","52","","7225","","","","","0.71073","MoKα","","0.0258","0.0254","","","0.0723","0.0726","","","","","","1.158","","","","has coordinates","183168","2020-10-21","18:00:00",""
"7118968","12.3","0.005","19.75","0.005","24.63","0.005","90","","95.3","0.08","90","","5958","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","1-op","[Mn2(Gd-H-DOTA-4AmP)(H2O)7].21H2O","","- C20 H37 Gd Mn2 N8 O44 P4 -","- C20 H37 Gd Mn2 N8 O44 P4 -","- C80 H148 Gd4 Mn8 N32 O176 P16 -","4","1","","Javier Arinez-Soriano; Jorge Albalad; Christian Vila-Parrondo; Javier Perez-Carvajal; Sabina Rodriguez-Hermida; Aurelio Cabeza; Jordi Juanhuix; Inhar Imaz; Daniel Maspoch","Single-crystal and humidity-controlled powder diffraction study of the breathing effect in a metal-organic framework upon water adsorption/desorption","Chem.Commun.","2016","52","","7229","","10.1039/C6CC02908F","","","0.88557","synchrotron","","0.0909","0.0876","","","0.2453","0.2481","","","","","","1.08","","","","has coordinates","192149","2020-10-21","18:00:00",""
"7118969","26.09","0.005","14.51","0.005","12.2","0.005","90","0.005","110.19","0.005","90","0.005","4335","2","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H37 Gd Mn2 N8 O28 P4 -","- C20 H37 Gd Mn2 N8 O28 P4 -","- C80 H148 Gd4 Mn8 N32 O112 P16 -","4","0.5","","Javier Arinez-Soriano; Jorge Albalad; Christian Vila-Parrondo; Javier Perez-Carvajal; Sabina Rodriguez-Hermida; Aurelio Cabeza; Jordi Juanhuix; Inhar Imaz; Daniel Maspoch","Single-crystal and humidity-controlled powder diffraction study of the breathing effect in a metal-organic framework upon water adsorption/desorption","Chem.Commun.","2016","52","","7229","","10.1039/C6CC02908F","","","0.82653","synchrotronradiation","","0.1811","0.1361","","","0.2858","0.3221","","","","","","0.904","","","","has coordinates","192149","2020-10-21","18:00:00",""
"7118970","13.5064","0.0008","5.8689","0.0004","17.8643","0.0015","90","","102.617","0.007","90","","1381.87","0.17","273.77","0.1","273.77","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H40 O4 S -","- C30 H39 O4 S -","- C60 H78 O8 S2 -","2","1","","Congde Huo; Yajun Wang; Yong Yuan; Fengjuan Chen; Jing Tang","Auto-oxidative hydroxysulfenylation of alkenes","Chem.Commun.","2016","52","","7233","","","","x-ray","1.54184","CuKα","","0.1102","0.0628","","","0.1419","0.1783","","","","","","0.996","","","","has coordinates,has disorder","183170","2020-10-21","18:00:00",""
"7118971","11.8093","0.0003","10.6449","0.0003","10.6262","0.0003","90","","91.185","0.003","90","","1335.52","0.06","190","","190","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Nitro-5-(pentafluorosulfanyl)-N-phenylaniline","","- C12 H9 F5 N2 O2 S -","- C12 H9 F5 N2 O2 S -","- C48 H36 F20 N8 O8 S4 -","4","1","","V. V. Khutorianskyi; M. Sonawane; M. Posta; B. Klepetarova; P. Beier","Oxidative nucleophilic aromatic amination of nitrobenzenes","Chem.Commun.","2016","52","","7237","","","","x-ray","1.54184","CuKα","","0.0447","0.0404","","0.0609","0.0538","0.0538","","","","","","1.0328","","","","has coordinates","183171","2020-10-21","18:00:00",""
"7118972","32.27","","18.631","0.004","23.512","0.003","90","","117.225","0.007","90","","12570","3","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C51 H23 Cu6 N3 O33 -","- C51 H23 Cu6 N3 O33 -","- C204 H92 Cu24 N12 O132 -","4","0.5","","Mingxing Zhang; Bin Li; Yunzhi Li; Qian Wang; Wenwei Zhang; Banglin Chen; Shuhua Li; Yi Pan; Xiaozeng You; Junfeng Bai","Finely tuning MOFs towards high performance in C2H2 storage: synthesis and properties of a new MOF-505 analogue with an inserted amide functional group","Chem.Commun.","2016","52","","7241","","10.1039/C6CC03198F","","","0.71073","MoKα","","0.2204","0.1619","","","0.4197","0.4466","","","","","","1.044","","","","has coordinates,has disorder","190334","2020-10-21","18:00:00",""
"7118973","19.8378","0.0016","9.3737","0.0008","13.4463","0.0012","90","","90","","90","","2500.4","0.4","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C26 H28 N2 O6 S -","- C26 H28 N2 O6 S -","- C104 H112 N8 O24 S4 -","4","1","","Peng-Long Zhu; Xiang-Ying Tang; Min Shi","Intramolecular cyclizations of cyclopropenes with indole","Chem.Commun.","2016","52","","7245","","","","","0.71073","MoKα","","0.0542","0.0417","","","0.0989","0.1055","","","","","","1.018","","","","has coordinates","183173","2020-10-21","18:00:00",""
"7118974","9.9556","0.0015","14.589","0.002","18.274","0.003","81.682","0.003","76.959","0.004","88.485","0.004","2558.4","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H27 F3 N2 O4 S -","- C26 H27 F3 N2 O4 S -","- C104 H108 F12 N8 O16 S4 -","4","2","","Peng-Long Zhu; Xiang-Ying Tang; Min Shi","Intramolecular cyclizations of cyclopropenes with indole","Chem.Commun.","2016","52","","7245","","","","","0.71073","MoKα","","0.13","0.0645","","","0.1423","0.1746","","","","","","0.99","","","","has coordinates,has disorder","183173","2020-10-21","18:00:00",""
"7118975","12.3454","0.0009","8.661","0.0006","22.8626","0.0016","90","","90","","90","","2444.5","0.3","130","","130","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H26 N2 O4 S -","- C28 H26 N2 O4 S -","- C112 H104 N8 O16 S4 -","4","1","","Peng-Long Zhu; Xiang-Ying Tang; Min Shi","Intramolecular cyclizations of cyclopropenes with indole","Chem.Commun.","2016","52","","7245","","","","","0.71073","MoKα","","0.0522","0.0411","","","0.0916","0.0978","","","","","","1.014","","","","has coordinates","183173","2020-10-21","18:00:00",""
"7118976","14.3817","0.0015","10.8082","0.0011","19.0025","0.0018","90","","109.283","0.002","90","","2788","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H27 N3 O8 S -","- C30 H27 N3 O8 S -","- C120 H108 N12 O32 S4 -","4","1","","Peng-Long Zhu; Xiang-Ying Tang; Min Shi","Intramolecular cyclizations of cyclopropenes with indole","Chem.Commun.","2016","52","","7245","","","","","0.71073","MoKα","","0.0682","0.0486","","","0.1209","0.1326","","","","","","1.028","","","","has coordinates","183173","2020-10-21","18:00:00",""
"7118977","9.3636","0.0017","10.8898","0.0019","12.521","0.002","99.75","0.004","95.533","0.004","107.818","0.004","1182.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H25 N3 O5 S -","- C26 H25 N3 O5 S -","- C52 H50 N6 O10 S2 -","2","1","","Peng-Long Zhu; Xiang-Ying Tang; Min Shi","Intramolecular cyclizations of cyclopropenes with indole","Chem.Commun.","2016","52","","7245","","","","","0.71073","MoKα","","0.0673","0.0514","","","0.1292","0.1405","","","","","","1.028","","","","has coordinates","183173","2020-10-21","18:00:00",""
"7118980","9.8778","0.0004","19.2098","0.0008","16.2304","0.0006","90","","101.765","0.002","90","","3015","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H36 B10 Cl2 N P -","- C19 H36 B10 Cl2 N P -","- C76 H144 B40 Cl8 N4 P4 -","4","1","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.047","0.0378","","","0.104","0.1085","","","","","","1.077","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118981","17.159","0.003","13.438","0.003","11.014","0.002","90","","90","","90","","2539.6","0.9","296","2","296","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C19 H36 B10 N P -","- C19 H36 B10 N P -","- C76 H144 B40 N4 P4 -","4","0.5","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.1182","0.0728","","","0.1884","0.2258","","","","","","1.021","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118982","10.3092","0.0003","10.9189","0.0004","16.0645","0.0006","80.327","0.002","73.798","0.002","74.727","0.002","1666.41","0.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H42 B10 N O4 P -","- C23 H42 B10 N O4 P -","- C46 H84 B20 N2 O8 P2 -","2","1","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.0493","0.0435","","","0.1312","0.1353","","","","","","1.089","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118983","10.177","0.0004","10.4214","0.0005","25.2588","0.0011","101.476","0.001","99.642","0.001","90.279","0.001","2586.2","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H72 B20 N2 P2 S -","- C38 H72 B20 N2 P2 S -","- C76 H144 B40 N4 P4 S2 -","2","1","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.0539","0.044","","","0.1208","0.1289","","","","","","1.038","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118984","10.2136","0.0004","10.4144","0.0005","25.274","0.0012","101.61","0.0015","99.7572","0.0013","90.6407","0.0013","2592.4","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H72 B20 N2 P2 Se -","- C38 H72 B20 N2 P2 Se -","- C76 H144 B40 N4 P4 Se2 -","2","1","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.0489","0.0396","","","0.117","0.1244","","","","","","1.072","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118985","18.683","0.001","13.262","0.0007","31.5134","0.0017","90","","90","","90","","7808.2","0.7","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H56 B10 N3 P Si2 -","- C27 H56 B10 N3 P Si2 -","- C216 H448 B80 N24 P8 Si16 -","8","1","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.1083","0.0601","","","0.145","0.1773","","","","","","1.01","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118986","17.4405","0.0003","13.6893","0.0003","10.8979","0.0002","90","","90","","90","","2601.85","0.09","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C19 H37 B10 Cl N P -","- C19 H37 B10 Cl N P -","- C76 H148 B40 Cl4 N4 P4 -","4","0.5","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.0624","0.0467","","","0.1152","0.1268","","","","","","1.03","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118987","17.4404","0.0015","12.4044","0.0009","18.5294","0.0015","90","","115.893","0.003","90","","3606.2","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H55 B10 N2 P Si2 -","- C25 H55 B10 N2 P Si2 -","- C100 H220 B40 N8 P4 Si8 -","4","1","","Tek Long Chan; Zuowei Xie","The synthesis, structure and reactivity of an imine-stabilized carboranylphosphorus(I) compound","Chem.Commun.","2016","52","","7280","","","","","0.71073","MoKα","","0.0885","0.0758","","","0.2035","0.2177","","","","","","1.117","","","","has coordinates","183175","2020-10-21","18:00:00",""
"7118988","13.4335","0.0002","9.7044","0.0002","42.1106","0.0007","90","","90","","90","","5489.71","0.17","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","cis-(4-benzoylphenyl)dichlorotriphenylphosphine gold(III)","","- C31 H24 Au Cl2 O P -","- C31 H24 Au Cl2 O P -","- C248 H192 Au8 Cl16 O8 P8 -","8","1","","Eric Omar Asomoza-Solis; Jonathan Rojas-Ocampo; Ruben Alfredo Toscano; Susana Porcel","Arenediazonium salts as electrophiles for the oxidative addition of gold(I)","Chem.Commun.","2016","52","","7295","","","","","0.71073","MoKα","","0.0956","0.0451","","","0.074","0.0931","","","","","","1.019","","","","has coordinates","183177","2020-10-21","18:00:00",""
"7118989","9.36","0.003","16.371","0.005","16.662","0.005","90","","95.597","0.006","90","","2541","1.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","cis-(4-nitrophenyl)dichlorotriphenylphosphine gold(III)","","- C24 H19 Au Cl2 N O2 P -","- C24 H19 Au Cl2 N O2 P -","- C96 H76 Au4 Cl8 N4 O8 P4 -","4","1","","Eric Omar Asomoza-Solis; Jonathan Rojas-Ocampo; Ruben Alfredo Toscano; Susana Porcel","Arenediazonium salts as electrophiles for the oxidative addition of gold(I)","Chem.Commun.","2016","52","","7295","","","","","0.71073","MoKα","","0.0473","0.0296","","","0.0602","0.0678","","","","","","1.019","","","","has coordinates","183177","2020-10-21","18:00:00",""
"7118990","16.775","0.003","19.152","0.004","20.418","0.004","93.782","0.003","113.688","0.002","106.847","0.003","5623.4","1.9","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C105 H143 K2 N12 O37 P -","- C105 H119 K2 N12 O37 P -","- C210 H238 K4 N24 O74 P2 -","2","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.3316","0.1465","","","0.2739","0.3455","","","","","","1.186","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118991","14.99","0.004","16.27","0.004","25.088","0.006","99.668","0.004","100.824","0.004","105.587","0.004","5632","2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C98 H128 K N16 O28 P -","- C98 H125 K N16 O28 P -","- C196 H250 K2 N32 O56 P2 -","2","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.2452","0.1228","","","0.2519","0.278","","","","","","1.093","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118992","14.782","0.002","19.415","0.003","21.552","0.003","85.538","0.002","85.989","0.002","89.867","0.002","6151.4","1.5","188","2","188","2","","","","","","","","5","P -1","-P 1","2","","","","- C116 H174 N17 O27 P -","- C116 H172 N17 O27 P -","- C232 H344 N34 O54 P2 -","2","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.2401","0.13","","","0.2572","0.3015","","","","","","1.095","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118993","16.6867","0.0018","19.4","0.002","32.767","0.003","90","","112.755","0.004","90","","9781.8","1.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C360 H490 K8 N48 O133 S4 -","- C360 H480 K8 N48 O133 S4 -","- C360 H480 K8 N48 O133 S4 -","1","0.25","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.0744","0.0523","","","0.1332","0.1489","","","","","","1.038","","","","has coordinates,has disorder","183178","2020-10-21","18:00:00",""
"7118994","18.0761","0.0018","21.11","0.002","32.803","0.003","90","","122.13","0.004","90","","10600.1","1.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C97 H132 K2 N13 O35 S -","- C97 H130 K2 N13 O35 S -","- C388 H520 K8 N52 O140 S4 -","4","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.3711","0.1846","","","0.3121","0.3769","","","","","","1.157","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118995","20.611","0.005","31.842","0.008","8.872","0.002","90","","104.307","0.005","90","","5642","2","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C50 H75 Cl N10 O14 -","- C50 H75 Cl N10 O14 -","- C200 H300 Cl4 N40 O56 -","4","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.0613","0.0474","","","0.1296","0.1475","","","","","","1.028","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118996","18.572","0.005","34.162","0.008","8.774","0.002","90","","94.732","0.004","90","","5548","2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H78 Cl N9 O14 -","- C51 H78 Cl N9 O14 -","- C204 H312 Cl4 N36 O56 -","4","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.2653","0.189","","","0.3684","0.4077","","","","","","1.179","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118997","12.275","0.0016","13.0629","0.0017","19.863","0.003","71.072","0.002","78.86","0.001","70.582","0.002","2828.3","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H68 I2 N10 O10 -","- C51 H68 I2 N10 O10 -","- C102 H136 I4 N20 O20 -","2","1","","Liguo Ji; Zaiwen Yang; Yanxia Zhao; Meng Sun; Liping Cao; Xiao-Juan Yang; Yao-Yu Wang; Biao Wu","Sandwich phosphate complexes of macrocyclic tris(urea) ligands and their rotation around the anion","Chem.Commun.","2016","52","","7310","","","","","0.71073","MoKα","","0.0772","0.0685","","","0.1542","0.1585","","","","","","1.156","","","","has coordinates","183178","2020-10-21","18:00:00",""
"7118998","9.4639","0.0002","10.1522","0.0002","14.1214","0.0003","77.6074","0.0008","86.1247","0.0009","71.6074","0.0007","1257.47","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H21 P Se -","- C29 H21 P Se -","- C58 H42 P2 Se2 -","2","1","","Massimo Rigo; Manuela Weber; Christian Muller","Expanding the phosphorus-carbon analogy: formation of an unprecedented 5-phosphasemibullvalene derivative","Chem.Commun.","2016","52","","7090","","","","","0.71073","MoKα","","0.043","0.0332","","","0.0728","0.0763","","","","","","1.053","","","","has coordinates","183179","2020-10-21","18:00:00",""
"7118999","17.055","0.009","10.409","0.006","7.301","0.004","90","","111.071","0.01","90","","1209.4","1.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H9 B O3 -","- C18 H9 B O3 -","- C72 H36 B4 O12 -","4","0.5","","Yuichi Kitamoto; Takatsugu Suzuki; Yasuo Miyata; Hiroshi Kita; Kenji Funaki; Shuichi Oi","The first synthesis and X-ray crystallographic analysis of an oxygen-bridged planarized triphenylborane","Chem.Commun.","2016","52","","7098","","","","","0.71075","MoKα","","0.1062","0.0529","","","0.117","0.1337","","","","","","0.89","","","","has coordinates","183180","2020-10-21","18:00:00",""
"7119000","7.0843","0.0001","25.1223","0.0002","8.2327","0.0001","90","","103.844","0.0004","90","","1422.65","0.03","100","","100","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C37 H33 N5 Ni -","- C37 H33 N5 Ni -","- C74 H66 N10 Ni2 -","2","0.5","","Ryo Nozawa; Keitaro Yamamoto; Ichiro Hisaki; Ji-Young Shin; Hiroshi Shinokubo","Ni^II^ tetrahydronorcorroles: antiaromatic porphyrinoids with saturated pyrrole units","Chem.Commun.","2016","52","","7106","","","","","0.8","synchrotron","","0.059","0.0589","","","0.1381","0.1381","","","","","","1.146","","","","has coordinates,has disorder","183182","2020-10-21","18:00:00",""
"7119001","14.579","0.003","9.8759","0.0017","9.0753","0.0015","90","","102.459","0.005","90","","1275.9","0.4","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N O3 -","- C14 H15 N O3 -","- C56 H60 N4 O12 -","4","1","","Nicole S. Y. Loy; Subin Choi; Sunggak Kim; Cheol-Min Park","The synthesis of pyrroles and oxazoles based on gold alpha-imino carbene complexes","Chem.Commun.","2016","52","","7336","","","","","0.71073","MoKα","","0.1498","0.0607","","","0.1381","0.1928","","","","","","0.977","","","","has coordinates","183251","2020-10-21","18:00:00",""
"7119002","30.509","0.006","14.5498","0.0018","33.049","0.004","90","","91.858","0.003","90","","14663","4","103","2","103.15","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","kim5","(Z)-1-(5-ethoxy-2-(4-nitrophenyl)oxazol-4-yl)ethan-1-one O-methyl oxime","","- C14 H15 N3 O5 -","- C14 H15 N3 O5 -","- C560 H600 N120 O200 -","40","5","","Nicole S. Y. Loy; Subin Choi; Sunggak Kim; Cheol-Min Park","The synthesis of pyrroles and oxazoles based on gold alpha-imino carbene complexes","Chem.Commun.","2016","52","","7336","","","","","0.71073","MoKα","","0.1417","0.0772","","","0.1992","0.2499","","","","","","1.031","","","","has coordinates,has disorder","183251","2020-10-21","18:00:00",""
"7119003","24.7264","0.0007","9.6603","0.0002","23.4725","0.0007","90","","109.127","0.003","90","","5297.2","0.3","150","0.2","150","0.2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H65 B Br Cl9 F N2 P -","- C44 H65 B Br Cl9 F N2 P -","- C176 H260 B4 Br4 Cl36 F4 N8 P4 -","4","1","","Shubhanchi Nigam; Benjamin P. Burke; Laura H. Davies; Juozas Domarkas; Jennifer F. Wallis; Paul G. Waddell; Jennifer S. Waby; David M. Benoit; Anne-Marie Seymour; Christopher Cawthorne; Lee J. Higham; Stephen J. Archibald","Structurally optimised BODIPY derivatives for imaging of mitochondrial dysfunction in cancer and heart cells","Chem.Commun.","2016","52","","7114","","","","x-ray","1.54184","CuKα","","0.1093","0.0685","","","0.1786","0.2101","","","","","","1.02","","","","has coordinates,has disorder","183252","2020-10-21","18:00:00",""
"7119004","10.064","0.003","8.502","0.002","13.718","0.004","90","","100.284","0.007","90","","1154.9","0.6","100","","100","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H28 Br N3 O3 -","- C25 H28 Br N3 O3 -","- C50 H56 Br2 N6 O6 -","2","1","","Jakob Blom; Tore Kiilerich Johansen; Frank Jensen; Karl Anker Jorgensen","Dynamic resolution of 2-cyclohexylidene acetaldehydes through organocatalytic dienamine [4+2] cycloaddition","Chem.Commun.","2016","52","","7153","","","","","0.56086","AgKα","","0.0463","0.0374","","","0.0958","0.1016","","","","","","1.003","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7119005","12.983","0.003","10.976","0.003","16.961","0.004","90","","99.955","0.008","90","","2380.6","1","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H27 N3 O4 -","- C30 H27 N3 O4 -","- C120 H108 N12 O16 -","4","2","","Jakob Blom; Tore Kiilerich Johansen; Frank Jensen; Karl Anker Jorgensen","Dynamic resolution of 2-cyclohexylidene acetaldehydes through organocatalytic dienamine [4+2] cycloaddition","Chem.Commun.","2016","52","","7153","","","","x-ray","0.56086","AgKα","","0.0545","0.0416","","","0.092","0.1","","","","","","1.0081","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7119006","15.361","0.004","4.955","0.0013","14.843","0.004","90","","98.245","0.007","90","","1118.1","0.5","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 N2 O6 -","- C26 H24 N2 O6 -","- C52 H48 N4 O12 -","2","0.5","","Kazuto Nakamura; Nobuhiro Yasuda; Hiromitsu Maeda","Dimension-controlled assemblies of modified bipyrroles stabilized by electron-withdrawing moieties","Chem.Commun.","2016","52","","7157","","","","","1.54187","CuKα","","0.0374","0.0329","","","0.0938","0.0957","","","","","","1.074","","","","has coordinates","183254","2020-10-21","18:00:00",""
"7119007","7.9706","0.0019","10.519","0.003","17.44","0.004","87.803","0.004","86.847","0.004","78.375","0.004","1429.5","0.6","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","DBBP-6OMe","","- C30 H32 N2 O9 -","- C30 H32 N2 O9 -","- C60 H64 N4 O18 -","2","1","","Kazuto Nakamura; Nobuhiro Yasuda; Hiromitsu Maeda","Dimension-controlled assemblies of modified bipyrroles stabilized by electron-withdrawing moieties","Chem.Commun.","2016","52","","7157","","","","","0.78203","Synchrotron","","0.1119","0.0551","","","0.1213","0.182","","","","","","1.132","","","","has coordinates,has disorder","183254","2020-10-21","18:00:00",""
"7119008","13.7969","0.0011","14.7646","0.001","20.728","0.002","92.826","0.009","108.606","0.007","114.956","0.008","3544","0.6","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H112 I3 N8 Nd O10 P4 -","- C40 H112 I3 N8 Nd O10 P4 -","- C80 H224 I6 N16 Nd2 O20 P8 -","2","1","","Sandeep K. Gupta; Thayalan Rajeshkumar; Gopalan Rajaraman; Ramaswamy Murugavel","An unprecedented zero field neodymium(III) single-ion magnet based on a phosphonic diamide","Chem.Commun.","2016","52","","7168","","","","","0.71075","MoKα","","0.0311","0.0304","","","0.0751","0.0756","","","","","","1.056","","","","has coordinates","183255","2020-10-21","18:00:00",""
"7119009","8.8932","0.001","11.8369","0.0005","15.1942","0.0008","72.926","0.004","88.754","0.006","88.696","0.006","1528.4","0.2","100.03","0.1","100.03","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C54 H38 Cd N8 O4 -","- C54 H38 Cd N8 O4 -","- C54 H38 Cd N8 O4 -","1","0.5","","Jian-Cheng Wang; Jian-Ping Ma; Qi-Kui Liu; Yu-Hong Hu; Yu-Bin Dong","Cd(II)-MOF-IM: post-synthesis functionalization of a Cd(II)-MOF as a triphase transfer catalyst","Chem.Commun.","2016","52","","6989","","10.1039/C6CC00576D","","x-ray","1.54184","CuKα","","0.0895","0.0733","","","0.1886","0.2008","","","","","","0.986","","","","has coordinates,has disorder","192152","2020-10-21","18:00:00",""
"7119010","11.479","0.004","8.356","0.003","12.079","0.004","90","","104.039","0.005","90","","1124","0.7","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(M)-Co(SO4)(1,3-bbix)(H2O)3","","- C22 H24 Co N4 O7 S -","- C22 H24 Co N4 O7 S -","- C44 H48 Co2 N8 O14 S2 -","2","1","","Jian-Shen Feng; Min Ren; Zhong-Sheng Cai; Kun Fan; Song-Song Bao; Li-Min Zheng","Enantiopure phosphonic acids as chiral inducers: homochiral crystallization of cobalt coordination polymers showing field-induced slow magnetization relaxation","Chem.Commun.","2016","52","","6877","","","","","0.71073","MoKα","","0.111","0.0976","","","0.2295","0.2384","","","","","","1.002","","","","has coordinates","183258","2020-10-21","18:00:00",""
"7119011","11.495","0.004","8.412","0.003","12.098","0.004","90","","103.45","0.005","90","","1137.7","0.7","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(P)-Co(SO4)(1,3-bbix)(H2O)3","","- C22 H24 Co N4 O7 S -","- C22 H24 Co N4 O7 S -","- C44 H48 Co2 N8 O14 S2 -","2","1","","Jian-Shen Feng; Min Ren; Zhong-Sheng Cai; Kun Fan; Song-Song Bao; Li-Min Zheng","Enantiopure phosphonic acids as chiral inducers: homochiral crystallization of cobalt coordination polymers showing field-induced slow magnetization relaxation","Chem.Commun.","2016","52","","6877","","","","","0.71073","MoKα","","0.0723","0.0562","","","0.1264","0.1358","","","","","","1","","","","has coordinates","183258","2020-10-21","18:00:00",""
"7119012","13.9705","0.0006","34.3796","0.0016","8.1479","0.0003","90","","90","","90","","3913.4","0.3","150","","150","","","","","","","","synthesis as described","3","C c m 21","C 2c -2c","36","","","","- C55 H31 N3 -","- C55 H31 N3 -","- C220 H124 N12 -","4","0.5","","Helena Isla; Monika Srebro-Hooper; Marion Jean; Nicolas Vanthuyne; Thierry Roisnel; Jamie L. Lunkley; Gilles Muller; J. A. Gareth Williams; Jochen Autschbach; Jeanne Crassous","Conformational changes and chiroptical switching of enantiopure bis-helicenic terpyridine upon Zn^2+^ binding","Chem.Commun.","2016","52","","5932","","","","x-ray","1.54178","CuKα","","0.0527","0.047","","","0.1355","0.1428","","","","","","1.082","","","","has coordinates","183259","2020-10-21","18:00:00",""
"7119013","15.3452","0.0006","16.8828","0.0007","18.9071","0.0007","90","","94.356","0.002","90","","4884.1","0.3","150","","150","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C61 H41 Cl4 N3 O4 Zn -","- C61 H41 Cl4 N3 O4 Zn -","- C244 H164 Cl16 N12 O16 Zn4 -","4","1","","Helena Isla; Monika Srebro-Hooper; Marion Jean; Nicolas Vanthuyne; Thierry Roisnel; Jamie L. Lunkley; Gilles Muller; J. A. Gareth Williams; Jochen Autschbach; Jeanne Crassous","Conformational changes and chiroptical switching of enantiopure bis-helicenic terpyridine upon Zn^2+^ binding","Chem.Commun.","2016","52","","5932","","","","x-ray","0.71073","MoKα","","0.071","0.0516","","","0.125","0.1431","","","","","","1.039","","","","has coordinates,has disorder","183259","2020-10-21","18:00:00",""
"7119014","8.9558","0.0008","11.4826","0.0007","21.7545","0.0018","90","","90","","90","","2237.1","0.3","150","","150","","","","","","","","synthesis as described","3","P 21 2 21","P 2ac 2ac","18","","","","- C55 H31 N3 -","- C55 H31 N3 -","- C110 H62 N6 -","2","0.5","","Helena Isla; Monika Srebro-Hooper; Marion Jean; Nicolas Vanthuyne; Thierry Roisnel; Jamie L. Lunkley; Gilles Muller; J. A. Gareth Williams; Jochen Autschbach; Jeanne Crassous","Conformational changes and chiroptical switching of enantiopure bis-helicenic terpyridine upon Zn^2+^ binding","Chem.Commun.","2016","52","","5932","","","","x-ray","0.71073","MoKα","","0.1014","0.0857","","","0.2137","0.2221","","","","","","1.065","","","","has coordinates,has disorder","183259","2020-10-21","18:00:00",""
"7119015","8.7316","0.0017","15.311","0.003","16.873","0.003","72.77","0.03","82.43","0.03","86.08","0.03","2134.7","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H18 Ag7 F15 N6 O10 -","- C27 H18 Ag7 F15 N6 O10 -","- C54 H36 Ag14 F30 N12 O20 -","2","1","","Xin He; Hai-Xia Liu; Liang Zhao","Integration of acetylenic carbon clusters and silver clusters: template synthesis and stability enhancement","Chem.Commun.","2016","52","","5682","","","","","0.71073","MoKα","","0.0809","0.0637","","","0.11","0.1191","","","","","","1.159","","","","has coordinates,has disorder","183260","2020-10-21","18:00:00",""
"7119016","20.7","0.004","23.694","0.005","31.929","0.006","90","","92.38","0.03","90","","15647","5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C82 H96 Ag22 F48 O48.5 S16 -","- C82 H96 Ag22 F48 O48.5 S16 -","- C328 H384 Ag88 F192 O194 S64 -","4","1","","Xin He; Hai-Xia Liu; Liang Zhao","Integration of acetylenic carbon clusters and silver clusters: template synthesis and stability enhancement","Chem.Commun.","2016","52","","5682","","","","","0.71073","MoKα","","0.095","0.0845","","","0.2177","0.2293","","","","","","1.161","","","","has coordinates,has disorder","183260","2020-10-21","18:00:00",""
"7119017","26.341","0.005","13.125","0.003","36.552","0.007","90","","105.85","0.03","90","","12157","5","173.15","","173.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C128 H150 Ag34 F72 O74 S24 -","- C128 H150 Ag34 F72 O74 S24 -","- C256 H300 Ag68 F144 O148 S48 -","2","0.5","","Xin He; Hai-Xia Liu; Liang Zhao","Integration of acetylenic carbon clusters and silver clusters: template synthesis and stability enhancement","Chem.Commun.","2016","52","","5682","","","","","0.71073","MoKα","","0.1165","0.1011","","","0.2218","0.2327","","","","","","1.198","","","","has coordinates,has disorder","183260","2020-10-21","18:00:00",""
"7119018","10.267","0.005","32.086","0.005","6.955","0.005","90","0.005","90","0.005","90","0.005","2291","2","293","2","293","2","","","","","","","","5","C m c m","-C 2c 2","63","USTC-7","","","- C15 H7 N4 O7 Zn2 -","- C15 H7 N4 O7 Zn2 -","- C60 H28 N16 O28 Zn8 -","4","0.25","","Yingli Hu; Meili Ding; Xiao-Qin Liu; Lin-Bing Sun; Hai-Long Jiang","Rational synthesis of an exceptionally stable Zn(II) metal-organic framework for the highly selective and sensitive detection of picric acid","Chem.Commun.","2016","52","","5734","","10.1039/C6CC01597B","","","0.71069","MoKα","","0.0598","0.053","","","0.1538","0.1588","","","","","","1.108","","","","has coordinates","192150","2020-10-21","18:00:00",""
"7119019","12.974","0.003","31.717","0.007","15.286","0.003","90","","95.96","0.003","90","","6256","2","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H89 Cl N4 O2 P2 -","- C62 H89 Cl N4 O2 P2 -","- C248 H356 Cl4 N16 O8 P8 -","4","1","","Yuzhong Wang; Hunter P. Hickox; Yaoming Xie; Pingrong Wei; Dongtao Cui; Melody R. Walter; Henry F. Schaefer III; Gregory H. Robinson","Protonation of carbene-stabilized diphosphorus: complexation of HP2+","Chem.Commun.","2016","52","","5746","","","","","0.71073","MoKα","","0.1367","0.0775","","","0.1834","0.2193","","","","","","1.014","","","","has coordinates,has disorder","183296","2020-10-21","18:00:00",""
"7119020","11.4425","0.0007","11.4934","0.0008","13.0446","0.0009","74.006","0.001","71.922","0.001","78.818","0.001","1556.65","0.18","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C76 H76 O8 -","- C76 H76 O8 -","- C76 H76 O8 -","1","0.5","","Bo Gao; Li-Li Tan; Nan Song; Ke Li; Ying-Wei Yang","A high-yield synthesis of [m]biphenyl-extended pillar[n]arenes for an efficient selective inclusion of toluene and m-xylene in the solid state","Chem.Commun.","2016","52","","5804","","","","","0.71073","MoKα","","0.1069","0.0686","","","0.1624","0.1937","","","","","","1.02","","","","has coordinates","183309","2020-10-21","18:00:00",""
"7119021","11.3535","0.0013","11.5292","0.0013","13.4501","0.0015","70.421","0.002","73.067","0.002","78.916","0.002","1578.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","m-xylene2_Bp_ExP6","","- C78 H80 O8 -","- C78 H80 O8 -","- C78 H80 O8 -","1","0.5","","Bo Gao; Li-Li Tan; Nan Song; Ke Li; Ying-Wei Yang","A high-yield synthesis of [m]biphenyl-extended pillar[n]arenes for an efficient selective inclusion of toluene and m-xylene in the solid state","Chem.Commun.","2016","52","","5804","","","","","0.71073","MoKα","","0.0933","0.056","","","0.1309","0.1532","","","","","","1.004","","","","has coordinates","183309","2020-10-21","18:00:00",""
"7119022","4.7306","0.0001","21.6655","0.0004","8.1069","0.0001","90","","103.803","0.002","90","","806.89","0.03","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide","Acetazolamide","","- C4 H6 N4 O3 S2 -","- C4 H6 N4 O3 S2 -","- C16 H24 N16 O12 S8 -","4","1","","Sounak Sarkar; Mysore S. Pavan; Suryanarayan Cherukuvada; Tayur N. Guru Row","Acetazolamide polymorphism: a case of hybridization induced polymorphism?","Chem.Commun.","2016","52","","5820","","","","x-ray","0.71073","MoKα","","0.037","0.022","","","","0.048","0.027","","","","","0.992","","","","has coordinates","183310","2020-10-21","18:00:00",""
"7119023","12.3361","0.0005","16.8521","0.0005","12.0571","0.0005","90","","112.1","0.005","90","","2322.38","0.17","571","2","571","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","fused heterocycle","1-azaphenalene","","- C28 H27 N O6 -","- C28 H27 N O6 -","- C112 H108 N4 O24 -","4","1","","Ying Xie; Xun Chen; Xin Liu; Shi-Jian Su; Jianzhang Li; Wei Zeng","Rh(III)-catalyzed relay carbenoid functionalization of aromatic C-H bonds: access to pi-conjugated fused heteroarenes","Chem.Commun.","2016","52","","5856","","","","","1.54178","CuKα","","0.0574","0.0513","","","0.1346","0.1402","","","","","","1.051","","","","has coordinates","183311","2020-10-21","18:00:00",""
"7119024","29.44","0.005","29.44","0.005","11.679","0.002","90","","90","","120","","8766","3","93","2","93","2","","","","","","","","5","P 63","P 6c","173","","","","- C61.4 H43.6 Cl4 N2 O6.2 -","- C61.4 H43.6 Cl4 N2 O6.2 -","- C368.4 H261.6 Cl24 N12 O37.2 -","6","1","","Midori Nagamoto; Daisuke Yamauchi; Takahiro Nishimura","Iridium-catalyzed asymmetric [3+2] annulation of aromatic ketimines with alkynes via C-H activation: unexpected inversion of the enantioselectivity induced by protic acids","Chem.Commun.","2016","52","","5876","","","","","1.54187","CuKα","","0.0755","0.0668","","","0.1842","0.189","","","","","","1.097","","","","has coordinates","183312","2020-10-21","18:00:00",""
"7119025","9.2746","0.0003","10.8353","0.0004","11.1364","0.0004","91.652","0.002","103.923","0.002","90.151","0.002","1085.75","0.07","173","2","173","2","","","","","","","watercress (Nasturtium officinale)","4","P -1","-P 1","2","","cyclonasturlexin","","- C11 H10 N2 S2 -","- C11 H10 N2 S2 -","- C44 H40 N8 S8 -","4","2","","M. S. C. Pedras; Q. H. To","Unveiling the first indole-fused thiazepine: structure, synthesis and biosynthesis of cyclonasturlexin, a remarkable cruciferous phytoalexin","Chem.Commun.","2016","52","","5880","","","","","0.71073","MoKα","","0.0657","0.0456","","","0.1144","0.1263","","","","","","1.053","","","","has coordinates","183313","2020-10-21","18:00:00",""
"7119031","13.3962","0.0012","19.3637","0.0016","22.587","0.002","90","","90","","90","","5859.1","0.9","123","","123","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(S)-binaphtyl gold(I)-isocyanide complex","(S)-1G","","- C34.5 H23 Au2 Cl N2 -","- C34.5 H23 Au2 Cl N2 -","- C276 H184 Au16 Cl8 N16 -","8","2","","Jin, Mingoo; Seki, Tomohiro; Ito, Hajime","Luminescent mechanochromism of a chiral complex: distinct crystal structures and color changes of racemic and homochiral gold( <scp>i</scp> ) isocyanide complexes with a binaphthyl moiety","Chem. Commun.","2016","52","52","8083","8086","10.1039/C6CC03541H","","","0.71075","MoKα","","0.0892","0.0641","","","0.1251","0.138","","","","","","1.051","","","","has coordinates,has disorder","282905","2023-04-28","18:54:43",""
"7119032","13.0435","0.0004","18.7272","0.0007","23.6159","0.0009","90","","90","","90","","5768.6","0.4","123","","123","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C34.25 H22.5 Au2 Cl0.5 N2 -","- C34.25 H22.5 Au2 Cl0.5 N2 -","- C274 H180 Au16 Cl4 N16 -","8","1","","Jin, Mingoo; Seki, Tomohiro; Ito, Hajime","Luminescent mechanochromism of a chiral complex: distinct crystal structures and color changes of racemic and homochiral gold( <scp>i</scp> ) isocyanide complexes with a binaphthyl moiety","Chem. Commun.","2016","52","52","8083","8086","10.1039/C6CC03541H","","","0.71075","MoKα","","0.0532","0.038","","","0.0701","0.0749","","","","","","1.061","","","","has coordinates,has disorder","282905","2023-04-28","18:54:43",""
"7119034","18.985","0.0008","10.8911","0.0005","14.8749","0.0007","90","","90","","90","","3075.6","0.2","180","2","180","2","","","","","","","","7","C m c m","-C 2c 2","63","","","","- C20 H57 B2 Li N2 P2 Sn -","- C20 H57 B2 Li N2 P2 Sn -","- C80 H228 B8 Li4 N8 P8 Sn4 -","4","0.25","","Maria Fernandez-Millan; Lucy K. Allen; Raul Garcia-Rodriguez; Andrew D. Bond; Marta E. G. Mosquera; Dominic S. Wright","Formation of a unique 'unsupported' hydridic stannate(II)","Chem.Commun.","2016","52","","5993","","","","","1.54178","CuKα","","0.0251","0.0228","","","0.0546","0.0561","","","","","","1.091","","","","has coordinates,has disorder","183980","2020-10-21","18:00:00",""
"7119035","40.8424","0.0009","40.8424","0.0009","40.8424","0.0009","90","","90","","90","","68129","3","100","","100","","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C216 H228 F96 N72 Sb16 Zn8 -","- C216 H237 F84.0002 N72 Sb14.0002 Zn8 -","- C1728 H1896 F672.002 N576 Sb112.002 Zn64 -","8","0.333333","","Jing Yang; Xiao-Yong Chang; Kiu-Chor Sham; Shek-Man Yiu; Hoi-Lun Kwong; Chi-Ming Che","M8L12 cubic cages with all facial delta or facial lamda configuration: effects of surface anions on the occupancy of the cage and anion exchange","Chem.Commun.","2016","52","","5981","","","","","1.54178","CuKα","","0.1065","0.0977","","","0.2862","0.2969","","","","","","1.086","","","","has coordinates,has disorder","183981","2020-10-21","18:00:00",""
"7119036","41.313","0.005","41.313","0.005","41.313","0.005","90","","90","","90","","70512","15","100","","100","","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C232 H240 Cd8 F48 N72 O48 S16 -","- C232 H240 Cd8 F47.9997 N72 O48.0001 S16 -","- C1856 H1920 Cd64 F383.998 N576 O384.001 S128 -","8","0.333333","","Jing Yang; Xiao-Yong Chang; Kiu-Chor Sham; Shek-Man Yiu; Hoi-Lun Kwong; Chi-Ming Che","M8L12 cubic cages with all facial delta or facial lamda configuration: effects of surface anions on the occupancy of the cage and anion exchange","Chem.Commun.","2016","52","","5981","","","","","0.78","","","0.1477","0.1226","","","0.3474","0.3748","","","","","","1.014","","","","has coordinates,has disorder","183981","2020-10-21","18:00:00",""
"7119037","26.6801","0.0003","26.6801","0.0003","26.6801","0.0003","90","","90","","90","","18991.6","0.4","173","2","173","2","","","","","","","","6","P n -3 n :2","-P 4a 2bc 3","222","","","","- C240 H240 F39 Mn8 N84 P6.5 -","- C240 H240 F39 Mn8 N84 P6.5 -","- C480 H480 F78 Mn16 N168 P13 -","2","0.0416667","","Jing Yang; Xiao-Yong Chang; Kiu-Chor Sham; Shek-Man Yiu; Hoi-Lun Kwong; Chi-Ming Che","M8L12 cubic cages with all facial delta or facial lamda configuration: effects of surface anions on the occupancy of the cage and anion exchange","Chem.Commun.","2016","52","","5981","","","","","1.54178","CuKα","","0.1684","0.1287","","","0.3681","0.3942","","","","","","1.325","","","","has coordinates","183981","2020-10-21","18:00:00",""
"7119038","9.1953","0.0005","15.9688","0.0008","16.377","0.0009","90","","90","","90","","2404.8","0.2","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H35 N3 O6 -","- C20 H35 N3 O6 -","- C80 H140 N12 O24 -","4","1","","Mihye Lee; Jihyun Shim; Philjae Kang; Moon-Gun Choi; Soo Hyuk Choi","Stabilization of 11/9-helical alpha/beta-peptide foldamers in protic solvents","Chem.Commun.","2016","52","","5950","","","","","0.71073","MoKα","","0.0525","0.0355","","","0.0719","0.0779","","","","","","1.052","","","","has coordinates","183982","2020-10-21","18:00:00",""
"7119039","9.7107","0.0007","17.8054","0.0012","18.6925","0.0014","90","","90","","90","","3232","0.4","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H49 N5 O8 -","- C29 H49 N5 O8 -","- C116 H196 N20 O32 -","4","1","","Mihye Lee; Jihyun Shim; Philjae Kang; Moon-Gun Choi; Soo Hyuk Choi","Stabilization of 11/9-helical alpha/beta-peptide foldamers in protic solvents","Chem.Commun.","2016","52","","5950","","","","","0.71073","MoKα","","0.0299","0.0275","","","0.067","0.0686","","","","","","1.053","","","","has coordinates","183982","2020-10-21","18:00:00",""
"7119040","9.5052","0.0017","17.583","0.003","23.471","0.004","90","","90","","90","","3922.7","1.2","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C31 H52 Cl3 N5 O8 -","- C31 H52 Cl3 N5 O8 -","- C124 H208 Cl12 N20 O32 -","4","1","","Mihye Lee; Jihyun Shim; Philjae Kang; Moon-Gun Choi; Soo Hyuk Choi","Stabilization of 11/9-helical alpha/beta-peptide foldamers in protic solvents","Chem.Commun.","2016","52","","5950","","","","","1.54178","CuKα","","0.0711","0.0682","","","0.1889","0.1943","","","","","","1.041","","","","has coordinates,has disorder","183982","2020-10-21","18:00:00",""
"7119041","8.28","0.007","11.804","0.01","12.324","0.01","64.811","0.014","88.065","0.015","80.753","0.017","1075","1.6","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H25 N O S -","- C26 H25 N O S -","- C52 H50 N2 O2 S2 -","2","1","","Jia-Jia Zhao; Man Tang; Hong-Hao Zhang; Meng-Meng Xu; Feng Shi","Bronsted acid-catalyzed chemodivergent reactions of ortho-mercaptobenzyl alcohols with 3-alkyl-2-vinylindoles and styrenes: [5+2] cyclization versus hydroxysulfenylation","Chem.Commun.","2016","52","","5953","","","","","0.71073","MoKα","","0.1149","0.0534","","","0.1197","0.1454","","","","","","0.973","","","","has coordinates","183983","2020-10-21","18:00:00",""
"7119042","8.5603","0.0003","22.813","0.0007","17.3998","0.0006","90","","94.2688","0.0017","90","","3388.5","0.2","296","","296","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C35 H42 O4 S3 -","- C35 H42 O4 S3 -","- C140 H168 O16 S12 -","4","1","","Jia-Jia Zhao; Man Tang; Hong-Hao Zhang; Meng-Meng Xu; Feng Shi","Bronsted acid-catalyzed chemodivergent reactions of ortho-mercaptobenzyl alcohols with 3-alkyl-2-vinylindoles and styrenes: [5+2] cyclization versus hydroxysulfenylation","Chem.Commun.","2016","52","","5953","","","","","0.71073","MoKα","","0.0417","0.0308","","","0.066","0.0712","","","","","","1.022","","","","has coordinates","183983","2020-10-21","18:00:00",""
"7119043","11.228","0.002","12.46","0.003","12.943","0.003","77.35","0.03","89.67","0.03","86.39","0.03","1763.2","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H14 F4 N2 O2 -","- C20 H14 F4 N2 O2 -","- C80 H56 F16 N8 O8 -","4","2","","Yingle Liu; Ke Zhang; Yangen Huang; Shen Pan; Xiao-Qiang Liu; Yi Yang; Yan Jiang; Xiu-Hua Xu","Synthesis of 3-fluoroalkenyl-3-trifluoromethyl-2-oxindoles by the reaction of indoline-2,3-diones with difluoromethylene phosphabetaine","Chem.Commun.","2016","52","","5969","","","","","1.54178","CuKα","","0.0523","0.0502","","","0.1424","0.1449","","","","","","1.035","","","","has coordinates","183984","2020-10-21","18:00:00",""
"7119044","15.667","0.002","15.136","0.002","7.3104","0.0011","90","","110.57","0.002","90","","1623","0.4","300","2","300","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Fe(H2O)2(bpy)[Pt(CN)4]?H2O","","- C14 H8 Fe N6 O2 Pt -","- C14 H8 Fe N6 O2 Pt -","- C56 H32 Fe4 N24 O8 Pt4 -","4","0.5","","Tomoyuki Haraguchi; Kazuya Otsubo; Osami Sakata; Shogo Kawaguchi; Akihiko Fujiwara; Hiroshi Kitagawa","A three-dimensional accordion-like metal∓organic framework: synthesis and unconventional oriented growth on a surface","Chem.Commun.","2016","52","","6017","","","","","0.71073","MoKα","","0.0531","0.0501","","","0.1232","0.1257","","","","","","1.088","","","","has coordinates","183985","2020-10-21","18:00:00",""
"7119045","8.33","0.0017","12.431","0.003","9.528","0.0019","90","","93.09","0.03","90","","985.2","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H17 N O4 S -","- C23 H17 N O4 S -","- C46 H34 N2 O8 S2 -","2","1","","Zhuang Song; Yizhou Wu; Tao Xin; Chao Jin; Xiaoan Wen; Hongbin Sun; Qing-Long Xu","The Rh(II)-catalyzed formal N-S bond insertion reaction of aryldiazoacetates into N-phenyl-sulfenyl phthalimide","Chem.Commun.","2016","52","","6079","","","","","0.71073","MoKα","","0.1107","0.0707","","","0.1655","0.1891","","","","","","1.011","","","","has coordinates","183988","2020-10-21","18:00:00",""
"7119046","43.889","0.006","31.033","0.004","26.186","0.004","90","","123.512","0.002","90","","29737","7","173.15","","173.15","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","","","- C467 Ag120 B4 Cl4 F64 N10 O45 S24 Si8 -","- C467 Ag120 B4 Cl4 F64 N10 O45 S24 Si8 -","- C934 Ag240 B8 Cl8 F128 N20 O90 S48 Si16 -","2","0.25","","Zi-Yi Chen; Dennis Y. S. Tam; Thomas C. W. Mak","Ethynide-stabilized high-nuclearity silver(I) sulfido molecular clusters assembled using organic sulfide precursors","Chem.Commun.","2016","52","","6119","","","","","0.71073","MoKα","","0.117","0.0699","","","0.1842","0.2358","","","","","","1.066","","","","has coordinates,has disorder","183989","2020-10-21","18:00:00",""
"7119047","19.8433","0.0012","28.203","0.0016","23.1207","0.0013","90","","97.808","0.002","90","","12819.3","1.3","173","2","173","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C198 Ag46 B2 F8 N2 O14 S6 -","- C198 Ag46.012 B2 F8 N2 O14 S6 -","- C396 Ag92.024 B4 F16 N4 O28 S12 -","2","0.5","","Zi-Yi Chen; Dennis Y. S. Tam; Thomas C. W. Mak","Ethynide-stabilized high-nuclearity silver(I) sulfido molecular clusters assembled using organic sulfide precursors","Chem.Commun.","2016","52","","6119","","","","","0.71073","MoKα","","0.1054","0.0845","","","0.2325","0.248","","","","","","1.019","","","","has coordinates,has disorder","183989","2020-10-21","18:00:00",""
"7119048","11.2444","0.0003","26.1267","0.0005","20.6154","0.0004","90","","94.991","0.001","90","","6033.4","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","complex 3","","- C62.5 H75 Cl3 F5 N5 O W -","- C62.5 H75 Cl3 F5 N5 O W -","- C250 H300 Cl12 F20 N20 O4 W4 -","4","1","","Dominik A. Imbrich; Wolfgang Frey; Stefan Naumann; Michael R. Buchmeiser","Application of imidazolinium salts and N-heterocyclic olefins for the synthesis of anionic and neutral tungsten imido alkylidene complexes","Chem.Commun.","2016","52","","6099","","","","","0.71073","MoKα","","0.04","0.0271","","","0.0545","0.0571","","","","","","1.024","","","","has coordinates,has disorder","183990","2020-10-21","18:00:00",""
"7119049","11.7112","0.0007","20.3641","0.0013","21.9201","0.0014","103.305","0.003","97.459","0.002","100.855","0.003","4913.7","0.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","complex 6","","- C40.5 H58 Cl F6 N5 O6 S2 W -","- C40.5 H58 Cl F6 N5 O6 S2 W -","- C162 H232 Cl4 F24 N20 O24 S8 W4 -","4","2","","Dominik A. Imbrich; Wolfgang Frey; Stefan Naumann; Michael R. Buchmeiser","Application of imidazolinium salts and N-heterocyclic olefins for the synthesis of anionic and neutral tungsten imido alkylidene complexes","Chem.Commun.","2016","52","","6099","","","","","0.71073","MoKα","","0.0419","0.0276","","","0.0598","0.0633","","","","","","1.052","","","","has coordinates","183990","2020-10-21","18:00:00",""
"7119050","10.5591","0.0003","13.627","0.0005","21.2326","0.0007","86.879","0.002","81.476","0.002","88.576","0.002","3016.47","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","complex 4","","- C55 H76 Cl2 N4 W -","- C55 H76 Cl2 N4 W -","- C110 H152 Cl4 N8 W2 -","2","1","","Dominik A. Imbrich; Wolfgang Frey; Stefan Naumann; Michael R. Buchmeiser","Application of imidazolinium salts and N-heterocyclic olefins for the synthesis of anionic and neutral tungsten imido alkylidene complexes","Chem.Commun.","2016","52","","6099","","","","","0.71073","MoKα","","0.0404","0.0297","","","0.0532","0.055","","","","","","1.041","","","","has coordinates","183990","2020-10-21","18:00:00",""
"7119051","21.6865","0.0019","18.8737","0.0016","16.1005","0.0013","90","","106.667","0.003","90","","6313.1","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","complex 2","","- C58.5 H79 Cl8 N5 W -","- C58.5 H79 Cl8 N5 W -","- C234 H316 Cl32 N20 W4 -","4","1","","Dominik A. Imbrich; Wolfgang Frey; Stefan Naumann; Michael R. Buchmeiser","Application of imidazolinium salts and N-heterocyclic olefins for the synthesis of anionic and neutral tungsten imido alkylidene complexes","Chem.Commun.","2016","52","","6099","","","","","0.71073","MoKα","","0.08","0.0566","","","0.1458","0.1608","","","","","","1.064","","","","has coordinates","183990","2020-10-21","18:00:00",""
"7119052","16.634","0.002","18.391","0.003","18.849","0.003","88.309","0.013","76.986","0.006","82.645","0.011","5571.9","1.4","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","","","- C124 H90 F40 N12 -","- C124 H90 F40 N12 -","- C248 H180 F80 N24 -","2","1","","Won-Young Cha; Takanori Soya; Takayuki Tanaka; Hirotaka Mori; Yongseok Hong; Sangsu Lee; Kyu Hyung Park; Atsuhiro Osuka; Dongho Kim","Multifaceted [36]octaphyrin(1.1.1.1.1.1.1.1): deprotonation-induced switching among nonaromatic, Mobius aromatic, and Huckel antiaromatic species","Chem.Commun.","2016","52","","6076","","","","","1.54187","CuKα","","0.085","0.0501","","","0.1105","0.1238","","","","","","1.068","","","","has coordinates,has disorder","183991","2020-10-21","18:00:00",""
"7119053","16.1117","0.0013","26.6027","0.0013","21.6003","0.0014","90","","100.029","0.006","90","","9116.7","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C182 H256 N2 O16 P8 Ru4 -","- C182 H256 N2 O16 P8 Ru4 -","- C364 H512 N4 O32 P16 Ru8 -","2","0.5","","Daniel Fink; Bernhard Weibert; Rainer F. Winter","Redox-active tetraruthenium metallacycles: reversible release of up to eight electrons resulting in strong electrochromism","Chem.Commun.","2016","52","","6103","","","","","0.71073","MoKα","","0.1305","0.097","","","0.2465","0.2634","","","","","","1.067","","","","has coordinates","183992","2020-10-21","18:00:00",""
"7119054","11.6168","0.0019","16.816","0.002","23.594","0.004","94.41","0.012","99.289","0.012","107.587","0.012","4297.1","1.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C148 H234 Cl16 N2 O16 P8 Ru4 -","- C148 H234 Cl16 N2 O16 P8 Ru4 -","- C148 H234 Cl16 N2 O16 P8 Ru4 -","1","0.5","","Daniel Fink; Bernhard Weibert; Rainer F. Winter","Redox-active tetraruthenium metallacycles: reversible release of up to eight electrons resulting in strong electrochromism","Chem.Commun.","2016","52","","6103","","","","","0.71073","MoKα","","0.1538","0.0951","","","0.2303","0.2646","","","","","","0.981","","","","has coordinates","204124","2020-10-21","18:00:00",""
"7119055","10.3736","0.0003","13.2432","0.0004","13.7718","0.0004","99.178","0.002","107.636","0.001","97.263","0.002","1748.99","0.09","100","","100","","","","","","","","","6","P 1","P 1","1","","","","- C72 H64 Cl4 N2 P2 Ru2 -","- C72 H64 Cl4 N2 P2 Ru2 -","- C72 H64 Cl4 N2 P2 Ru2 -","1","1","","Demyan E. Prokopchuk; Alan J. Lough; Rafael E. Rodriguez-Lugo; Robert H. Morris; Hansjorg Grutzmacher","Insights into metal-ligand hydrogen transfer: a square-planar ruthenate complex supported by a tetradentate amino-amido-diolefin ligand","Chem.Commun.","2016","52","","6138","","","","","0.71073","MoKα","","0.057","0.0456","","","0.1028","0.1089","","","","","","1.021","","","","has coordinates,has disorder","204124","2020-10-21","18:00:00",""
"7119056","9.121","0.002","15.475","0.003","21.72","0.005","90","","92.615","0.005","90","","3062.5","1.1","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H42 N2 O Ru -","- C40 H42 N2 O Ru -","- C160 H168 N8 O4 Ru4 -","4","1","","Demyan E. Prokopchuk; Alan J. Lough; Rafael E. Rodriguez-Lugo; Robert H. Morris; Hansjorg Grutzmacher","Insights into metal-ligand hydrogen transfer: a square-planar ruthenate complex supported by a tetradentate amino-amido-diolefin ligand","Chem.Commun.","2016","52","","6138","","","","","0.71073","MoKα","","0.1213","0.0558","","","0.0926","0.1146","","","","","","0.985","","","","has coordinates","204124","2020-10-21","18:00:00",""
"7119057","11.8733","0.0006","24.8708","0.0012","17.2324","0.0009","90","","95.965","0.002","90","","5061.1","0.4","147","2","147","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H73 K N2 O8 Ru -","- C56 H73 K N2 O8 Ru -","- C224 H292 K4 N8 O32 Ru4 -","4","1","","Demyan E. Prokopchuk; Alan J. Lough; Rafael E. Rodriguez-Lugo; Robert H. Morris; Hansjorg Grutzmacher","Insights into metal-ligand hydrogen transfer: a square-planar ruthenate complex supported by a tetradentate amino-amido-diolefin ligand","Chem.Commun.","2016","52","","6138","","","","","0.71073","MoKα","","0.0992","0.0544","","","0.1057","0.1245","","","","","","1.051","","","","has coordinates,has disorder","183993","2020-10-21","18:00:00",""
"7119058","12.919","0.002","15.875","0.003","17.332","0.003","90","","90","","90","","3554.6","1.1","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3aS,3'R,4S,6R,6aS)-Tri-tert-butyl 4-(2-bromophenyl)-1,2',3-trioxo-3a,4,6,6a-tetrahydro -1H-spiro[cyclopenta[c]pyrrole-5,3'-indoline]-1',2,6(3H)-tricarboxylate","","- C35 H39 Br N2 O9 -","- C35 H39 Br N2 O9 -","- C140 H156 Br4 N8 O36 -","4","1","","Bo-Liang Zhao; Da-Ming Du","Organocatalytic cascade Michael/Michael reaction for the asymmetric synthesis of spirooxindoles containing five contiguous stereocenters","Chem.Commun.","2016","52","","6162","","","","","0.71073","MoKα","","0.0559","0.0434","","","0.0524","0.0559","","","","","","0.998","","","","has coordinates","183994","2020-10-21","18:00:00",""
"7119059","11.6454","0.0007","12.5993","0.0006","21.7275","0.0014","90","","104.608","0.002","90","","3084.9","0.3","150","2","150","2","","","","","","","synthesized by the authors","6","P 1 21 1","P 2yb","4","","","","- C30 H27.5 F6 N2.5 O6 S2 -","- C30 H27.5 F6 N2.5 O6 S2 -","- C120 H110 F24 N10 O24 S8 -","4","2","","Jaroslav Sebestik; Filip Teply; Ivana Cisarova; Jan Vavra; Dusan Koval; Petr Bour","Intense chirality induction in nitrile solvents by a helquat dye monitored by near resonance Raman scattering","Chem.Commun.","2016","52","","6257","","","","","0.71073","MoKα","","0.051","0.0401","","","0.1025","0.1102","","","","","","1.018","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7119060","7.9386","0.0002","17.6476","0.0004","19.6814","0.0004","90","","90","","90","","2757.31","0.11","150","2","150","2","","","","","","","synthesized by the authors","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H29 I2 N3 O2 -","- C28 H29 I2 N3 O2 -","- C112 H116 I8 N12 O8 -","4","1","","Jaroslav Sebestik; Filip Teply; Ivana Cisarova; Jan Vavra; Dusan Koval; Petr Bour","Intense chirality induction in nitrile solvents by a helquat dye monitored by near resonance Raman scattering","Chem.Commun.","2016","52","","6257","","","","","0.71073","MoKα","","0.0199","0.0181","","","0.0417","0.0425","","","","","","1.039","","","","has coordinates","184013","2020-10-21","18:00:00",""
"7119061","20.8179","0.0009","19.5864","0.001","24.4923","0.0013","90","","90","","90","","9986.7","0.9","","","","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C41 H38 Dy F9 N14 O9 S3 -","- C41 H38 Dy F9 N14 O9 S3 -","- C328 H304 Dy8 F72 N112 O72 S24 -","8","1","","Zhong-Xia Jiang; Jun-Liang Liu; Yan-Cong Chen; Jiang Liu; Jian-Hua Jia; Ming-Liang Tong","Lanthanoid single-ion magnets with the LnN10 coordination geometry","Chem.Commun.","2016","52","","6261","","","","","","","","0.129","","","","","","","","","","","","","","","has coordinates","191065","2020-10-21","18:00:00",""
"7119062","20.69","0.0004","19.5456","0.0005","24.427","0.0005","90","","90","","90","","9878.2","0.4","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C41 H38 Er F9 N14 O9 S3 -","- C41 H38 Er F9 N14 O9 S3 -","- C328 H304 Er8 F72 N112 O72 S24 -","8","1","","Zhong-Xia Jiang; Jun-Liang Liu; Yan-Cong Chen; Jiang Liu; Jian-Hua Jia; Ming-Liang Tong","Lanthanoid single-ion magnets with the LnN10 coordination geometry","Chem.Commun.","2016","52","","6261","","","","","0.71073","MoKα","","0.0586","0.0475","","","0.1133","0.12","","","","","","1.038","","","","has coordinates","184029","2020-10-21","18:00:00",""
"7119064","11.1272","0.0003","13.525","0.0004","13.4866","0.0004","90","","104.147","0.003","90","","1968.11","0.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 Cl4 Cu4 N2 P2 -","- C40 H40 Cl4 Cu4 N2 P2 -","- C80 H80 Cl8 Cu8 N4 P4 -","2","0.5","","Xu-Lin Chen; Rongmin Yu; Xiao-Yuan Wu; Dong Liang; Ji-Hui Jia; Can-Zhong Lu","A strongly greenish-blue-emitting Cu4Cl4 cluster with an efficient spin-orbit coupling (SOC): fast phosphorescence versus thermally activated delayed fluorescence","Chem.Commun.","2016","52","","6288","","","","","0.71073","MoKα","","0.0525","0.0451","","","0.1291","0.1369","","","","","","1.078","","","","has coordinates","184109","2020-10-21","18:00:00",""
"7119065","9.4353","0.0013","17.316","0.002","11.6428","0.0017","90","","92.321","0.003","90","","1900.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H18 N2 O3 S -","- C22 H18 N2 O3 S -","- C88 H72 N8 O12 S4 -","4","1","","Ming Chen; Ning Sun; Haoyi Chen; Yuanhong Liu","Dioxazoles, a new mild nitrene transfer reagent in gold catalysis: highly efficient synthesis of functionalized oxazoles","Chem.Commun.","2016","52","","6324","","","","","0.71073","MoKα","","0.0614","0.0465","","","0.1159","0.1255","","","","","","1.038","","","","has coordinates","184110","2020-10-21","18:00:00",""
"7119066","18.929","0.009","12.43","0.006","8.472","0.004","90","","91.235","0.013","90","","1992.9","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 N2 O3 S2 -","- C23 H18 N2 O3 S2 -","- C92 H72 N8 O12 S8 -","4","1","","Ming Chen; Ning Sun; Haoyi Chen; Yuanhong Liu","Dioxazoles, a new mild nitrene transfer reagent in gold catalysis: highly efficient synthesis of functionalized oxazoles","Chem.Commun.","2016","52","","6324","","","","","0.71073","MoKα","","0.0911","0.0529","","","0.1062","0.1218","","","","","","0.995","","","","has coordinates","184110","2020-10-21","18:00:00",""
"7119067","11.4418","0.0008","11.4418","0.0008","23.88","0.003","90","","90","","120","","2707.4","0.4","293","2","293","2","","","","","","","","7","P 32 2 1","P 32 2""","154","","","","- C29 H36 Au F6 N3 O4 S2 -","- C29 H36 Au F6 N3 O4 S2 -","- C87 H108 Au3 F18 N9 O12 S6 -","3","0.5","","Ming Chen; Ning Sun; Haoyi Chen; Yuanhong Liu","Dioxazoles, a new mild nitrene transfer reagent in gold catalysis: highly efficient synthesis of functionalized oxazoles","Chem.Commun.","2016","52","","6324","","","","","0.71073","MoKα","","0.0313","0.028","","","0.061","0.062","","","","","","1.006","","","","has coordinates","184110","2020-10-21","18:00:00",""
"7119068","12.2213","0.0006","16.2437","0.0009","22.0973","0.0012","97.7","0.003","93.029","0.003","106.714","0.002","4144.2","0.4","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C94.45 H106.45 N6 P2 -","- C62 H74 N6 P2 -","- C124 H148 N12 P4 -","2","1","","Alexander Hinz; Axel Schulz; Alexander Villinger","On the behaviour of biradicaloid [P(mu-NTer)]2 towards Lewis acids and bases","Chem.Commun.","2016","52","","6328","","","","","0.71073","MoKα","","0.0817","0.0526","","","0.133","0.1424","","","","","","0.958","","","","has coordinates,has disorder","184111","2020-10-21","18:00:00",""
"7119069","10.94","0.0009","11.9932","0.0014","21.421","0.003","87.907","0.002","76.158","0.002","65.57","0.002","2478.4","0.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C56.95 H58.95 Au Cl N2 P2 -","- C56.9634 H58.9634 Au Cl N2 P2 -","- C113.927 H117.927 Au2 Cl2 N4 P4 -","2","1","","Alexander Hinz; Axel Schulz; Alexander Villinger","On the behaviour of biradicaloid [P(mu-NTer)]2 towards Lewis acids and bases","Chem.Commun.","2016","52","","6328","","","","","0.71073","MoKα","","0.0563","0.0356","","","0.0656","0.0715","","","","","","1.023","","","","has coordinates,has disorder","184111","2020-10-21","18:00:00",""
"7119070","11.168","0.005","12.029","0.005","18.686","0.005","94.538","0.005","94.411","0.005","114.833","0.005","2254.1","1.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H53 Au1.33 Cl1.33 N2 P2 -","- C51 H53 Au1.332 Cl1.332 N2 P2 -","- C102 H106 Au2.664 Cl2.664 N4 P4 -","2","1","","Alexander Hinz; Axel Schulz; Alexander Villinger","On the behaviour of biradicaloid [P(mu-NTer)]2 towards Lewis acids and bases","Chem.Commun.","2016","52","","6328","","","","","0.71073","MoKα","","0.0522","0.0434","","","0.1011","0.1034","","","","","","1.327","","","","has coordinates,has disorder","184111","2020-10-21","18:00:00",""
"7119071","11.243","0.0007","12.0524","0.0007","18.7795","0.0011","94.113","0.003","94.288","0.003","114.879","0.003","2287.1","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H53 Au1.44 Cl1.44 N2 P2 -","- C51 H53 Au1.4413 Cl1.4413 N2 P2 -","- C102 H106 Au2.8826 Cl2.8826 N4 P4 -","2","1","","Alexander Hinz; Axel Schulz; Alexander Villinger","On the behaviour of biradicaloid [P(mu-NTer)]2 towards Lewis acids and bases","Chem.Commun.","2016","52","","6328","","","","","0.71073","MoKα","","0.0765","0.0498","","","0.0861","0.0932","","","","","","1.095","","","","has coordinates","184111","2020-10-21","18:00:00",""
"7119072","9.7639","0.0011","19.413","0.002","10.4751","0.0012","90","","105.633","0.001","90","","1912.1","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H14 F N O4 -","- C25 H14 F N O4 -","- C100 H56 F4 N4 O16 -","4","1","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.0522","0.0414","","","0.1027","0.1107","","","","","","1.031","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119073","11.2312","0.0012","16.239","0.002","22.524","0.002","90","","90","","90","","4108","0.8","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H17 N O5 -","- C26 H17 N O5 -","- C208 H136 N8 O40 -","8","2","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.1101","0.0501","","","0.0828","0.0967","","","","","","1.014","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119074","10.033","0.004","19.091","0.008","10.544","0.005","90","","107.453","0.011","90","","1926.6","1.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H13 F2 N O4 -","- C25 H13 F2 N O4 -","- C100 H52 F8 N4 O16 -","4","1","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.1723","0.0605","","","0.1167","0.1387","","","","","","0.917","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119075","9.9815","0.0012","10.7217","0.0012","10.8522","0.0013","66.536","0.003","86.529","0.004","76.874","0.003","1036.9","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H13 Cl F N O4 -","- C25 H13 Cl F N O4 -","- C50 H26 Cl2 F2 N2 O8 -","2","1","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.0936","0.0658","","","0.16","0.1765","","","","","","1.053","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119076","11.727","0.006","12.81","0.006","12.935","0.006","103.837","0.013","115.433","0.012","91.903","0.014","1683.3","1.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H12 F N O5 -","- C20 H12 F N O5 -","- C80 H48 F4 N4 O20 -","4","2","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.2987","0.0904","","","0.1861","0.232","","","","","","0.848","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119077","22.142","0.002","15.2704","0.0016","12.2599","0.0017","90","","115.973","0.004","90","","3726.6","0.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 Cl N O5 -","- C21 H14 Cl N O5 -","- C168 H112 Cl8 N8 O40 -","8","1","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.0758","0.056","","","0.1484","0.1636","","","","","","1.036","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119078","12.8577","0.0007","14.7678","0.0008","16.2529","0.0008","90","","112.154","0.0018","90","","2858.3","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H21 N3 O5 -","- C30 H21 N3 O5 -","- C120 H84 N12 O20 -","4","1","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.1104","0.0659","","","0.1613","0.1825","","","","","","1.02","","","","has coordinates","184112","2020-10-21","18:00:00",""
"7119079","11.783","0.0018","13.245","0.002","15.8627","0.0018","90","","94.265","0.004","90","","2468.8","0.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H17 Cl N2 O5 -","- C25 H17 Cl N2 O5 -","- C100 H68 Cl4 N8 O20 -","4","1","","Rong-Guo Shi; Xiao-Hua Wang; Ruzhang Liu; Chao-Guo Yan","Two-carbon ring expansion of isatin: a convenient construction of a dibenzo[b,d]azepinone scaffold","Chem.Commun.","2016","52","","6280","","","","","0.71073","MoKα","","0.0621","0.0473","","","0.1283","0.1341","","","","","","1.065","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7119080","15.9209","0.0001","19.4144","0.0002","16.2447","0.0002","90","","103.631","0.001","90","","4879.72","0.09","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H39 Cl Cu N -","- C27 H39 Cl Cu N -","- C216 H312 Cl8 Cu8 N8 -","8","2","","Alexander S. Romanov; Dawei Di; Le Yang; Julio Fernandez-Cestau; Ciaran R. Becker; Charlotte E. James; Bonan Zhu; Mikko Linnolahti; Dan Credgington; Manfred Bochmann","Highly photoluminescent copper carbene complexes based on prompt rather than delayed fluorescence","Chem.Commun.","2016","52","","6379","","","","","0.71073","MoKα","","0.0447","0.0334","","","0.0786","0.0838","","","","","","0.994","","","","has coordinates","184113","2020-10-21","18:00:00",""
"7119081","11.1918","0.0002","11.9685","0.0002","20.7901","0.0004","101.52","0.002","94.798","0.001","94.419","0.001","2706.59","0.09","140","2","140","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H40 Cl Cu I N -","- C27.5 H40 Cl Cu I N -","- C110 H160 Cl4 Cu4 I4 N4 -","4","2","","Alexander S. Romanov; Dawei Di; Le Yang; Julio Fernandez-Cestau; Ciaran R. Becker; Charlotte E. James; Bonan Zhu; Mikko Linnolahti; Dan Credgington; Manfred Bochmann","Highly photoluminescent copper carbene complexes based on prompt rather than delayed fluorescence","Chem.Commun.","2016","52","","6379","","","","","0.71073","MoKα","","0.0289","0.0222","","","0.055","0.0574","","","","","","1.004","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7119082","16.0878","0.0002","19.4137","0.0003","16.2912","0.0003","90","","103.54","0.002","90","","4946.71","0.14","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H39 Br Cu N -","- C27 H39 Br Cu N -","- C216 H312 Br8 Cu8 N8 -","8","2","","Alexander S. Romanov; Dawei Di; Le Yang; Julio Fernandez-Cestau; Ciaran R. Becker; Charlotte E. James; Bonan Zhu; Mikko Linnolahti; Dan Credgington; Manfred Bochmann","Highly photoluminescent copper carbene complexes based on prompt rather than delayed fluorescence","Chem.Commun.","2016","52","","6379","","","","","0.71073","MoKα","","0.0643","0.0512","","","0.1479","0.1574","","","","","","1.034","","","","has coordinates","184113","2020-10-21","18:00:00",""
"7119083","13.4447","0.0004","19.4178","0.0011","9.8391","0.0006","90","","91.496","0.001","90","","2567.8","0.2","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","hg01_48_LT","","","- C18 H14 Fe -","- C18 H14 Fe -","- C144 H112 Fe8 -","8","2","","Antonio Urbano; Gloria Hernandez-Torres; Ana M. del Hoyo; Alicia Martinez-Carrion; M. Carmen Carreno","Mild access to planar-chiral ortho-condensed aromatic ferrocenes via gold(I)-catalyzed cycloisomerization of ortho-alkynylaryl ferrocenes","Chem.Commun.","2016","52","","6419","","","","","0.71073","","","0.0469","0.0308","","","0.0699","0.0777","","","","","","1.034","","","","has coordinates","184114","2020-10-21","18:00:00",""
"7119084","7.8273","0.0013","7.8273","0.0013","47.227","0.009","90","","90","","90","","2893.4","0.9","200","2","200","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","hg_m-OMe_R1140_LT","","","- C19 H16 Fe O -","- C19 H16 Fe O -","- C152 H128 Fe8 O8 -","8","1","","Antonio Urbano; Gloria Hernandez-Torres; Ana M. del Hoyo; Alicia Martinez-Carrion; M. Carmen Carreno","Mild access to planar-chiral ortho-condensed aromatic ferrocenes via gold(I)-catalyzed cycloisomerization of ortho-alkynylaryl ferrocenes","Chem.Commun.","2016","52","","6419","","","","","0.71073","","","0.1172","0.0751","","","0.1647","0.1839","","","","","","1.031","","","","has coordinates","184114","2020-10-21","18:00:00",""
"7119085","13.2706","0.0007","15.2693","0.0009","16.3133","0.0009","101.437","0.0012","110.526","0.0011","102.271","0.0012","2887.5","0.3","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C122 H74 B2 F48 Pd4 -","- C122 H74 B2 F48 Pd4 -","- C122 H74 B2 F48 Pd4 -","1","0.5","","Kohei Masai; Katsunori Shirato; Koji Yamamoto; Yuki Kurashige; Tetsuro Murahashi","A mechanistic insight into metal-cluster pi-envelopment: a dual binding mode involving bent and planar ligand-conformers","Chem.Commun.","2016","52","","6427","","","","","0.71075","MoKα","","","0.0723","","","","0.1887","","","","","","1.152","","","","has coordinates","184117","2020-10-21","18:00:00",""
"7119086","14.2381","0.0006","15.6226","0.0007","28.2509","0.0012","81.3277","0.0009","79.8346","0.0009","77.6849","0.001","6001.1","0.4","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C128 H78 B2 Cl2 F48 Pd4 -","- C128 H78 B2 Cl2 F48 Pd4 -","- C256 H156 B4 Cl4 F96 Pd8 -","2","1","","Kohei Masai; Katsunori Shirato; Koji Yamamoto; Yuki Kurashige; Tetsuro Murahashi","A mechanistic insight into metal-cluster pi-envelopment: a dual binding mode involving bent and planar ligand-conformers","Chem.Commun.","2016","52","","6427","","","","","0.71075","MoKα","","","0.0818","","","","0.2773","","","","","","0.952","","","","has coordinates","184117","2020-10-21","18:00:00",""
"7119087","18.5114","0.0007","21.0181","0.0007","19.5326","0.0007","90","","111.452","0.0009","90","","7073.2","0.4","123","","123","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C153 H106 B2 Cl2 F48 Pd4 -","- C153 H106 B2 Cl2 F48 Pd4 -","- C306 H212 B4 Cl4 F96 Pd8 -","2","1","","Kohei Masai; Katsunori Shirato; Koji Yamamoto; Yuki Kurashige; Tetsuro Murahashi","A mechanistic insight into metal-cluster pi-envelopment: a dual binding mode involving bent and planar ligand-conformers","Chem.Commun.","2016","52","","6427","","","","","0.71075","MoKα","","0.0678","0.0538","","","0.1411","0.1572","","","","","","1.05","","","","has coordinates","184117","2020-10-21","18:00:00",""
"7119088","10.394","0.0002","16.6422","0.0003","15.389","0.0002","90","","108.771","0.0008","90","","2520.39","0.08","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","5a in manuscript","","","- C27 H21 Au B Cl F4 N P -","- C27 H21 Au1.0227 B Cl F4 N P -","- C108 H84 Au4.0908 B4 Cl4 F16 N4 P4 -","4","1","","Long Huang; Frank Rominger; Matthias Rudolph; A. Stephen K. Hashmi","A general access to organogold(III) complexes by oxidative addition of diazonium salts","Chem.Commun.","2016","52","","6435","","","","","0.71073","MoKα","","0.0382","0.0266","","","0.0607","0.0651","","","","","","1.041","","","","has coordinates,has disorder","184118","2020-10-21","18:00:00",""
"7119089","9.3558","0.0001","11.4552","0.0002","13.9422","0.0002","86.4666","0.0008","70.5144","0.0007","67.9291","0.0007","1301.94","0.03","200","2","200","2","","","","","","","","8","P -1","-P 1","2","5d in manuscript","","","- C27 H20 Au B Cl2 F4 N P -","- C27 H20 Au B Cl2 F4 N P -","- C54 H40 Au2 B2 Cl4 F8 N2 P2 -","2","1","","Long Huang; Frank Rominger; Matthias Rudolph; A. Stephen K. Hashmi","A general access to organogold(III) complexes by oxidative addition of diazonium salts","Chem.Commun.","2016","52","","6435","","","","","0.71073","MoKα","","0.0297","0.0246","","","0.0515","0.0529","","","","","","1.03","","","","has coordinates,has disorder","184118","2020-10-21","18:00:00",""
"7119090","12.1272","0.0004","14.5748","0.0005","18.6371","0.0005","90","","96.632","0.003","90","","3272.09","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","7c in manuscript","","","- C26.5 H38.5 Au Cl6.5 F3 P -","- C26.5 H38.5 Au Cl6.5 F3 P -","- C106 H154 Au4 Cl26 F12 P4 -","4","1","","Long Huang; Frank Rominger; Matthias Rudolph; A. Stephen K. Hashmi","A general access to organogold(III) complexes by oxidative addition of diazonium salts","Chem.Commun.","2016","52","","6435","","","","","1.54178","CuKα","","0.0687","0.051","","","0.1312","0.1434","","","","","","1.122","","","","has coordinates,has disorder","184118","2020-10-21","18:00:00",""
"7119091","7.6257","0.0003","25.7293","0.001","10.2076","0.0006","90","","92.279","0.004","90","","2001.19","0.16","119.99","0.14","119.99","0.14","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Compound 1","","- C12 H28.5 B10 Br N2.5 -","- C12 H28.5 B10 Br N2.5 -","- C48 H114 B40 Br4 N10 -","4","1","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","x-ray","0.71073","MoKα","","0.0575","0.0422","","","0.0911","0.0969","","","","","","1.053","","","","has coordinates,has disorder","184125","2020-10-21","18:00:00",""
"7119092","15.6541","0.0015","13.7503","0.0014","18.375","0.0018","90","","115.101","0.005","90","","3581.7","0.6","150","2","150.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H27 B9 N2 -","- C11 H27 B9 N2 -","- C88 H216 B72 N16 -","8","2","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","","0.71073","MoKα","","0.0605","0.0462","","","0.1191","0.1306","","","","","","1.026","","","","has coordinates","184125","2020-10-21","18:00:00",""
"7119093","11.9249","0.0005","23.7834","0.0011","25.2349","0.0011","90","","90","","90","","7157","0.5","120","0.11","120","0.11","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H55 B9 N4 Rh2 -","- C31 H55 B9 N4 Rh2 -","- C248 H440 B72 N32 Rh16 -","8","1","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","","0.71073","MoKα","","0.0741","0.0505","","","0.0905","0.0997","","","","","","1.041","","","","has coordinates","184125","2020-10-21","18:00:00",""
"7119094","11.1781","0.0005","12.5631","0.0005","14.8258","0.0007","111.322","0.004","92.917","0.004","105.326","0.004","1845.32","0.16","120.01","0.11","120.01","0.11","","","","","","","","6","P -1","-P 1","2","","","","- C32 H58 B9 N3 O Rh2 -","- C32 H58 B9 N3 O Rh2 -","- C64 H116 B18 N6 O2 Rh4 -","2","1","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","x-ray","0.71073","MoKα","","0.049","0.0387","","","0.0791","0.0855","","","","","","1.037","","","","has coordinates","184125","2020-10-21","18:00:00",""
"7119095","10.7898","0.0006","11.4212","0.0012","14.8764","0.0014","71.73","0.009","83.274","0.006","69.415","0.008","1629.6","0.3","120.01","0.1","120.01","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C29 H54 B9 N2 O0.5 Rh2 -","- C29 H54 B9 N2 O0.5 Rh2 -","- C58 H108 B18 N4 O Rh4 -","2","1","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","","0.71073","MoKα","","0.0761","0.0512","","","0.1055","0.1177","","","","","","1.038","","","","has coordinates,has disorder","184125","2020-10-21","18:00:00",""
"7119096","12.3894","0.0004","15.3629","0.0005","13.6908","0.0004","90","","93.441","0.003","90","","2601.17","0.14","290.87","0.1","290.87","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H38 B10 Cl N2 Rh -","- C19 H38 B10 Cl N2 Rh -","- C76 H152 B40 Cl4 N8 Rh4 -","4","1","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","x-ray","0.71073","MoKα","","0.0811","0.0537","","","0.1173","0.1305","","","","","","1.048","","","","has coordinates","184125","2020-10-21","18:00:00",""
"7119097","17.2832","0.0005","10.5283","0.0002","14.1775","0.0004","90","","113.02","0.003","90","","2374.34","0.12","119.99","0.1","119.99","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H37 B10 N2 Rh -","- C19 H37 B10 N2 Rh -","- C76 H148 B40 N8 Rh4 -","4","1","","Jordan Holmes; Christopher M. Pask; Mark A. Fox; Charlotte E. Willans","Tethered N-heterocyclic carbene-carboranes: unique ligands that exhibit unprecedented and versatile coordination modes at rhodium","Chem.Commun.","2016","52","","6443","","","","x-ray","0.71073","MoKα","","0.0565","0.0443","","","0.1013","0.1155","","","","","","1.097","","","","has coordinates","184125","2020-10-21","18:00:00",""
"7119098","5.8458","0.0003","12.3784","0.0006","16.7657","0.0012","90","","98.058","0.006","90","","1201.22","0.12","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(2S,3S)-3,7-dimethyl-2-(5-methyl-2-oxohexyl)-3- ((E)-6-methyl-3-oxohept-1-en-1-yl)-3,4-dihydronaphthalen-1(2H)-one","","- C27 H38 O3 -","- C27 H38 O3 -","- C54 H76 O6 -","2","1","","Qiqiao Lin; Yuanzhen Li; Deb Kumar Das; Guoxiang Zhang; Zhifei Zhao; Shuang Yang; Xinqiang Fang","N-Heterocyclic carbene-catalyzed desymmetrization of functionalized 1,4-dienes via Stetter Reaction","Chem.Commun.","2016","52","","6459","","","","","1.54184","CuKα","","0.0457","0.0422","","","0.1127","0.1185","","","","","","1.045","","","","has coordinates","184126","2020-10-21","18:00:00",""
"7119099","34.4885","0.0002","34.4885","0.0002","34.4885","0.0002","90","","90","","90","","41022.6","0.4","293","2","293","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- C384 H288 Cu4.8 N288 Zn43.2 -","- C384 H288 Cu4.8 N288 Zn43.2 -","- C768 H576 Cu9.6 N576 Zn86.4 -","2","0.0208333","","Xiao-Wei Zhu; Xiao-Ping Zhou; Dan Li","Exceptionally water stable heterometallic gyroidal MOFs: tuning the porosity and hydrophobicity by doping metal ions","Chem.Commun.","2016","52","","6513","","10.1039/C6CC02116F","","","1.54178","CuKα","","0.1111","0.0602","","","0.1592","0.1865","","","","","","0.928","","","","has coordinates,has disorder","192148","2020-10-21","18:00:00",""
"7119102","11.8267","0.0006","13.4665","0.0007","18.3608","0.0009","106.876","0.003","92.299","0.003","109.501","0.003","2607.2","0.2","372","2","372","2","","","","","","","","4","P -1","-P 1","2","monomer of PIM-C1","","","- C47 H82 O5 Si4 -","- C47 H82 O5 Si4 -","- C94 H164 O10 Si8 -","2","1","","Jian Zhang; Hong Kang; Jacob Martin; Shouhai Zhang; Sylvie Thomas; Tim C. Merkel; Jianyong Jin","The enhancement of chain rigidity and gas transport performance of polymers of intrinsic microporosity via intramolecular locking of the spiro-carbon","Chem.Commun.","2016","52","","6553","","","","","0.71073","MoKα","","0.0795","0.0522","","","0.1279","0.144","","","","","","1.052","","","","has coordinates","184192","2020-10-21","18:00:00",""
"7119103","6.67202","0.00007","12.80551","0.00014","18.3291","0.0002","90","","90","","90","","1566.01","0.03","223","0.1","223","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 O3 -","- C16 H28 O3 -","- C64 H112 O12 -","4","1","","Yajun Ren; Marc Presset; Jeremy Godemert; Nicolas Vanthuyne; Jean-Valere Naubron; Michel Giorgi; Jean Rodriguez; Yoann Coquerel","A switchable dual organocatalytic system and the enantioselective total synthesis of the quadrane sesquiterpene suberosanone","Chem.Commun.","2016","52","","6565","","","","x-ray","1.54184","CuKα","","0.0345","0.0338","","","0.0889","0.0899","","","","","","1.031","","","","has coordinates","184193","2020-10-21","18:00:00",""
"7119114","9.3925","0.0008","9.5682","0.0009","10.9216","0.001","73.528","0.008","66.26","0.009","85.458","0.007","860.9","0.15","289","2","289","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H16 F3 N O4 S -","- C17 H16 F3 N O4 S -","- C34 H32 F6 N2 O8 S2 -","2","1","","Zhi-Wei Yang; Qi Zhang; Yuan-Ye Jiang; Lei Li; Bin Xiao; Yao Fu","Palladium-catalyzed directing group-assisted C8-triflation of naphthalenes","Chem.Commun.","2016","52","","6709","","","","","0.71073","MoKα","","0.0819","0.0562","","","0.1306","0.1518","","","","","","1.036","","","","has coordinates","185751","2020-10-21","18:00:00",""
"7119115","10.7989","0.0009","23.324","0.002","18.592","0.0016","90","","106.381","0.007","90","","4492.7","0.7","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H68 O3 S Sm2 -","- C45 H68 O3 S Sm2 -","- C180 H272 O12 S4 Sm8 -","4","1","","Christoph Schoo; Svetlana V. Klementyeva; Michael T. Gamer; Sergey N. Konchenko; Peter W. Roesky","Samarocene oxide: from an undesired decomposition product to a new reagent","Chem.Commun.","2016","52","","6654","","","","","0.71073","MoKα","","0.0707","0.0528","","","0.1436","0.1579","","","","","","1.041","","","","has coordinates,has disorder","185752","2020-10-21","18:00:00",""
"7119116","18.588","0.004","23.602","0.005","21.654","0.004","90","","107.26","0.03","90","","9072","4","195","2","195.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H68 O2 S2 Sm2 -","- C45 H68 O2 S2 Sm2 -","- C360 H544 O16 S16 Sm16 -","8","2","","Christoph Schoo; Svetlana V. Klementyeva; Michael T. Gamer; Sergey N. Konchenko; Peter W. Roesky","Samarocene oxide: from an undesired decomposition product to a new reagent","Chem.Commun.","2016","52","","6654","","","","","0.71073","MoKα","","0.1015","0.0334","","","0.0573","0.0639","","","","","","0.704","","","","has coordinates,has disorder","185752","2020-10-21","18:00:00",""
"7119117","17.824","0.004","16.299","0.003","16.056","0.003","90","","108.56","0.03","90","","4421.9","1.7","195","","195","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H68 O4 S Sm2 -","- C44 H68 O4 S Sm2 -","- C176 H272 O16 S4 Sm8 -","4","1","","Christoph Schoo; Svetlana V. Klementyeva; Michael T. Gamer; Sergey N. Konchenko; Peter W. Roesky","Samarocene oxide: from an undesired decomposition product to a new reagent","Chem.Commun.","2016","52","","6654","","","","","0.71073","MoKα","","0.1092","0.0471","","","0.0809","0.0914","","","","","","0.731","","","","has coordinates,has disorder","185752","2020-10-21","18:00:00",""
"7119118","16.952","0.003","13.879","0.003","20.819","0.004","90","","90.81","0.03","90","","4897.7","1.7","210","2","210","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H70 N2 O4 S Sm2 -","- C50 H70 N2 O4 S Sm2 -","- C200 H280 N8 O16 S4 Sm8 -","4","1","","Christoph Schoo; Svetlana V. Klementyeva; Michael T. Gamer; Sergey N. Konchenko; Peter W. Roesky","Samarocene oxide: from an undesired decomposition product to a new reagent","Chem.Commun.","2016","52","","6654","","","","","0.71073","MoKα","","0.0989","0.0472","","","0.0745","0.0823","","","","","","0.84","","","","has coordinates","185752","2020-10-21","18:00:00",""
"7119119","10.561","0.002","10.7","0.002","15.035","0.003","110.25","0.03","97.77","0.03","98.73","0.03","1542.9","0.7","200","2","200","","","","","","","","","4","P -1","-P 1","2","","","","- C68 H86 O4 Sm2 -","- C68 H86 O4 Sm2 -","- C68 H86 O4 Sm2 -","1","0.5","","Christoph Schoo; Svetlana V. Klementyeva; Michael T. Gamer; Sergey N. Konchenko; Peter W. Roesky","Samarocene oxide: from an undesired decomposition product to a new reagent","Chem.Commun.","2016","52","","6654","","","","","0.71073","MoKα","","0.0411","0.0325","","","0.0793","0.0812","","","","","","0.985","","","","has coordinates,has disorder","185752","2020-10-21","18:00:00",""
"7119120","16.207","0.003","14","0.003","21.465","0.004","90","","90","","90","","4870.4","1.7","210","2","205","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C44 H66 N2 O8 Re2 Sm2 -","- C44 H66 N2 O8 Re2 Sm2 -","- C176 H264 N8 O32 Re8 Sm8 -","4","0.5","","Christoph Schoo; Svetlana V. Klementyeva; Michael T. Gamer; Sergey N. Konchenko; Peter W. Roesky","Samarocene oxide: from an undesired decomposition product to a new reagent","Chem.Commun.","2016","52","","6654","","","","","0.71073","MoKα","","0.0436","0.0265","","","0.0481","0.0509","","","","","","0.927","","","","has coordinates","185752","2020-10-21","18:00:00",""
"7119121","9.7747","0.0005","11.2285","0.0005","12.079","0.0006","86.4386","0.0015","70.8147","0.0014","85.0255","0.0014","1246.59","0.11","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Pentaphenyl-1,2-oxaborine","","","- C34 H25 B O -","- C34 H25 B O -","- C68 H50 B2 O2 -","2","1","","Sam Yruegas; Dayna C. Patterson; Caleb D. Martin","Oxygen insertion into boroles as a route to 1,2-oxaborines","Chem.Commun.","2016","52","","6658","","","","","0.71073","MoKα","","0.0846","0.047","","","0.1039","0.119","","","","","","1.014","","","","has coordinates","185753","2020-10-21","18:00:00",""
"7119122","10.5923","0.0005","11.7946","0.0007","12.5909","0.0007","91.8608","0.0017","94.7506","0.0015","113.478","0.0015","1434.13","0.14","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Biphenyl-1,2-oxaborine","","","- C40 H29 B O -","- C40 H29 B O -","- C80 H58 B2 O2 -","2","1","","Sam Yruegas; Dayna C. Patterson; Caleb D. Martin","Oxygen insertion into boroles as a route to 1,2-oxaborines","Chem.Commun.","2016","52","","6658","","","","","0.71073","MoKα","","0.0679","0.0434","","","0.1101","0.1281","","","","","","1.064","","","","has coordinates","185753","2020-10-21","18:00:00",""
"7119123","9.5347","0.0005","10.4694","0.0006","15.6057","0.0009","92.938","0.005","107.085","0.005","116.622","0.006","1300.34","0.16","120","","120","","","","","","","","","6","P -1","-P 1","2","Furosemide","","","- C12 H11 Cl N2 O5 S -","- C12 H11 Cl N2 O5 S -","- C48 H44 Cl4 N8 O20 S4 -","4","2","","Cory M. Widdifield; Harry Robson; Paul Hodgkinson","Furosemide's one little hydrogen atom: NMR crystallography structure verification of powdered molecular organics","Chem.Commun.","2016","52","","6685","","","","x-ray","0.71073","MoKα","","0.1193","0.0561","","","0.0935","0.1209","","","","","","0.994","","","","has coordinates","185754","2020-10-21","18:00:00",""
"7119124","15.6295","0.0014","11.7772","0.001","23.646","0.002","90","","100.375","0.001","90","","4281.4","0.6","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","naphthalene bridged phenoxyl-imidazolyl radical complex","","- C31 H20 N2 O -","- C31 H20 N2 O -","- C248 H160 N16 O8 -","8","2","","Katsuya Mutoh; Yoichi Kobayashi; Yasukazu Hirao; Takashi Kubo; Jiro Abe","Stealth fast photoswitching of negative photochromic naphthalene-bridged phenoxyl-imidazolyl radical complexes","Chem.Commun.","2016","52","","6797","","","","","0.71073","MoKα","","0.0475","0.0369","","","0.0874","0.0932","","","","","","0.989","","","","has coordinates","185772","2020-10-21","18:00:00",""
"7119125","10.417","0.003","7.846","0.003","15.614","0.005","90","","109.024","0.004","90","","1206.5","0.7","90","","90","","","","","","","","","4","P 1 21 1","P 2yb","4","","naphthalene bridged naphthoxyl-imidazolyl radical complex","","- C35 H22 N2 O -","- C35 H22 N2 O -","- C70 H44 N4 O2 -","2","1","","Katsuya Mutoh; Yoichi Kobayashi; Yasukazu Hirao; Takashi Kubo; Jiro Abe","Stealth fast photoswitching of negative photochromic naphthalene-bridged phenoxyl-imidazolyl radical complexes","Chem.Commun.","2016","52","","6797","","","","","0.71073","MoKα","","0.0371","0.0323","","","0.0705","0.0728","","","","","","1.029","","","","has coordinates","185772","2020-10-21","18:00:00",""
"7119126","10.4123","0.0013","10.6141","0.0013","22.372","0.003","90","","101.14","0.0017","90","","2425.9","0.5","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","by-product 1","","- C31 H20 N2 O3 -","- C31 H20 N2 O3 -","- C124 H80 N8 O12 -","4","1","","Katsuya Mutoh; Yoichi Kobayashi; Yasukazu Hirao; Takashi Kubo; Jiro Abe","Stealth fast photoswitching of negative photochromic naphthalene-bridged phenoxyl-imidazolyl radical complexes","Chem.Commun.","2016","52","","6797","","","","","0.71073","MoKα","","0.0454","0.0341","","","0.0748","0.08","","","","","","0.997","","","","has coordinates","185772","2020-10-21","18:00:00",""
"7119127","15.6018","0.0016","11.8059","0.0012","23.666","0.002","90","","100.492","0.0012","90","","4286.2","0.7","90","","90","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","by-product 2","","- C31 H19.46 Cl0.08 N2 O -","- C31 H19.4583 Cl0.0835 N2 O -","- C248 H155.666 Cl0.668 N16 O8 -","8","2","","Katsuya Mutoh; Yoichi Kobayashi; Yasukazu Hirao; Takashi Kubo; Jiro Abe","Stealth fast photoswitching of negative photochromic naphthalene-bridged phenoxyl-imidazolyl radical complexes","Chem.Commun.","2016","52","","6797","","","","","0.71073","MoKα","","0.0577","0.0415","","","0.101","0.1098","","","","","","1.068","","","","has coordinates,has disorder","185772","2020-10-21","18:00:00",""
"7119128","10.284","0.0003","26.1213","0.0007","15.8601","0.0004","90","","102.69","0.001","90","","4156.4","0.2","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-benzyl-4-methyl-N-(4-methyl-1-oxo-1H-isochromen-3-yl)benzenesulfonamide","","- C24 H21 N O4 S -","- C24 H21 N O4 S -","- C192 H168 N8 O32 S8 -","8","2","","Hongxu Liu; Yanyan Yang; Jie Wu; Xiao-Na Wang; Junbiao Chang","Regioselective synthesis of 3,4-disubstituted isocoumarins through the Pd-catalyzed annulation of 2-iodoaromatic acids with ynamides","Chem.Commun.","2016","52","","6801","","","","","1.54178","CuKα","","0.0406","0.0345","","","0.0887","0.0924","","","","","","1.032","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7119129","12.2963","0.0004","13.8393","0.0004","16.8203","0.0004","71.704","0.001","82.18","0.001","66.12","0.001","2484.87","0.13","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","N-benzyl-4-methyl-N-(1-oxo-4-(p-tolyl)-1H-isochromen-3-yl)benzenesulfonamide","","- C30 H25 N O4 S -","- C30 H25 N O4 S -","- C120 H100 N4 O16 S4 -","4","2","","Hongxu Liu; Yanyan Yang; Jie Wu; Xiao-Na Wang; Junbiao Chang","Regioselective synthesis of 3,4-disubstituted isocoumarins through the Pd-catalyzed annulation of 2-iodoaromatic acids with ynamides","Chem.Commun.","2016","52","","6801","","","","","0.71073","MoKα","","0.0847","0.055","","","0.1404","0.1665","","","","","","1.068","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7119130","9.8924","0.0002","19.0871","0.0005","19.8273","0.0004","90","","100.618","0.001","90","","3679.63","0.14","200","1","200","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Cl4 P2 Pd -","- C40 H32 Cl4 P2 Pd -","- C160 H128 Cl16 P8 Pd4 -","4","1","","Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank","Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis","Chem.Commun.","2016","52","","6785","","","","","1.54178","CuKα","","0.0271","0.0263","","","0.0682","0.0688","","","","","","1.032","","","","has coordinates","185774","2020-10-21","18:00:00",""
"7119131","9.9582","0.0003","21.3845","0.0007","10.1108","0.0003","90","","103.135","0.002","90","","2096.78","0.11","200","1","200","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C41 H32 Cl8 P2 Pt -","- C41 H32 Cl8 P2 Pt -","- C82 H64 Cl16 P4 Pt2 -","2","1","","Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank","Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis","Chem.Commun.","2016","52","","6785","","","","","1.54178","CuKα","","0.0184","0.0183","","","0.0464","0.0466","","","","","","1.032","","","","has coordinates","185774","2020-10-21","18:00:00",""
"7119132","12.7889","0.0005","16.392","0.0006","19.0982","0.0007","93.515","0.003","96.512","0.003","112.335","0.003","3655.6","0.3","200","1","200","1","","","","","","","","6","P -1","-P 1","2","","","","- C82 H68 Au2 Cl4 O P4 -","- C82 H68 Au2 Cl4 O P4 -","- C164 H136 Au4 Cl8 O2 P8 -","2","1","","Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank","Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis","Chem.Commun.","2016","52","","6785","","","","","1.54178","CuKα","","0.0818","0.0603","","","0.1429","0.161","","","","","","1.132","","","","has coordinates,has disorder","185774","2020-10-21","18:00:00",""
"7119133","12.6409","0.0003","16.973","0.0004","18.0808","0.0005","90","","104.661","0.001","90","","3753","0.16","200","1","200","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H32 Au2 Cl4 P2 -","- C40 H32 Au2 Cl4 P2 -","- C160 H128 Au8 Cl16 P8 -","4","1","","Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank","Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis","Chem.Commun.","2016","52","","6785","","","","","0.71073","MoKα","","0.0248","0.0191","","","0.0439","0.0462","","","","","","1.083","","","","has coordinates","185774","2020-10-21","18:00:00",""
"7119134","34.8","0.002","9.8414","0.0006","10.8355","0.0007","90","","96.507","0.003","90","","3687","0.4","200","1","200","1","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C39.5 H31 Au2 Cl3 P2 -","- C39.5 H30.9999 Au2 Cl3.00005 P2 -","- C158 H124 Au8 Cl12.0002 P8 -","4","1","","Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank","Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis","Chem.Commun.","2016","52","","6785","","","","","1.54178","CuKα","","0.0184","0.0179","","","0.0445","0.0447","","","","","","1.032","","","","has coordinates","185774","2020-10-21","18:00:00",""
"7119135","34.8079","0.0011","9.8397","0.0003","10.8227","0.0004","90","","96.441","0.002","90","","3683.4","0.2","200","1","200","1","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C39.5 H31 Au2 Cl3 P2 -","- C39.5 H30.9999 Au2 Cl3.00005 P2 -","- C158 H124 Au8 Cl12.0002 P8 -","4","1","","Avassaya Vanitcha; Cecilia Damelincourt; Geoffrey Gontard; Nicolas Vanthuyne; Virginie Mouries-Mansuy; Louis Fensterbank","Bis-phosphine allene ligand: coordination chemistry and preliminary applications in catalysis","Chem.Commun.","2016","52","","6785","","","","","1.54178","CuKα","","0.0142","0.0141","","","0.0359","0.0359","","","","","","1.069","","","","has coordinates","185774","2020-10-21","18:00:00",""
"7119136","8.7871","0.001","9.5833","0.0011","13.1959","0.0013","104.353","0.004","93.696","0.004","116.282","0.004","945.63","0.19","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C38 H62 Li4 N2 O4 -","- C38 H62 Li4 N2 O4 -","- C38 H62 Li4 N2 O4 -","1","0.5","","Quentin Dufrois; Laure Vendier; Michel Etienne","alpha-CC agostic structures and aggregation diversity in cyclopropyllithium derivatives","Chem.Commun.","2016","52","","6781","","","","","0.71073","MoKα","","0.0491","0.0415","","","0.1044","0.1101","","","","","","1.028","","","","has coordinates","185775","2020-10-21","18:00:00",""
"7119137","8.5802","0.0005","9.438","0.0005","20.2265","0.0011","80.998","0.002","82.494","0.002","70.198","0.002","1516.79","0.15","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C33 H49 Li2 O3 -","- C33 H49 Li2 O3 -","- C66 H98 Li4 O6 -","2","1","","Quentin Dufrois; Laure Vendier; Michel Etienne","alpha-CC agostic structures and aggregation diversity in cyclopropyllithium derivatives","Chem.Commun.","2016","52","","6781","","","","","0.71073","MoKα","","0.0731","0.0548","","","0.134","0.1433","","","","","","1.04","","","","has coordinates,has disorder","185775","2020-10-21","18:00:00",""
"7119138","17.8505","0.0005","8.3333","0.0002","13.1813","0.0003","90","","104.671","0.001","90","","1896.84","0.08","93","2","93","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","3PyMeBF3Ph_open","Open-ring isomer of a diarylethene","","- C39 H32 B2 F12 N2 S2 -","- C39 H32 B2 F12 N2 S2 -","- C78 H64 B4 F24 N4 S4 -","2","0.5","","Kazuki Takase; Kengo Hyodo; Masakazu Morimoto; Yuko Kojima; Hiroyuki Mayama; Satoshi Yokojima; Shinichiro Nakamura; Kingo Uchida","Photoinduced reversible formation of a superhydrophilic surface by crystal growth of diarylethene","Chem.Commun.","2016","52","","6885","","","","","1.54178","","","0.0815","0.0799","","","0.2034","0.2049","","","","","","1.064","","","","has coordinates,has disorder","185776","2020-10-21","18:00:00",""
"7119139","9.7143","0.0002","32.9243","0.0007","11.9342","0.0003","90","","96.4166","0.001","90","","3793.08","0.15","93","2","93","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","3PyMeBF3Ph_closed","The closed-ring isomer of a diarylethene","","- C39 H34 B2 F12 N2 O S2 -","- C39 H34 B2 F12 N2 O S2 -","- C156 H136 B8 F48 N8 O4 S8 -","4","1","","Kazuki Takase; Kengo Hyodo; Masakazu Morimoto; Yuko Kojima; Hiroyuki Mayama; Satoshi Yokojima; Shinichiro Nakamura; Kingo Uchida","Photoinduced reversible formation of a superhydrophilic surface by crystal growth of diarylethene","Chem.Commun.","2016","52","","6885","","","","","1.54178","","","0.0349","0.0338","","","0.0891","0.09","","","","","","1.069","","","","has coordinates,has disorder","185776","2020-10-21","18:00:00",""
"7119140","8.6053","0.001","11.6403","0.0014","17.468","0.002","90","","90","","90","","1749.7","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C80 H92 N4 O12 -","4","1","","Yuan-Ming Sun; Peng Gu; Yu-Ning Gao; Qin Xu; Min Shi","Gold(I) catalyzed tandem cyclization of propargylic esters to 4-acyloxy-1,2-dihydroquinolines","Chem.Commun.","2016","52","","6942","","","","","0.71073","MoKα","","0.0418","0.0385","","","0.1014","0.1043","","","","","","1.01","","","","has coordinates","185777","2020-10-21","18:00:00",""
"7119141","7.0929","0.0002","15.6774","0.0004","20.8647","0.0005","90","","90","","90","","2320.12","0.1","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C21 H29 F6 Ir N O P -","- C21 H29 F6 Ir N O P -","- C84 H116 F24 Ir4 N4 O4 P4 -","4","1","","Ross A. Arthurs; Peter N. Horton; Simon J. Coles; Christopher J. Richards","Metallocene to metallocene conversion. Synthesis of an oxazoline-substituted pentamethyliridocenium cation from a ferrocenyloxazoline","Chem.Commun.","2016","52","","7024","","","","","0.71073","MoKα","","0.0333","0.0281","","","0.059","0.0606","","","","","","1.03","","","","has coordinates,has disorder","185778","2020-10-21","18:00:00",""
"7119142","4.375","0.0002","20.1126","0.0013","13.1678","0.0008","90","","98.317","0.006","90","","1146.48","0.12","141","50","141","50","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1f","","- C14 H8 F2 N4 -","- C14 H8 F2 N4 -","- C56 H32 F8 N16 -","4","1","","Erchang Shang; Junzhi Zhang; Jinyi Bai; Zhan Wang; Xiang Li; Bing Zhu; Xiaoguang Lei","Syntheses of [1,2,4]triazolo[1,5-a]benzazoles enabled by the transition-metal-free oxidative N-N bond formation","Chem.Commun.","2016","52","","7028","","","","","0.71073","MoKα","","0.0708","0.046","","","0.1037","0.1153","","","","","","1.046","","","","has coordinates","185779","2020-10-21","18:00:00",""
"7119143","21.401","0.002","4.7059","0.0005","10.6453","0.001","90","","90","","90","","1072.1","0.18","179.99","0.1","179.99","0.1","","","","","","","","4","P c a 21","P 2c -2ac","29","","4i","","- C14 H9 N3 O -","- C14 H9 N3 O -","- C56 H36 N12 O4 -","4","1","","Erchang Shang; Junzhi Zhang; Jinyi Bai; Zhan Wang; Xiang Li; Bing Zhu; Xiaoguang Lei","Syntheses of [1,2,4]triazolo[1,5-a]benzazoles enabled by the transition-metal-free oxidative N-N bond formation","Chem.Commun.","2016","52","","7028","","","","","0.71073","MoKα","","0.0505","0.0424","","","0.1037","0.1112","","","","","","1.126","","","","has coordinates","185779","2020-10-21","18:00:00",""
"7119144","5.9753","0.0006","15.9285","0.0017","13.447","0.0013","90","","90.062","0.011","90","","1279.9","0.2","180","0.1","180","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4a","","- C16 H14 N4 -","- C16 H14 N4 -","- C64 H56 N16 -","4","1","","Erchang Shang; Junzhi Zhang; Jinyi Bai; Zhan Wang; Xiang Li; Bing Zhu; Xiaoguang Lei","Syntheses of [1,2,4]triazolo[1,5-a]benzazoles enabled by the transition-metal-free oxidative N-N bond formation","Chem.Commun.","2016","52","","7028","","","","","0.71073","MoKα","","0.0848","0.0502","","","0.11","0.1324","","","","","","1.085","","","","has coordinates","185779","2020-10-21","18:00:00",""
"7119145","10.9506","0.0003","19.9969","0.0006","17.6775","0.0006","90","","96.054","0.001","90","","3849.4","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ALMX57","","","- C38 H42 F10 P2 Pt Zn -","- C38 H42 F10 P2 Pt Zn -","- C152 H168 F40 P8 Pt4 Zn4 -","4","1","","Allegra L. Liberman-Martin; Daniel S. Levine; Micah S. Ziegler; Robert G. Bergman; T. Don Tilley","Lewis acid-base interactions between platinum(II) diaryl complexes and bis(perfluorophenyl)zinc: strongly accelerated reductive elimination induced by a Z-type ligand","Chem.Commun.","2016","52","","7039","","","","","0.71073","MoKα","","0.0315","0.0252","","","0.056","0.0622","","","","","","1.206","","","","has coordinates,has disorder","185780","2020-10-21","18:00:00",""
"7119146","12.995","0.0013","16.7483","0.0016","21.185","0.002","90","","106.136","0.002","90","","4429.1","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","ALMX88","","","- C51 H42 F10 N2 Pt Zn -","- C51 H42 F10 N2 Pt Zn -","- C204 H168 F40 N8 Pt4 Zn4 -","4","1","","Allegra L. Liberman-Martin; Daniel S. Levine; Micah S. Ziegler; Robert G. Bergman; T. Don Tilley","Lewis acid-base interactions between platinum(II) diaryl complexes and bis(perfluorophenyl)zinc: strongly accelerated reductive elimination induced by a Z-type ligand","Chem.Commun.","2016","52","","7039","","","","","0.71073","MoKα","","0.0355","0.0312","","","0.0722","0.0747","","","","","","1.156","","","","has coordinates","185780","2020-10-21","18:00:00",""
"7119147","14.436","0.008","9.801","0.003","28.668","0.011","90","","100.42","0.03","90","","3989","3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C56 H40 B -","- C56 H40 B -","- C224 H160 B4 -","4","1","","Holger Braunschweig; Ivo Krummenacher; Lisa Mailander; Leanne Pentecost; Alfredo Vargas","Formation of a stable radical by oxidation of a tetraorganoborate","Chem.Commun.","2016","52","","7005","","","","","0.71073","MoKα","","0.1292","0.0902","","","0.1885","0.2068","","","","","","1.144","","","","has coordinates","185781","2020-10-21","18:00:00",""
"7119148","6.6058","0.0001","24.886","0.0004","14.6272","0.0003","90","","102.224","0.007","90","","2350.08","0.09","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C40.17 H62.43 Na2 O28 -","- C40.168 H62.42 Na2 O28 -","- C80.336 H124.84 Na4 O56 -","2","1","","Guo-Hong Ning; Kazuki Matsumura; Yasuhide Inokuma; Makoto Fujita","A saccharide-based crystalline sponge for hydrophilic guests","Chem.Commun.","2016","52","","7013","","","","","1.54187","CuKα","","0.053","0.0506","","","0.1387","0.1456","","","","","","1.053","","","","has coordinates,has disorder","185782","2020-10-21","18:00:00",""
"7119149","6.6503","0.0015","24.44","0.006","14.717","0.003","90","","101.39","0.002","90","","2344.9","0.9","93","2","93","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H34 Na O13.5 -","- C21 H34 Na O13.5 -","- C84 H136 Na4 O54 -","4","2","","Guo-Hong Ning; Kazuki Matsumura; Yasuhide Inokuma; Makoto Fujita","A saccharide-based crystalline sponge for hydrophilic guests","Chem.Commun.","2016","52","","7013","","","","","0.71073","MoKα","","0.0479","0.0387","","","0.087","0.0912","","","","","","1.022","","","","has coordinates","287753","2023-11-23","09:34:44",""
"7119150","6.6481","0.0005","24.625","0.002","14.756","0.0012","90","","102.798","0.0009","90","","2355.7","0.3","93","2","93","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20.45 H30.90 Na O14.46 -","- C20.454 H30.908 Na O14.461 -","- C81.816 H123.632 Na4 O57.844 -","4","2","","Guo-Hong Ning; Kazuki Matsumura; Yasuhide Inokuma; Makoto Fujita","A saccharide-based crystalline sponge for hydrophilic guests","Chem.Commun.","2016","52","","7013","","","","","0.71073","MoKα","","0.0454","0.0436","","","0.1149","0.116","","","","","","1.096","","","","has coordinates,has disorder","287753","2023-11-23","09:34:45",""
"7119151","6.6239","0.0005","24.772","0.0017","14.6783","0.001","90","","102.43","0.0015","90","","2352.1","0.3","93","2","93","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20.29 H30.59 Na O14 -","- C20.2965 H30.593 Na O14 -","- C81.186 H122.372 Na4 O56 -","4","2","","Guo-Hong Ning; Kazuki Matsumura; Yasuhide Inokuma; Makoto Fujita","A saccharide-based crystalline sponge for hydrophilic guests","Chem.Commun.","2016","52","","7013","","","","","0.71073","MoKα","","0.0674","0.0645","","","0.1633","0.1648","","","","","","1.17","","","","has coordinates,has disorder","287753","2023-11-23","09:34:45",""
"7119152","7.195","0.007","7.195","0.007","4.118","0.004","90","","90","","90","","213.2","0.4","240","2","240","2","","","","","","","","3","P 42/m n m","-P 4n 2n","136","α-Diemthylcadmium","α-Diemthylcadmium","","- C2 H6 Cd -","- C2 H6 Cd -","- C4 H12 Cd2 -","2","0.125","","Hanke, Felix; Hindley, Sarah; Jones, Anthony C.; Steiner, Alexander","The solid state structures of the high and low temperature phases of dimethylcadmium","Chemical Communications","2016","52","66","10144","","10.1039/C6CC05851E","","","0.71073","MoKα","","0.0392","0.0257","","","0.0614","0.0702","","","","","","0.985","","","","has coordinates","185827","2020-10-21","18:00:00",""
"7119153","7.483","0.011","7.711","0.011","7.734","0.011","90","","115.85","0.03","90","","401.6","1","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Dimethylcadmium","Dimethylcadmium","","- C2 H6 Cd -","- C2 H6 Cd -","- C8 H24 Cd4 -","4","1","","Hanke, Felix; Hindley, Sarah; Jones, Anthony C.; Steiner, Alexander","The solid state structures of the high and low temperature phases of dimethylcadmium","Chemical Communications","2016","52","66","10144","","10.1039/C6CC05851E","","","0.71073","MoKα","","0.0866","0.0721","","","0.1884","0.1986","","","","","","1.07","","","","has coordinates","185828","2020-10-21","18:00:00",""
"7119160","12.554","0.002","8.8499","0.0015","12.6253","0.0017","90","","103.988","0.005","90","","1361.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","piracetam gallic acid","","- C13 H16 N2 O7 -","- C13 H16 N2 O7 -","- C52 H64 N8 O28 -","4","1","","Lynne H. Thomas; Craig Wales; Chick C. Wilson","Selective preparation of elusive and alternative single component polymorphic solid forms through multi-component crystallisation routes","Chem.Commun.","2016","52","","7372","","","","","0.71075","MoKα","","0.1209","0.0562","","","0.1176","0.1633","","","","","","1.056","","","","has coordinates","186020","2020-10-21","18:00:00",""
"7119161","3.6803","0.0003","27.724","0.0019","9.3579","0.0007","90","","94.397","0.003","90","","952","0.12","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Gallic acid monohydrate","","- C7 H8 O6 -","- C7 H6 O6 -","- C28 H24 O24 -","4","1","","Lynne H. Thomas; Craig Wales; Chick C. Wilson","Selective preparation of elusive and alternative single component polymorphic solid forms through multi-component crystallisation routes","Chem.Commun.","2016","52","","7372","","","","","0.71073","MoKα","","0.1327","0.0568","","","0.1474","0.1636","","","","","","0.907","","","","has coordinates","186020","2020-10-21","18:00:00",""
"7119162","7.8557","0.0003","10.1043","0.0004","10.4713","0.0005","80.602","0.002","68.952","0.002","69.742","0.002","727.01","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","piroxicam","","- C15 H13 N3 O4 S -","- C15 H13 N3 O4 S -","- C30 H26 N6 O8 S2 -","2","1","","Lynne H. Thomas; Craig Wales; Chick C. Wilson","Selective preparation of elusive and alternative single component polymorphic solid forms through multi-component crystallisation routes","Chem.Commun.","2016","52","","7372","","","","","0.71073","MoKα","","0.0678","0.0407","","","0.0919","0.1011","","","","","","0.968","","","","has coordinates","186020","2020-10-21","18:00:00",""
"7119163","12.6899","0.0009","14.6928","0.0009","20.5097","0.0016","84.866","0.002","74.669","0.003","84.683","0.002","3663.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","piroxicam","","- C15 H13 N3 O4 S -","- C15 H13 N3 O4 S -","- C150 H130 N30 O40 S10 -","10","5","","Lynne H. Thomas; Craig Wales; Chick C. Wilson","Selective preparation of elusive and alternative single component polymorphic solid forms through multi-component crystallisation routes","Chem.Commun.","2016","52","","7372","","","","","0.71075","MoKα","","0.1569","0.0809","","","0.2094","0.2819","","","","","","1.017","","","","has coordinates","186020","2020-10-21","18:00:00",""
"7119164","7.0374","0.0019","12.917","0.004","25.467","0.008","84.077","0.007","89.174","0.007","83.327","0.006","2287","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","piroxicam methanol solvate","","- C46 H43 N9 O13 S3 -","- C46 H43 N9 O13 S3 -","- C92 H86 N18 O26 S6 -","2","1","","Lynne H. Thomas; Craig Wales; Chick C. Wilson","Selective preparation of elusive and alternative single component polymorphic solid forms through multi-component crystallisation routes","Chem.Commun.","2016","52","","7372","","","","","0.71075","MoKα","","0.3371","0.2271","","","0.4776","0.5325","","","","","","1.44","","","","has coordinates","186020","2020-10-21","18:00:00",""
"7119165","9.0171","0.0005","11.0071","0.0006","23.9483","0.0013","90","","90","","90","","2376.9","0.2","123","","123","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Cyheptamiede Form-III","","- C16 H15 N O -","- C16 H15 N O -","- C128 H120 N8 O8 -","8","1","","Vijay K. Srirambhatla; Rui Guo; Sarah L. Price; Alastair J. Florence","Isomorphous template induced crystallisation: a robust method for the targeted crystallisation of computationally predicted metastable polymorphs","Chem.Commun.","2016","52","","7384","","","","","1.54178","CuKα","","0.0518","0.0441","","0.0556","0.0465","0.0445","","","","","","0.8911","","","","has coordinates","186021","2020-10-21","18:00:00",""
"7119166","15.113","0.003","7.708","0.0015","16.178","0.003","90","","94","0.03","90","","1880","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-TA-AN","","- C26 H16 S2 -","- C26 H16 S2 -","- C104 H64 S8 -","4","1","","Haichao Liu; Liang Yao; Bao Li; Xiankai Chen; Yu Gao; Shitong Zhang; Weijun Li; Ping Lu; Bing Yang; Yuguang Ma","Excimer-induced high-efficiency fluorescence due to pairwise anthracene stacking in a crystal with long lifetime","Chem.Commun.","2016","52","","7356","","","","","0.71073","MoKα","","0.0588","0.0429","","","0.1055","0.1135","","","","","","1.051","","","","has coordinates","186022","2020-10-21","18:00:00",""
"7119167","17.08","0.003","11.919","0.002","19.8","0.004","90","","104.04","0.03","90","","3910.4","1.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2-TA-AN","","- C26 H16 S2 -","- C26 H16 S2 -","- C208 H128 S16 -","8","1","","Haichao Liu; Liang Yao; Bao Li; Xiankai Chen; Yu Gao; Shitong Zhang; Weijun Li; Ping Lu; Bing Yang; Yuguang Ma","Excimer-induced high-efficiency fluorescence due to pairwise anthracene stacking in a crystal with long lifetime","Chem.Commun.","2016","52","","7356","","","","","0.71073","MoKα","","0.0557","0.0423","","","0.1191","0.1252","","","","","","1.032","","","","has coordinates","186022","2020-10-21","18:00:00",""
"7119168","10.9129","0.0004","7.8194","0.0003","22.428","0.0008","90","","97.304","0.002","90","","1898.3","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H23 N3 O4 -","- C22 H23 N3 O4 -","- C88 H92 N12 O16 -","4","1","","Haiyan Yu; Wang Ren; Hongguang Lu; Yanan Liang; Qiusheng Wang","Synthesis and piezochromic luminescence study of a coumarin hydrozone compound","Chem.Commun.","2016","52","","7387","","","","x-ray","0.71073","MoKα","","0.0431","0.0385","","","0.1031","0.1069","","","","","","1.024","","","","has coordinates","186023","2020-10-21","18:00:00",""
"7119169","12.37","0.003","12.834","0.004","18.49","0.005","98.783","0.018","91.487","0.006","104.872","0.007","2797.3","1.4","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H11 F26 N O2 -","- C21 H11 F26 N O2 -","- C84 H44 F104 N4 O8 -","4","2","","Yohei Haketa; Ryota Takasago; Hiromitsu Maeda","beta-Perfluoroalkyl-substituted pyrrole as an anion-responsive pi-electronic system through a single NH moiety","Chem.Commun.","2016","52","","7364","","","","","1.54187","CuKα","","0.0547","0.0505","","","0.1455","0.149","","","","","","1.059","","","","has coordinates,has disorder","192220","2020-10-21","18:00:00",""
"7119170","31.093","0.005","34.507","0.006","24.271","0.006","90","","128.646","0.004","90","","20339","7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C132 H108 Cd4 N20 O12 -","- C132 H108 Cd4 N20 O12 -","- C528 H432 Cd16 N80 O48 -","4","0.5","","Thirumurugan Prakasam; Rana A. Bilbeisi; Matteo Lusi; John-Carl Olsen; Carlos Platas-Iglesias; Ali Trabolsi","Post-synthetic modifications of cadmium-based knots and links","Chem.Commun.","2016","52","","7398","","","","","1.54178","CuKα","","0.4424","0.283","","","0.4981","0.5455","","","","","","1.447","","","","has coordinates","186025","2020-10-21","18:00:00",""
"7119171","12.5188","0.0005","15.3848","0.0007","42.5644","0.0017","90","","90","","90","","8197.9","0.6","100","2","100","2","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C70 H56 B Cd2 F4 N10 O8 -","- C70 H56 B Cd2 F4 N10 O8 -","- C280 H224 B4 Cd8 F16 N40 O32 -","4","0.25","","Thirumurugan Prakasam; Rana A. Bilbeisi; Matteo Lusi; John-Carl Olsen; Carlos Platas-Iglesias; Ali Trabolsi","Post-synthetic modifications of cadmium-based knots and links","Chem.Commun.","2016","52","","7398","","","","","1.54178","CuKα","","0.0792","0.0614","","","0.2078","0.2219","","","","","","1.449","","","","has coordinates,has disorder","186025","2020-10-21","18:00:00",""
"7119172","18.6042","0.0006","18.6042","0.0006","51.5285","0.0019","90","","90","","120","","15445.4","0.9","100","2","100","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","","","- C105 H69 Cd3 F9 N15 O24 Re3 -","- C105 H69 Cd3 F9 N15 O24 Re3 -","- C630 H414 Cd18 F54 N90 O144 Re18 -","6","0.333333","","Thirumurugan Prakasam; Rana A. Bilbeisi; Matteo Lusi; John-Carl Olsen; Carlos Platas-Iglesias; Ali Trabolsi","Post-synthetic modifications of cadmium-based knots and links","Chem.Commun.","2016","52","","7398","","","","","1.54178","CuKα","","0.0434","0.0409","","","0.1078","0.1131","","","","","","1.081","","","","has coordinates","186025","2020-10-21","18:00:00",""
"7119173","19.5965","0.0003","19.5965","0.0003","16.078","0.0003","90","","90","","90","","6174.32","0.18","173","2","173","2","","","","","","","","8","P 4/n :2","-P 4a","85","","","","- C64 H60 F3 N12 O52 P W12 Zn2 -","- C64 H60 F3 N12 O52 P W12 Zn2 -","- C128 H120 F6 N24 O104 P2 W24 Zn4 -","2","0.25","","Jian-Zhen Liao; Chen Wu; Xiao-Yuan Wu; Shui-Quan Deng; Can-Zhong Lu","Exceptional photosensitivity of a polyoxometalate-based charge-transfer hybrid material","Chem.Commun.","2016","52","","7394","","","","","1.54184","CuKα","","0.0442","0.034","","","0.0727","0.0765","","","","","","1.064","","","","has coordinates","186026","2020-10-21","18:00:00",""
"7119174","11.891","0.0009","16.2219","0.0012","15.2941","0.0011","90","","93.262","0.004","90","","2945.4","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C144 H128 O32 -","8","2","","Rajkumar Lalji Sahani; Rai-Shung Liu","Gold-catalyzed [4+3] and [4+4]-annulation reactions of t-butyl propiolate derivatives with epoxides and oxetanes for the construction of 1,4-dioxepane and 1,5-dioxocane cores","Chem.Commun.","2016","52","","7482","","","","","0.71073","MoKα","","0.0986","0.0489","","","0.1296","0.172","","","","","","0.99","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7119175","5.7294","0.0005","16.4971","0.0016","16.9275","0.0016","90","","96.391","0.002","90","","1590","0.3","302","2","302","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 O4 -","- C19 H18 O4 -","- C76 H72 O16 -","4","1","","Rajkumar Lalji Sahani; Rai-Shung Liu","Gold-catalyzed [4+3] and [4+4]-annulation reactions of t-butyl propiolate derivatives with epoxides and oxetanes for the construction of 1,4-dioxepane and 1,5-dioxocane cores","Chem.Commun.","2016","52","","7482","","","","","0.71073","MoKα","","0.0982","0.0471","","","0.1007","0.1197","","","","","","1.009","","","","has coordinates","186027","2020-10-21","18:00:00",""
"7119176","8.2011","0.0002","3.5207","0.0001","9.9129","0.0003","90","","110.987","0.002","90","","267.234","0.013","296.15","","296.15","","","","","","","","","4","P 1 2/m 1","-P 2y","10","","H4Mn2V9O14","","- Mn1.5 N O13 V4 -","- Mn1.5 N O13 V4 -","- Mn1.5 N O13 V4 -","1","0.25","","Martin K. Dufficy; Lan Luo; Peter S. Fedkiw; Paul A. Maggard","Vacancy-induced manganese vanadates and their potential application to Li-ion batteries","Chem.Commun.","2016","52","","7509","","","","","0.71073","MoKα","","0.0533","0.0362","","","0.0936","0.1019","","","","","","1.079","","","","has coordinates","186028","2020-10-21","18:00:00",""
"7119177","13.0691","0.0004","13.0691","0.0004","30.157","0.001","90","","90","","90","","5150.9","0.3","300","","300","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","potassium cobalt (II) citrate, UTSA-16","","- C12 H8 Co3 K O20 -","- C12 H8 Co3 K O20 -","- C96 H64 Co24 K8 O160 -","8","0.5","","Jack Binns; Konstantin V. Kamenev; Katie E. R. Marriott; Garry J. McIntyre; Stephen A. Moggach; Mark Murrie; Simon Parsons","A non-topological mechanism for negative linear compressibility","Chem.Commun.","2016","52","","7486","","","","","0.71073","MoKα","","0.0389","0.0352","","0.0961","0.0893","0.0893","","","","","","0.9014","","","","has coordinates","186029","2020-10-21","18:00:00",""
"7119178","13.0005","0.0005","13.0005","0.0005","30.2002","0.0011","90","","90","","90","","5104.2","0.3","293","","293","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","potassium cobalt (II) citrate, UTSA-16","","- C12 H8 Co3 K O18 -","- C12 H8 Co3 K O18 -","- C96 H64 Co24 K8 O144 -","8","0.5","","Jack Binns; Konstantin V. Kamenev; Katie E. R. Marriott; Garry J. McIntyre; Stephen A. Moggach; Mark Murrie; Simon Parsons","A non-topological mechanism for negative linear compressibility","Chem.Commun.","2016","52","","7486","","","","","0.71073","MoKα","","0.0866","0.0576","","0.3531","0.1485","0.1485","","","","","","0.9537","","","","has coordinates","186029","2020-10-21","18:00:00",""
"7119179","12.8201","0.0005","12.8201","0.0005","30.2685","0.0012","90","","90","","90","","4974.8","0.3","293","","293","","","","0.5","","","","","5","I -4 2 d","I -4 2bw","122","","potassium cobalt (II) citrate, UTSA-16","","- C12 H8 Co3 K O18 -","- C12 H8 Co3 K O18 -","- C96 H64 Co24 K8 O144 -","8","0.5","","Jack Binns; Konstantin V. Kamenev; Katie E. R. Marriott; Garry J. McIntyre; Stephen A. Moggach; Mark Murrie; Simon Parsons","A non-topological mechanism for negative linear compressibility","Chem.Commun.","2016","52","","7486","","","","","0.71073","MoKα","","0.091","0.0672","","0.2657","0.1806","0.169","","","","","","1.0214","","","","has coordinates","186029","2020-10-21","18:00:00",""
"7119180","12.6111","0.0005","12.6111","0.0005","30.2999","0.0011","90","","90","","90","","4818.9","0.3","293","","293","","","","1","","","","","5","I -4 2 d","I -4 2bw","122","","potassium cobalt (II) citrate, UTSA-16","","- C12 H8 Co3 K O18 -","- C12 H8 Co3 K O18 -","- C96 H64 Co24 K8 O144 -","8","0.5","","Jack Binns; Konstantin V. Kamenev; Katie E. R. Marriott; Garry J. McIntyre; Stephen A. Moggach; Mark Murrie; Simon Parsons","A non-topological mechanism for negative linear compressibility","Chem.Commun.","2016","52","","7486","","","","","0.71073","MoKα","","0.1068","0.0774","","0.2688","0.2027","0.1949","","","","","","1.0185","","","","has coordinates","186029","2020-10-21","18:00:00",""
"7119181","5.9638","0.0001","7.4011","0.0001","40.7678","0.0005","90","","90","","90","","1799.44","0.04","293","","293.15","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 O4 -","- C21 H20 O4 -","- C84 H80 O16 -","4","1","","Wei Zhou; Peng Chen; Mengna Tao; Xiao Su; Qingjie Zhao; Junliang Zhang","Enantioselective intermolecular cross Rauhut-Currier reactions of activated alkenes with acrolein","Chem.Commun.","2016","52","","7612","","","","","1.54178","CuKα","","0.0452","0.041","","","0.1187","0.1239","","","","","","1.044","","","","has coordinates","186030","2020-10-21","18:00:00",""
"7119182","8.966","0.0004","10.6824","0.0004","34.6972","0.0013","90","","90","","90","","3323.2","0.2","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C39 H38 N O P S -","- C39 H38 N O P S -","- C156 H152 N4 O4 P4 S4 -","4","1","","Wei Zhou; Peng Chen; Mengna Tao; Xiao Su; Qingjie Zhao; Junliang Zhang","Enantioselective intermolecular cross Rauhut-Currier reactions of activated alkenes with acrolein","Chem.Commun.","2016","52","","7612","","","","","0.71073","MoKα","","0.074","0.0486","","","0.106","0.1201","","","","","","1.016","","","","has coordinates","186030","2020-10-21","18:00:00",""
"7119183","12.7414","0.0005","7.5452","0.0003","15.8499","0.0007","90","","104.524","0.003","90","","1475.06","0.11","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 B Fe O2 -","- C16 H21 B Fe O2 -","- C64 H84 B4 Fe4 O8 -","4","1","","Anis Tlili; Arnaud Voituriez; Angela Marinetti; Pierre Thuery; Thibault Cantat","Synergistic effects in ambiphilic phosphino-borane catalysts for the hydroboration of CO2","Chem.Commun.","2016","52","","7553","","","","","0.71073","MoKα","","0.0432","0.0297","","","0.0787","0.0823","","","","","","1.073","","","","has coordinates","186031","2020-10-21","18:00:00",""
"7119350","6.1067","0.0002","13.7465","0.0004","12.4167","0.0003","90","","96.024","0.001","90","","1036.57","0.05","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 Cl8 N10 O8 -","- C6 Cl8 N10 O8 -","- C12 Cl16 N20 O16 -","2","0.5","","Srinivas, Dharavath; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.","From FOX-7 to H-FOX to insensitive energetic materials with hypergolic properties","Chemical Communications","2016","52","49","7668","7671","10.1039/c6cc02669a","","","0.71073","MoKα","","0.0328","0.0274","","","0.0757","0.0804","","","","","","1.023","","","","has coordinates","209429","2020-10-21","18:00:00",""
"7119351","10.3037","0.0003","9.6323","0.0003","14.3934","0.0004","90","","107.927","0.001","90","","1359.17","0.07","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H2 Cl2 N10 O8 -","- C4 H2 Cl2 N10 O8 -","- C16 H8 Cl8 N40 O32 -","4","1","","Srinivas, Dharavath; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.","From FOX-7 to H-FOX to insensitive energetic materials with hypergolic properties","Chemical Communications","2016","52","49","7668","7671","10.1039/c6cc02669a","","","0.71073","MoKα","","0.0451","0.0329","","","0.0966","0.1058","","","","","","1.013","","","","has coordinates","209429","2020-10-21","18:00:00",""
"7119352","12.88","0.03","13.13","0.04","15.88","0.04","99.38","0.02","90.29","0.03","101.76","0.06","2592","12","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","2d","","- C47 H43 Ag3 F6 N12 O7 S2 -","- C47 H43 Ag3 F6 N12 O7 S2 -","- C94 H86 Ag6 F12 N24 O14 S4 -","2","1","","Hui; Guo; Xin; He; Chong-Qing; Wan; Liang; Zhao","A stepwise bulk-to-cluster-to-particle transformation toward the efficient synthesis of alkynyl-protected silver nanoclusters","Chem.Commun.","2016","52","","7723","","","","","0.71073","MoKα","","0.0629","0.045","","","0.1079","0.1179","","","","","","1.033","","","","has coordinates","189982","2020-10-21","18:00:00",""
"7119353","11.882","0.003","6.1817","0.0015","15.84","0.004","90","","108.485","0.004","90","","1103.4","0.5","203","2","203","2","","","","","","","","4","P 1 21 1","P 2yb","4","","S8a","","- C24 H27 Br O5 -","- C24 H27 Br O5 -","- C48 H54 Br2 O10 -","2","1","","Liangliang; Song; Lei; Gong; Eric; Meggers","Asymmetric dual catalysis via fragmentation of a single rhodium precursor complex","Chem.Commun.","2016","52","","7699","","","","","0.71073","MoKα","","0.0367","0.0331","","","0.086","0.0871","","","","","","1.013","","","","has coordinates","189983","2020-10-21","18:00:00",""
"7119354","12.6831","0.0005","13.3648","0.0005","25.5629","0.0009","90","","90","","90","","4333.1","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Rh-SC-1","","- C43 H44 N3 O5 Rh -","- C43 H44 N3 O5 Rh -","- C172 H176 N12 O20 Rh4 -","4","1","","Liangliang; Song; Lei; Gong; Eric; Meggers","Asymmetric dual catalysis via fragmentation of a single rhodium precursor complex","Chem.Commun.","2016","52","","7699","","","","","0.71073","MoKα","","0.0888","0.0792","","","0.2105","0.2191","","","","","","1.001","","","","has coordinates","189983","2020-10-21","18:00:00",""
"7119355","6.202","","12.159","","30.276","","90","","90","","90","","2283.12","","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","comound 6a'","","- C24 H27 Br O5 -","- C24 H27 Br O5 -","- C96 H108 Br4 O20 -","4","1","","Liangliang; Song; Lei; Gong; Eric; Meggers","Asymmetric dual catalysis via fragmentation of a single rhodium precursor complex","Chem.Commun.","2016","52","","7699","","","","","0.71073","MoKα","","0.0922","0.0601","","","0.1068","0.114","","","","","","1.013","","","","has coordinates","189983","2020-10-21","18:00:00",""
"7119356","17.6","0.03","4.372","0.006","34.3","0.05","90","","97.444","0.015","90","","2617","7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,4'-Bipyridine; 3,5-diiodosalicylic acid","","- C12 H8 I2 N O3 -","- C12 H8 I2 N O3 -","- C96 H64 I16 N8 O24 -","8","1","","Subhankar; Saha; Gautam; R.; Desiraju","Using structural modularity in cocrystals to engineer properties: elasticity","Chem.Commun.","2016","52","","7676","","","","","0.71073","MoKα","","0.0767","0.0667","","","0.1946","0.2213","","","","","","1.137","","","","has coordinates","189984","2020-10-21","18:00:00",""
"7119357","3.795","0.009","14.7","0.03","21.4","0.05","80.7","0.05","89.35","0.06","89.09","0.05","1178","5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","4,4'-Bipyridine; 3,5-dichlorosalicylic acid","","- C24 H16 Cl4 N2 O6 -","- C24 H16 Cl4 N2 O6 -","- C48 H32 Cl8 N4 O12 -","2","1","","Subhankar; Saha; Gautam; R.; Desiraju","Using structural modularity in cocrystals to engineer properties: elasticity","Chem.Commun.","2016","52","","7676","","","","","0.71073","MoKα","","0.1611","0.0979","","","0.231","0.305","","","","","","1.088","","","","has coordinates","189984","2020-10-21","18:00:00",""
"7119358","4.183","0.003","8.769","0.007","15.366","0.012","94.1","0.03","95.78","0.03","99.68","0.03","550.5","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","4,4'-Bipyridine; 3,5-dibromophenol","","- C11 H8 Br2 N O -","- C11 H8 Br2 N O -","- C22 H16 Br4 N2 O2 -","2","1","","Subhankar; Saha; Gautam; R.; Desiraju","Using structural modularity in cocrystals to engineer properties: elasticity","Chem.Commun.","2016","52","","7676","","","","","0.71073","MoKα","","0.0695","0.056","","","0.1411","0.189","","","","","","1.15","","","","has coordinates","189984","2020-10-21","18:00:00",""
"7119359","3.777","0.007","10.382","0.017","13.45","0.02","68.43","0.04","85.15","0.06","80.26","0.06","483.3","1.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Pyrazine; 3,5-dichlorosalicylic acid","","- C9 H6 Cl2 N O3 -","- C9 H6 Cl2 N O3 -","- C18 H12 Cl4 N2 O6 -","2","1","","Subhankar; Saha; Gautam; R.; Desiraju","Using structural modularity in cocrystals to engineer properties: elasticity","Chem.Commun.","2016","52","","7676","","","","","0.71073","MoKα","","0.0668","0.0531","","","0.1349","0.1561","","","","","","1.106","","","","has coordinates","189984","2020-10-21","18:00:00",""
"7119360","27.78","0.03","4.706","0.004","17.566","0.016","90","","96.051","0.008","90","","2284","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Pyrazine; 3,5-diiodosalicylic acid","","- C9 H6 I2 N O3 -","- C9 H6 I2 N O3 -","- C72 H48 I16 N8 O24 -","8","1","","Subhankar; Saha; Gautam; R.; Desiraju","Using structural modularity in cocrystals to engineer properties: elasticity","Chem.Commun.","2016","52","","7676","","","","","0.71073","MoKα","","0.046","0.0417","","","0.1231","0.1541","","","","","","1.204","","","","has coordinates","189984","2020-10-21","18:00:00",""
"7119361","19.6264","0.0006","52.3974","0.0015","14.3627","0.0004","90","","90.6803","0.0011","90","","14769.2","0.7","93","","93","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C91.75 H99.7 Cl12.48 N14.43 O4.45 Pd6 S0.48 -","- C91.7528 H93.2147 Cl12.4829 N14.4277 O4.4487 Pd6 S0.4829 -","- C367.011 H372.859 Cl49.9316 N57.7108 O17.7948 Pd24 S1.9316 -","4","1","","Shohei; Tashiro; Hirotaka; Yonezawa; Ryou; Kubota; Tsutomu; Umeki; Mitsuhiko; Shionoya","Non-covalent immobilisation of p-toluenesulfonic acid in a porous molecular crystal for size-specific acid-catalysed reactions","Chem.Commun.","2016","52","","7657","","","","","0.71075","MoKα","","0.1446","0.1043","","","0.3119","0.3529","","","","","","1.172","","","","has coordinates","189986","2020-10-21","18:00:00",""
"7119362","19.5796","0.0013","52.142","0.003","14.2469","0.001","90","","91.162","0.002","90","","14541.9","1.6","93","","93","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H52 Cl8 N6 O4 Pd3 -","- C43 H44 Cl8 N6 O4 Pd3 -","- C344 H352 Cl64 N48 O32 Pd24 -","8","2","","Shohei; Tashiro; Hirotaka; Yonezawa; Ryou; Kubota; Tsutomu; Umeki; Mitsuhiko; Shionoya","Non-covalent immobilisation of p-toluenesulfonic acid in a porous molecular crystal for size-specific acid-catalysed reactions","Chem.Commun.","2016","52","","7657","","","","","0.71075","MoKα","","0.189","0.1612","","","0.4245","0.4455","","","","","","1.124","","","","has coordinates","202518","2020-10-21","18:00:00",""
"7119363","19.5493","0.0009","51.784","0.003","14.2759","0.0007","90","","90.7569","0.0014","90","","14450.8","1.3","96","","96","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","sulfonamide_MMF","sulfonamide_MMF","","- C94.65 H105.36 Cl12 N16.29 O3.82 Pd6 S0.41 -","- C94.6499 H98.5318 Cl12 N16.2942 O3.8246 Pd6 S0.4123 -","- C378.6 H394.127 Cl48 N65.1768 O15.2984 Pd24 S1.6492 -","4","1","","Shohei; Tashiro; Hirotaka; Yonezawa; Ryou; Kubota; Tsutomu; Umeki; Mitsuhiko; Shionoya","Non-covalent immobilisation of p-toluenesulfonic acid in a porous molecular crystal for size-specific acid-catalysed reactions","Chem.Commun.","2016","52","","7657","","","","","0.71075","MoKα","","0.1699","0.117","","","0.3281","0.3675","","","","","","1.082","","","","has coordinates","189988","2020-10-21","18:00:00",""
"7119373","10.4816","0.0005","12.7531","0.0005","22.3603","0.001","90","","90","","90","","2989","0.2","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Sulfapyridine DMSO solvate","","","- C13 H17 N3 O3 S2 -","- C13 H17 N3 O3 S2 -","- C104 H136 N24 O24 S16 -","8","1","","Celia; Ruiz-Palomero; Stuart; R.; Kennedy; M.; Laura; Soriano; Christopher; D.; Jones; Miguel; Valcarcel; Jonathan; W.; Steed","Pharmaceutical crystallization with nanocellulose organogels","Chem.Commun.","2016","52","","7782","","","","","0.71073","MoKα","","0.0565","0.0374","","","0.0877","0.0968","","","","","","1.018","","","","has coordinates","190050","2020-10-21","18:00:00",""
"7119374","5.7565","0.0009","10.7037","0.0016","31.057","0.005","87.126","0.004","85.544","0.004","86.192","0.004","1901.7","0.5","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Octadecylammonium sulfamethoxazole DMSO solavte","","- C32 H62 N4 O5 S3 -","- C32 H62 N4 O5 S3 -","- C64 H124 N8 O10 S6 -","2","1","","Celia; Ruiz-Palomero; Stuart; R.; Kennedy; M.; Laura; Soriano; Christopher; D.; Jones; Miguel; Valcarcel; Jonathan; W.; Steed","Pharmaceutical crystallization with nanocellulose organogels","Chem.Commun.","2016","52","","7782","","","","","0.71073","MoKα","","0.1754","0.1334","","","0.3087","0.3284","","","","","","1.12","","","","has coordinates","190050","2020-10-21","18:00:00",""
"7119375","5.5517","0.0018","11.006","0.004","24.121","0.008","90","","90","","90","","1473.8","0.9","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H15 N O3 -","- C20 H15 N O3 -","- C80 H60 N4 O12 -","4","1","","Chun-Wei; Kuo; Ashok; Konala; Lyu; Lin; Ting-Ta; Chiang; Chia-Yu; Huang; Tang-Hao; Yang; Veerababurao; Kavala; Ching-Fa; Yao","Synthesis of benzo[a]carbazole derivatives from 3-ethylindoles by exploiting the dual character of benzoquinone as an oxidizing agent and dienophile","Chem.Commun.","2016","52","","7870","","","","","0.71073","MoKα","","0.0903","0.0484","","","0.0951","0.1252","","","","","","1.052","","","","has coordinates","190051","2020-10-21","18:00:00",""
"7119376","37.27","0.02","7.992","0.005","12.774","0.007","90","","91.797","0.012","90","","3803","4","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H19 N O2 -","- C25 H19 N O2 -","- C200 H152 N8 O16 -","8","1","","Chun-Wei; Kuo; Ashok; Konala; Lyu; Lin; Ting-Ta; Chiang; Chia-Yu; Huang; Tang-Hao; Yang; Veerababurao; Kavala; Ching-Fa; Yao","Synthesis of benzo[a]carbazole derivatives from 3-ethylindoles by exploiting the dual character of benzoquinone as an oxidizing agent and dienophile","Chem.Commun.","2016","52","","7870","","","","","0.71073","MoKα","","0.2953","0.1225","","","0.1931","0.2624","","","","","","1.037","","","","has coordinates","190051","2020-10-21","18:00:00",""
"7119377","7.174","0.0007","14.3271","0.0014","17.4194","0.0017","90","","90","","90","","1790.4","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3ca'","","- C20 H15 Cl N2 O2 -","- C20 H15 Cl N2 O2 -","- C80 H60 Cl4 N8 O8 -","4","1","","Zhu, Gongming; Yang, Junxian; Bao, Guangjun; Zhang, Ming; Li, Jing; Li, Yiping; Sun, Wangsheng; Hong, Liang; Wang, Rui","Catalyst-controlled switch of regioselectivity in the asymmetric allylic alkylation of oxazolones with MBHCs","Chemical Communications","2016","52","50","7882","7885","10.1039/c6cc03246j","","","0.71073","MoKα","","0.0328","0.028","","","0.0632","0.0661","","","","","","1.004","","","","has coordinates","209430","2020-10-21","18:00:00",""
"7119378","7.1668","0.0004","12.4455","0.0008","21.2096","0.0012","90","","90","","90","","1891.78","0.19","273.77","0.1","273.77","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","SN2","","- C21 H18 Cl N O4 -","- C21 H18 Cl N O4 -","- C84 H72 Cl4 N4 O16 -","4","1","","Zhu, Gongming; Yang, Junxian; Bao, Guangjun; Zhang, Ming; Li, Jing; Li, Yiping; Sun, Wangsheng; Hong, Liang; Wang, Rui","Catalyst-controlled switch of regioselectivity in the asymmetric allylic alkylation of oxazolones with MBHCs","Chemical Communications","2016","52","50","7882","7885","10.1039/c6cc03246j","","x-ray","0.71073","MoKα","","0.0827","0.0538","","","0.0962","0.1143","","","","","","1.025","","","","has coordinates","209430","2020-10-21","18:00:00",""
"7119379","13.8176","0.0006","14.3073","0.0006","16.9982","0.0008","90","","95.502","0.004","90","","3344.9","0.3","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H58 Gd2 N8 O20 Zn2 -","- C62 H58 Gd2 N8 O20 Zn2 -","- C124 H116 Gd4 N16 O40 Zn4 -","2","0.5","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","1.54184","CuKα","","0.06","0.0541","","","0.1392","0.1485","","","","","","1.055","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119380","13.75033","0.00018","14.3147","0.0002","16.9418","0.0002","90","","95.2801","0.0012","90","","3320.54","0.07","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H58 Dy2 N8 O20 Zn2 -","- C62 H58 Dy2 N8 O20 Zn2 -","- C124 H116 Dy4 N16 O40 Zn4 -","2","0.5","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","0.71073","MoKα","","0.0462","0.0367","","","0.0946","0.0992","","","","","","1.064","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119381","13.7448","0.0006","14.3133","0.0007","16.9268","0.0007","90","","95.068","0.005","90","","3317","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H58 N8 O20 Y2 Zn2 -","- C62 H58 N8 O20 Y2 Zn2 -","- C124 H116 N16 O40 Y4 Zn4 -","2","0.5","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","0.71073","MoKα","","0.0791","0.0558","","","0.1467","0.1627","","","","","","1.162","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119382","13.8125","0.0004","14.3087","0.0005","16.9783","0.0005","90","","95.498","0.003","90","","3340.14","0.18","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H58 Eu2 N8 O20 Zn2 -","- C62 H58 Eu2 N8 O20 Zn2 -","- C124 H116 Eu4 N16 O40 Zn4 -","2","0.5","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","1.54184","CuKα","","0.05","0.0452","","","0.1113","0.1176","","","","","","1.03","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119383","10.0681","0.0007","9.7551","0.0007","17.5082","0.0011","90","","94.291","0.006","90","","1714.8","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 N2 -","- C23 H18 N2 -","- C92 H72 N8 -","4","1","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","0.6889","","","0.1319","0.0626","","","0.1375","0.1681","","","","","","1.033","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119384","9.9468","0.0004","10.285","0.0005","11.5735","0.0005","75.327","0.004","82.383","0.004","81.347","0.004","1126.82","0.09","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C29 H24 N2 O2 -","- C29 H24 N2 O2 -","- C58 H48 N4 O4 -","2","1","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","0.71073","MoKα","","0.0788","0.0558","","","0.1337","0.1463","","","","","","1.045","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119385","8.8491","0.0005","10.6531","0.0007","20.9154","0.0013","90","","96.794","0.006","90","","1957.9","0.2","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H20 N2 O3 -","- C23 H20 N2 O3 -","- C92 H80 N8 O12 -","4","1","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","0.71073","MoKα","","0.1108","0.0696","","","0.1801","0.2212","","","","","","1.023","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119386","18.3322","0.0016","10.0821","0.0006","20.0451","0.001","90","","90.573","0.006","90","","3704.7","0.4","100","2","100","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- C25 H22 N2 -","- C25 H22 N2 -","- C200 H176 N16 -","8","1","","Griffiths, Kieran; Kumar, Prashant; Akien, Geoffrey R.; Chilton, Nicholas F.; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Kostakis, George E.","Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation","Chemical Communications","2016","52","50","7866","7869","10.1039/c6cc03608b","","x-ray","0.71075","MoKα","","0.1149","0.0575","","","0.1015","0.1202","","","","","","1.032","","","","has coordinates","209431","2020-10-21","18:00:00",""
"7119387","29.983","0.002","29.983","0.002","29.983","0.002","90","","90","","90","","26954","3","250","2","250","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","UBMOF-8","","- C96 H92 N12 O32 Zr6 -","- C96 H84 N12 O32 Zr6 -","- C384 H336 N48 O128 Zr24 -","4","0.0208333","","Naeem, Ayesha; Ting, Valeska P.; Hintermair, Ulrich; Tian, Mi; Telford, Richard; Halim, Saaiba; Nowell, Harriott; Hołyńska, Małgorzata; Teat, Simon J.; Scowen, Ian J.; Nayak, Sanjit","Mixed-linker approach in designing porous zirconium-based metal‒organic frameworks with high hydrogen storage capacity","Chemical Communications","2016","52","50","7826","7829","10.1039/c6cc03787a","","","0.7749","synchrotron","","0.0578","0.0559","","","0.1795","0.182","","","","","","1.016","","","","has coordinates,has disorder","209432","2020-10-21","18:00:00",""
"7119388","29.941","0.001","29.941","0.001","29.941","0.001","90","","90","","90","","26841","1.6","250","2","250","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","UBMOF-9","","- C96 H80 O32 Zr6 -","- C96 H60 O32 Zr6 -","- C384 H240 O128 Zr24 -","4","0.0208333","","Naeem, Ayesha; Ting, Valeska P.; Hintermair, Ulrich; Tian, Mi; Telford, Richard; Halim, Saaiba; Nowell, Harriott; Hołyńska, Małgorzata; Teat, Simon J.; Scowen, Ian J.; Nayak, Sanjit","Mixed-linker approach in designing porous zirconium-based metal‒organic frameworks with high hydrogen storage capacity","Chemical Communications","2016","52","50","7826","7829","10.1039/c6cc03787a","","","0.7749","synchrotron","","0.0578","0.0549","","","0.1589","0.1635","","","","","","1.016","","","","has coordinates,has disorder","209432","2020-10-21","18:00:00",""
"7119389","9.4771","0.0005","16.9192","0.0009","25.2949","0.0014","90","","92.298","0.003","90","","4052.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H36 Cl6 Ge3 N4 -","- C36 H36 Cl6 Ge3 N4 -","- C144 H144 Cl24 Ge12 N16 -","4","1","","Swamy, V. S. V. S. N.; Yadav, Sandeep; Pal, Shiv; Das, Tamal; Vanka, Kumar; Sen, Sakya S.","Facile access to a Ge(II) dication stabilized by isocyanides","Chemical Communications","2016","52","50","7890","7892","10.1039/c6cc03789e","","","0.71073","MoKα","","0.0634","0.0409","","","0.091","0.1005","","","","","","1.065","","","","has coordinates,has disorder","209433","2020-10-21","18:00:00",""
"7119440","9.477","0.005","15.308","0.008","21.114","0.011","90","","102.525","0.01","90","","2990","3","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H36 Br F3 N O3 P -","- C29 H36 Br F3 N O3 P -","- C116 H144 Br4 F12 N4 O12 P4 -","4","1","","Ryosuke; Saijo; Hidemitsu; Uno; Shigeki; Mori; Masami; Kawase","Synthesis and structures of stable phosphorus zwitterions derived from mesoionic 4_trifluoroacetyl-1,3-oxazolium-5-olates","Chem.Commun.","2016","52","","8006","","","","","0.71075","MoKα","","0.0874","0.0717","","","0.1832","0.1968","","","","","","1.167","","","","has coordinates","190511","2020-10-21","18:00:00",""
"7119441","25.9455","0.0003","25.9455","0.0003","24.2457","0.0002","90","","90","","90","","16321.5","0.3","153","","153","","","","","","","","","5","P 4/n c c","-P 4a 2ac","130","","SPA/TPMA/DCB","","- C39 H31 N O3 S -","- C39 H31 N O3 S -","- C624 H496 N16 O48 S16 -","16","","","Tetsuya; Hasegawa; Kei; Ohkubo; Ichiro; Hisaki; Mikiji; Miyata; Norimitsu; Tohnai; Shunichi; Fukuzumi","Photoinduced electron transfer in porous organic salt crystals impregnated with fullerenes","Chem.Commun.","2016","52","","7928","","","","","0.75","synchrotron","","0.0842","0.0603","","","0.1808","0.1965","","","","","","1.084","","","","has coordinates","190512","2020-10-21","18:00:00",""
"7119442","26.7747","0.0001","26.7747","0.0001","24.0725","0.0001","90","","90","","90","","17257.2","0.12","153","","153","","","","","","","","","5","P 4/n c c","-P 4a 2ac","130","","SPA/TPMA/C60","","- C60 H45 N O3 S -","- C60 H45 N O3 S -","- C960 H720 N16 O48 S16 -","16","","","Tetsuya; Hasegawa; Kei; Ohkubo; Ichiro; Hisaki; Mikiji; Miyata; Norimitsu; Tohnai; Shunichi; Fukuzumi","Photoinduced electron transfer in porous organic salt crystals impregnated with fullerenes","Chem.Commun.","2016","52","","7928","","","","","0.8","synchrotron","","0.1327","0.1138","","","0.348","0.3735","","","","","","1.58","","","","has coordinates,has disorder","190512","2020-10-21","18:00:00",""
"7119443","27.3864","0.001","27.3864","0.001","24.2386","0.0005","90","","90","","90","","18179.3","1","153","","153","","","","","","","","","5","P 4/n c c","-P 4a 2ac","130","","SPA/TPMA/C70","","- C62.5 H45 N O3 S -","- C62.5 H45 N O3 S -","- C1000 H720 N16 O48 S16 -","16","","","Tetsuya; Hasegawa; Kei; Ohkubo; Ichiro; Hisaki; Mikiji; Miyata; Norimitsu; Tohnai; Shunichi; Fukuzumi","Photoinduced electron transfer in porous organic salt crystals impregnated with fullerenes","Chem.Commun.","2016","52","","7928","","","","","0.8","synchrotron","","0.3169","0.1293","","","0.3439","0.4357","","","","","","1.19","","","","has coordinates,has disorder","190512","2020-10-21","18:00:00",""
"7119446","20.6432","0.0017","12.1018","0.0009","12.8802","0.0011","90","","110.019","0.003","90","","3023.3","0.4","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 F12 N6 P2 Ru -","- C26 H28 F12 N6 P2 Ru -","- C104 H112 F48 N24 P8 Ru4 -","4","0.5","","Yanay; Popowski; Israel; Goldberg; Moshe; Kol","The stereoselectivity of bipyrrolidine-based sequential polydentate ligands around Ru(II)","Chem.Commun.","2016","52","","7932","","","","","0.71073","MoKα","","0.0355","0.0304","","","0.0737","0.0838","","","","","","1.398","","","","has coordinates","190514","2020-10-21","18:00:00",""
"7119447","25.132","0.002","9.8199","0.0007","17.2577","0.0016","90","","131.012","0.005","90","","3213.8","0.5","110","2","110","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C30 H32 F12 N6 P2 Ru -","- C30 H32 F12 N6 P2 Ru -","- C120 H128 F48 N24 P8 Ru4 -","4","1","","Yanay; Popowski; Israel; Goldberg; Moshe; Kol","The stereoselectivity of bipyrrolidine-based sequential polydentate ligands around Ru(II)","Chem.Commun.","2016","52","","7932","","","","","0.71073","MoKα","","0.0685","0.0611","","","0.1538","0.16","","","","","","1.036","","","","has coordinates","190514","2020-10-21","18:00:00",""
"7119448","10.2422","0.0002","10.2422","0.0002","24.9887","0.0006","90","","90","","120","","2270.18","0.08","110","2","110","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C24 H32 F12 N6 P2 Ru -","- C24 H32 F12 N6 P2 Ru -","- C72 H96 F36 N18 P6 Ru3 -","3","0.5","","Yanay; Popowski; Israel; Goldberg; Moshe; Kol","The stereoselectivity of bipyrrolidine-based sequential polydentate ligands around Ru(II)","Chem.Commun.","2016","52","","7932","","","","","0.71073","MoKα","","0.0199","0.0196","","","0.0474","0.0476","","","","","","1.071","","","","has coordinates","190514","2020-10-21","18:00:00",""
"7119449","10.1753","0.001","16.8389","0.0017","9.2498","0.0009","90","","112.218","0.003","90","","1467.2","0.3","110","2","110","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H29 Cl F12 Fe N5 P2 -","- C25 H29 Cl F12 Fe N5 P2 -","- C50 H58 Cl2 F24 Fe2 N10 P4 -","2","1","","Yanay; Popowski; Israel; Goldberg; Moshe; Kol","The stereoselectivity of bipyrrolidine-based sequential polydentate ligands around Ru(II)","Chem.Commun.","2016","52","","7932","","","","","0.71073","MoKα","","0.045","0.041","","","0.1053","0.1078","","","","","","1.039","","","","has coordinates","190514","2020-10-21","18:00:00",""
"7119450","14.515","0.005","14.999","0.005","15.692","0.005","90","","96.15","0.005","90","","3397","2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{[RuIII(bda)(pic)2(?-O)]2RuIV(pic)2(H2O)2}2+","","- C60 H74 B2 F8 N10 O20 Ru3 -","- C60 H58 B2 F8 N10 O18.614 Ru3 -","- C120 H116 B4 F16 N20 O37.228 Ru6 -","2","0.5","","Yuta; Tsubonouchi; Shu; Lin; Alexander; R.; Parent; Gary; W.; Brudvig; Ken; Sakai","Light-induced water oxidation catalyzed by an oxido-bridged triruthenium complex with a Ru-O-Ru-O-Ru motif","Chem.Commun.","2016","52","","8018","","","","","0.71073","MoKα","","0.064","0.0412","","","0.0886","0.0979","","","","","","1.019","","","","has coordinates,has disorder","190515","2020-10-21","18:00:00",""
"7119451","15.229","0.003","17.001","0.003","17.204","0.003","65.62","0.03","84.91","0.03","71.63","0.03","3845.9","1.7","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","{[Ru3.5(bda)(pic)2(?-O)]2RuIV(pic)2(H2O)2}2+","","- C60 H82 B F4 N10 O32 Ru3 S2 -","- C60 H64 B F4 N10 O32 Ru3 S2 -","- C120 H128 B2 F8 N20 O64 Ru6 S4 -","2","1","","Yuta; Tsubonouchi; Shu; Lin; Alexander; R.; Parent; Gary; W.; Brudvig; Ken; Sakai","Light-induced water oxidation catalyzed by an oxido-bridged triruthenium complex with a Ru-O-Ru-O-Ru motif","Chem.Commun.","2016","52","","8018","","","","","0.71073","MoKα","","0.0871","0.0598","","","0.1511","0.1657","","","","","","1.086","","","","has coordinates","190515","2020-10-21","18:00:00",""
"7119454","14.5436","0.0002","14.5436","0.0002","29.1864","0.0009","90","","90","","90","","6173.4","0.2","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0465","0.0359","","","0.0689","0.0733","","","","","","1.042","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119455","14.573","0.003","14.573","0.003","28.941","0.011","90","","90","","90","","6146","3","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H25 Cd N2 O4 -","- C36 H25 Cd N2 O4 -","- C288 H200 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0827","0.0543","","","0.1141","0.1276","","","","","","1.106","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119456","14.523","0.0002","14.523","0.0002","29.1177","0.0008","90","","90","","90","","6141.4","0.2","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0623","0.0543","","","0.1226","0.1264","","","","","","1.149","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119457","14.3555","0.0003","14.3555","0.0003","29.4087","0.0014","90","","90","","90","","6060.6","0.3","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H24 Cd N2 O4 -","- C36 H24 Cd N2 O4 -","- C288 H192 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0393","0.0355","","","0.0874","0.0907","","","","","","1.018","","","","has coordinates","204130","2020-10-21","18:00:00",""
"7119458","14.5029","0.0003","14.5029","0.0003","29.2053","0.0013","90","","90","","90","","6142.9","0.3","296","2","296","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0356","0.0324","","","0.0804","0.0827","","","","","","1.095","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119459","14.3664","0.0007","14.3664","0.0007","29.399","0.003","90","","90","","90","","6067.8","0.7","296","2","296","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H24 Cd N2 O4 -","- C36 H24 Cd N2 O4 -","- C288 H192 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0449","0.0402","","","0.101","0.1039","","","","","","1.084","","","","has coordinates","204130","2020-10-21","18:00:00",""
"7119460","14.5318","0.0004","14.5318","0.0004","29.1429","0.0015","90","","90","","90","","6154.2","0.4","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.045","0.0366","","","0.0842","0.0879","","","","","","1.061","","","","has coordinates,has disorder","204131","2020-10-21","18:00:00",""
"7119461","14.5128","0.0014","14.5128","0.0014","29.194","0.004","90","","90","","90","","6148.9","1.2","296","2","296","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0439","0.0394","","","0.1011","0.1045","","","","","","1.106","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119462","14.4791","0.0005","14.4791","0.0005","29.069","0.002","90","","90","","90","","6094.2","0.5","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0515","0.0402","","","0.0902","0.095","","","","","","1.072","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119463","14.4739","0.0003","14.4739","0.0003","29.0695","0.0012","90","","90","","90","","6089.9","0.3","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0661","0.0543","","","0.1292","0.1354","","","","","","1.098","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119464","14.4958","0.0003","14.4958","0.0003","29.0361","0.0015","90","","90","","90","","6101.3","0.4","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1133","0.0933","","","0.2163","0.2252","","","","","","1.207","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119465","14.5294","0.0003","14.5294","0.0003","29.1842","0.0016","90","","90","","90","","6160.9","0.4","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1112","0.0956","","","0.2184","0.2303","","","","","","1.071","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119466","14.4838","0.0003","14.4838","0.0003","29.2182","0.0011","90","","90","","90","","6129.4","0.3","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0929","0.0694","","","0.1574","0.174","","","","","","1.094","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119467","14.4458","0.0004","14.4458","0.0004","29.3447","0.0013","90","","90","","90","","6123.7","0.4","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","1.54178","CuKα","","0.15","0.069","","","0.1267","0.1765","","","","","","1.026","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119468","14.4171","0.0003","14.4171","0.0003","29.1929","0.0014","90","","90","","90","","6067.8","0.3","296","2","296","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0998","0.0689","","","0.1519","0.1653","","","","","","1.057","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119469","14.5097","0.0003","14.5097","0.0003","28.8452","0.0014","90","","90","","90","","6072.8","0.3","273","2","273","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0837","0.0649","","","0.1491","0.159","","","","","","1.035","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119470","14.5222","0.0009","14.5222","0.0009","29.245","0.003","90","","90","","90","","6167.6","0.8","296","2","296","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1592","0.0771","","","0.1551","0.1865","","","","","","1.082","","","","has coordinates","204130","2020-10-21","18:00:00",""
"7119471","14.5387","0.0016","14.5387","0.0016","29.246","0.006","90","","90","","90","","6181.8","1.6","296","2","296","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1515","0.0913","","","0.1822","0.2058","","","","","","1.154","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119472","14.5486","0.0002","14.5486","0.0002","29.1966","0.0011","90","","90","","90","","6179.8","0.3","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0957","0.0862","","","0.1888","0.1943","","","","","","1.142","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119473","14.486","0.0008","14.486","0.0008","28.911","0.003","90","","90","","90","","6066.8","0.8","273","2","273","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1436","0.0746","","","0.1523","0.1821","","","","","","1.018","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119474","14.4896","0.0003","14.4896","0.0003","29.1167","0.001","90","","90","","90","","6113","0.3","273","2","273","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1015","0.078","","","0.1771","0.1939","","","","","","1.102","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119475","14.4789","0.0004","14.4789","0.0004","29.007","0.002","90","","90","","90","","6081","0.5","273","2","273","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0957","0.0682","","","0.1528","0.1664","","","","","","1.108","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119476","14.5067","0.0003","14.5067","0.0003","28.888","0.0016","90","","90","","90","","6079.3","0.4","273","2","273","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1212","0.0824","","","0.1949","0.2165","","","","","","1.069","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119477","14.4975","0.0002","14.4975","0.0002","29.1189","0.0011","90","","90","","90","","6120.1","0.3","273","2","273","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.098","0.0791","","","0.1845","0.1967","","","","","","1.1","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119478","14.5803","0.0004","14.5803","0.0004","29.181","0.002","90","","90","","90","","6203.4","0.5","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0617","0.0465","","","0.0902","0.0965","","","","","","1.067","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119479","14.5474","0.0002","14.5474","0.0002","29.2215","0.0009","90","","90","","90","","6184.1","0.2","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.0594","0.05","","","0.11","0.1156","","","","","","1.097","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119480","14.5616","0.0003","14.5616","0.0003","29.153","0.0008","90","","90","","90","","6181.6","0.2","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C36 H26 Cd N2 O4 -","- C36 H26 Cd N2 O4 -","- C288 H208 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1071","0.0983","","","0.2164","0.2214","","","","","","1.154","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119481","14.4906","0.0003","14.4906","0.0003","29.1148","0.0011","90","","90","","90","","6113.5","0.3","273","2","273","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C36 H25 Cd N2 O4 -","- C36 H25 Cd N2 O4 -","- C288 H200 Cd8 N16 O32 -","8","1","","Hu, Fei-Long; Wang, Hui-Fang; Guo, Dong; Zhang, Hui; Lang, Jian-Ping; Beves, Jonathon E.","Controlled formation of chiral networks and their reversible chiroptical switching behaviour by UV/microwave irradiation","Chemical Communications","2016","52","51","7990","7993","10.1039/c6cc03256g","","","0.71073","MoKα","","0.1098","0.0792","","","0.1737","0.193","","","","","","1.094","","","","has coordinates,has disorder","204130","2020-10-21","18:00:00",""
"7119482","44.874","0.004","44.874","0.004","42.074","0.005","90","","90","","120","","73373","13","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","InOF-9","","- C72 H40 In2 O16 -","- C72 H40 In2 O16 -","- C1296 H720 In36 O288 -","18","1","","Panpan; Yu; Qipeng; Li; Yue; Hu; Nannan; Liu; Lijie; Zhang; Kongzhao; Su; Jinjie; Qian; Shaoming; Huang; Maochun; Hong","Cuboctahedron-based indium-organic frameworks for gas sorption and selective cation exchange","Chem.Commun.","2016","52","","7978","","","","","0.71073","MoKα","","0.1337","0.0845","","","0.2307","0.2533","","","","","","0.945","","","","has coordinates","190518","2020-10-21","18:00:00",""
"7119483","25.507","0.004","8.1552","0.0014","16.661","0.003","90","","92.869","0.002","90","","3461.4","1","90","","90","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","11-Benzoyl-6-hydroxytetracen-5(12H)-one","","- C25 H16 O3 -","- C25 H16 O3 -","- C200 H128 O24 -","8","1","","Hikaru; Yanai; Nobuyuki; Ishii; Takashi; Matsumoto","Synthesis of 1,2,3,4-tetrasubstituted naphthalenes through a cascade reaction triggered by silyl acetal activation","Chem.Commun.","2016","52","","7974","","","","","0.71073","MoKα","","0.0464","0.0357","","","0.0868","0.0925","","","","","","1.04","","","","has coordinates","190519","2020-10-21","18:00:00",""
"7119484","9.173","0.002","10.382","0.003","12.748","0.003","104.062","0.003","94.66","0.003","116.023","0.002","1033.4","0.4","90","","90","","","","","","","","","3","P -1","-P 1","2","","Ethyl 4-benzoyl-3-benzyl-1-hydroxy-2-naphthoate","","- C27 H22 O4 -","- C27 H22 O4 -","- C54 H44 O8 -","2","1","","Hikaru; Yanai; Nobuyuki; Ishii; Takashi; Matsumoto","Synthesis of 1,2,3,4-tetrasubstituted naphthalenes through a cascade reaction triggered by silyl acetal activation","Chem.Commun.","2016","52","","7974","","","","","0.71073","MoKα","","0.0524","0.0466","","","0.1304","0.1368","","","","","","1.046","","","","has coordinates","190519","2020-10-21","18:00:00",""
"7119485","14.1779","0.0017","7.8527","0.0009","19.28","0.002","90","","96.464","0.0016","90","","2132.9","0.4","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Ethyl 4-benzoyl-1-hydroxy-3-pentyl-2-naphthoate","","- C25 H26 O4 -","- C25 H26 O4 -","- C100 H104 O16 -","4","1","","Hikaru; Yanai; Nobuyuki; Ishii; Takashi; Matsumoto","Synthesis of 1,2,3,4-tetrasubstituted naphthalenes through a cascade reaction triggered by silyl acetal activation","Chem.Commun.","2016","52","","7974","","","","","0.71073","MoKα","","0.0416","0.0348","","","0.0913","0.0963","","","","","","1.038","","","","has coordinates","190519","2020-10-21","18:00:00",""
"7119486","5.7885","0.0004","10.4613","0.0008","16.3808","0.0012","92.216","0.001","97.607","0.001","92.531","0.001","981.26","0.12","90","2","90","2","","","","","","","","3","P -1","-P 1","2","","Ethyl 5-hydroxy-12-phenyltetraphene-6-carboxylate","","- C27 H24 O3 -","- C27 H24 O3 -","- C54 H48 O6 -","2","1","","Hikaru; Yanai; Nobuyuki; Ishii; Takashi; Matsumoto","Synthesis of 1,2,3,4-tetrasubstituted naphthalenes through a cascade reaction triggered by silyl acetal activation","Chem.Commun.","2016","52","","7974","","","","","0.71073","MoKα","","0.0455","0.0392","","","0.1062","0.1115","","","","","","0.977","","","","has coordinates","190519","2020-10-21","18:00:00",""
"7119487","12.8806","0.0003","15.305","0.0003","15.3667","0.0003","113.734","0.0011","98.8175","0.0012","110.01","0.0011","2452.06","0.1","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C37.5 H32.5 Br Cl10.5 Mn N3 O3 P2 -","- C37.5 H32.5 Br Cl10.5 Mn N3 O3 P2 -","- C75 H65 Br2 Cl21 Mn2 N6 O6 P4 -","2","1","","Gyandshwar; Kumar; Rao; Wendy; Pell; Ilia; Korobkov; Darrin; Richeson","Electrocatalytic reduction of CO2 using Mn complexes with unconventional coordination environments","Chem.Commun.","2016","52","","8010","","","","","0.71073","MoKα","","0.0582","0.0465","","","0.1195","0.1275","","","","","","1.061","","","","has coordinates,has disorder","190520","2020-10-21","18:00:00",""
"7119488","8.312","0.0002","11.1704","0.0003","11.8045","0.0004","90","","108.672","0.0016","90","","1038.34","0.05","200","2","200","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C21 H17 Br Mn N2 O3 P -","- C21 H17 Br Mn N2 O3 P -","- C42 H34 Br2 Mn2 N4 O6 P2 -","2","1","","Gyandshwar; Kumar; Rao; Wendy; Pell; Ilia; Korobkov; Darrin; Richeson","Electrocatalytic reduction of CO2 using Mn complexes with unconventional coordination environments","Chem.Commun.","2016","52","","8010","","","","","0.71073","MoKα","","0.0253","0.024","","","0.0577","0.0582","","","","","","0.935","","","","has coordinates,has disorder","190520","2020-10-21","18:00:00",""
"7119615","33.1977","0.0003","33.1977","0.0003","59.4184","0.0008","90","","90","","120","","56711","1.1","120","2","120","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C219 H324 Gd18 N30 O147 -","- C219 H306 Gd18 N30 O147 -","- C1314 H1836 Gd108 N180 O882 -","6","0.166667","","Kai; Wang; Zi-Lu; Chen; Hua-Hong; Zou; Kun; Hu; Hai-Ye; Li; Zhong; Zhang; Wei-Yin; Sun; Fu-Pei; Liang","A single-stranded {Gd18} nanowheel with a symmetric polydentate diacylhydrazone ligand","Chem.Commun.","2016","52","","8297","","","","","0.71073","MoKα","","0.0786","0.0568","","","0.1326","0.1545","","","","","","1.158","","","","has coordinates,has disorder","191776","2020-10-21","18:00:00",""
"7119616","7.965","0.0002","9.5073","0.0002","16.0506","0.0004","90","","90","","90","","1215.44","0.05","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","1.54178","CuKα","","0.0272","0.0266","","","0.0656","0.0661","","","","","","1.068","","","","has coordinates","191777","2020-10-21","18:00:00",""
"7119617","7.9647","0.0002","9.5076","0.0003","16.0492","0.0005","90","","90","","90","","1215.33","0.06","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","1.54178","CuKα","","0.0283","0.0277","","","0.0679","0.0684","","","","","","1.104","","","","has coordinates","191777","2020-10-21","18:00:00",""
"7119618","8.5431","0.0008","9.8089","0.0008","14.6636","0.0012","90","","90","","90","","1228.79","0.18","100","2","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C56 H48 Br4 N4 O8 -","4","1","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","0.71073","MoKα","","0.0244","0.0204","","","0.0425","0.0436","","","","","","1.04","","","","has coordinates","191777","2020-10-21","18:00:00",""
"7119619","16.9222","0.0007","7.6509","0.0003","20.5384","0.0008","90","","109.285","0.002","90","","2509.9","0.18","296","2","296.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C120 H120 N8 O24 -","8","2","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","1.54178","CuKα","","0.1162","0.1101","","","0.2873","0.2902","","","","","","1.092","","","","has coordinates","191777","2020-10-21","18:00:00",""
"7119620","9.6309","0.0003","7.8723","0.0002","17.274","0.0005","90","","96.92","0.0012","90","","1300.13","0.06","296","2","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 F3 N O2 -","- C15 H12 F3 N O2 -","- C60 H48 F12 N4 O8 -","4","1","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","1.54178","CuKα","","0.0508","0.045","","","0.1128","0.1169","","","","","","1.068","","","","has coordinates","191777","2020-10-21","18:00:00",""
"7119621","8.7121","0.0003","11.7093","0.0003","14.2353","0.0004","76.9998","0.0011","72.3793","0.0011","69.8941","0.0006","1287.79","0.07","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H12 F3 N O2 -","- C15 H12 F3 N O2 -","- C60 H48 F12 N4 O8 -","4","2","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","1.54178","CuKα","","0.0383","0.0351","","","0.0872","0.0893","","","","","","1.09","","","","has coordinates","191777","2020-10-21","18:00:00",""
"7119622","18.1984","0.0005","7.3629","0.0002","19.2858","0.0005","90","","108.487","0.001","90","","2450.81","0.11","100","2","99.96","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C112 H96 Br8 N8 O16 -","8","2","","Ramya Raghunathan; Elango Kumarasamy; Steffen Jockusch; Angel Ugrinov; J. Sivaguru","Engaging electronic effects for atropselective [5+2]-photocycloaddition of maleimides","Chem.Commun.","2016","52","","8305","","","","","1.54178","CuKα","","0.0384","0.0321","","","0.0778","0.0822","","","","","","1.088","","","","has coordinates","202518","2020-10-21","18:00:00",""
"7119649","9.4627","0.0002","11.1519","0.0003","18.1676","0.0006","90","","90","","90","","1917.17","0.09","294.39","0.1","294.39","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 Cl N O2 -","- C23 H20 Cl N O2 -","- C92 H80 Cl4 N4 O8 -","4","1","","Yan Lu; Yuhang Zhou; Lili Lin; Haifeng Zheng; Kai Fu; Xiaohua Liu; Xiaoming Feng","N,N'-Dioxide/nickel(II)-catalyzed asymmetric Diels-Alder reaction of cyclopentadiene with 2,3-dioxopyrrolidines and 2=alkenoyl pyridines","Chem.Commun.","2016","52","","8255","","","","x-ray","1.54184","CuKα","","0.0509","0.0479","","","0.1258","0.1296","","","","","","1.067","","","","has coordinates","192002","2020-10-21","18:00:00",""
"7119650","16.2716","0.0015","21.2062","0.0018","10.0994","0.0009","90","","90","","90","","3484.9","0.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","3-Methyl-2-Phenylbutyramide, Salicylic acid","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C144 H168 N8 O32 -","8","2","","U. B. Rao Khandavilli; Matteo Lusi; Balakrishna R. Bhogala; Anita R. Maguire; Matthias Stein; Simon E. Lawrence","Diversity in a simple co-crystal: racemic and kryptoracemic behaviour","Chem.Commun.","2016","52","","8309","8312","10.1039/C6CC04148E","","","0.71073","","","0.0584","0.0464","","","0.1387","0.1507","","","","","","1.005","","","","has coordinates","287771","2023-11-24","08:38:55",""
"7119651","9.882","0.004","20.953","0.008","16.215","0.006","90","","93.913","0.011","90","","3350","2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C144 H168 N8 O32 -","8","4","","U. B. Rao Khandavilli; Matteo Lusi; Balakrishna R. Bhogala; Anita R. Maguire; Matthias Stein; Simon E. Lawrence","Diversity in a simple co-crystal: racemic and kryptoracemic behaviour","Chem.Commun.","2016","52","","8309","8312","10.1039/C6CC04148E","","","0.71073","MoKα","","0.1735","0.1089","","","0.2653","0.3014","","","","","","1.028","","","","has coordinates","287771","2023-11-24","08:38:56",""
"7119652","10.0661","0.0014","21.081","0.003","16.584","0.002","90","","100.06","0.004","90","","3465.1","0.8","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-Methyl-2-Phenylbutyramide-Salicylic acid-Polymorph III","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C144 H168 N8 O32 -","8","2","","U. B. Rao Khandavilli; Matteo Lusi; Balakrishna R. Bhogala; Anita R. Maguire; Matthias Stein; Simon E. Lawrence","Diversity in a simple co-crystal: racemic and kryptoracemic behaviour","Chem.Commun.","2016","52","","8309","8312","10.1039/C6CC04148E","","","0.71073","","","0.1054","0.0527","","","0.124","0.1506","","","","","","1.013","","","","has coordinates","287771","2023-11-24","08:38:58",""
"7119653","9.03667","0.00017","6.90757","0.00013","21.7122","0.0004","90","","99.8233","0.0009","90","","1335.44","0.04","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 N2 O5 S -","- C11 H16 N2 O5 S -","- C44 H64 N8 O20 S4 -","4","1","","Shuai Dong; Kiran Indukuri; Derrick L. J. Clive; Jin-Ming Gao","Synthesis of models of the BC ring systems of MPC1001 and MPC1001F","Chem.Commun.","2016","52","","8271","","","","","1.54178","CuKα","","0.0508","0.0493","","","0.1361","0.1373","","","","","","1.123","","","","has coordinates","192004","2020-10-21","18:00:00",""
"7119654","6.7169","0.0003","7.9571","0.0003","16.1794","0.0006","91.3062","0.0004","98.1391","0.0004","92.2828","0.0005","855","0.06","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 N3 O7 S -","- C16 H15 N3 O7 S -","- C32 H30 N6 O14 S2 -","2","1","","Shuai Dong; Kiran Indukuri; Derrick L. J. Clive; Jin-Ming Gao","Synthesis of models of the BC ring systems of MPC1001 and MPC1001F","Chem.Commun.","2016","52","","8271","","","","","0.71073","MoKα","","0.0344","0.032","","","0.0854","0.0877","","","","","","1.025","","","","has coordinates","192004","2020-10-21","18:00:00",""
"7119655","10.013","0.002","7.5562","0.0016","21.159","0.005","90","","93.102","0.003","90","","1598.5","0.6","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 F3 N3 O2 -","- C16 H14 F3 N3 O2 -","- C64 H56 F12 N12 O8 -","4","1","","Xing-Long Yu; Jia-Rong Chen; Dong-Zhen Chen; Wen-Jing Xiao","Visible-light-induced photocatalytic azotrifluoromethylation of alkenes with aryldiazonium salts and sodium triflinate","Chem.Commun.","2016","52","","8275","","","","","0.71073","MoKα","","0.0836","0.0578","","","0.1648","0.1835","","","","","","1.049","","","","has coordinates","192005","2020-10-21","18:00:00",""
"7119656","7.7761","0.0016","15.354","0.003","14.48","0.003","90","","95.766","0.008","90","","1720.1","0.6","151","2","150.89","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 B F4 O -","- C20 H17 B F4 O -","- C80 H68 B4 F16 O4 -","4","1","","Eliar Mosaferi; David Ripsman; Douglas W. Stephan","The air-stable carbocation salt [(MeOC6H4)CPh2][BF4] in Lewis acid catalyzed hydrothiolation of alkenes","Chem.Commun.","2016","52","","8291","","","","","0.71073","MoKα","","0.1255","0.1084","","","0.3087","0.322","","","","","","1.0549","","","","has coordinates","192006","2020-10-21","18:00:00",""
"7119675","39.65","0.005","13.44","0.005","26.01","0.005","90","","111.476","0.005","90","","12898","6","273","2","273","2","","","","","","","synthesis","6","C 1 2/c 1","-C 2yc","15","","","","- C59 H59 B2 F24 N5 Pt -","- C59 H59 B2 F24 N5 Pt -","- C472 H472 B16 F192 N40 Pt8 -","8","1","","Marta Rosello-Merino; Raquel J. Rama; Josefina Diez; Salvador Conejero","Catalytic dehydrocoupling of amine-boranes and amines into diaminoboranes: isolation of a Pt(II), Shimoi-type, Eta1-BH complex","Chem.Commun.","2016","52","","8389","","","","","1.5418","CuKα","","0.04","0.0395","","","0.0977","0.0981","","","","","","1.041","","","","has coordinates","192269","2020-10-21","18:00:00",""
"7119676","28.2219","0.0017","28.2219","0.0017","9.7266","0.0012","90","","90","","90","","7747","1.2","296","2","296","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C68 H78 N8 O28 Zn3 -","- C68 H78 N8 O28 Zn3 -","- C272 H312 N32 O112 Zn12 -","4","0.25","","Jun-Cheng Jin; Ju Wu; Guo-Ping Yang; Yun-Long Wu; Yao-Yu Wang","A microporous anionic metal-organic framework for a highly selective and sensitive electrochemical sensor of Cu2+ ions","Chem.Commun.","2016","52","","8475","","","","","0.71073","MoKα","","0.0618","0.0548","","","0.1461","0.1509","","","","","","1.043","","","","has coordinates,has disorder","192270","2020-10-21","18:00:00",""
"7119677","8.4472","0.0004","12.7834","0.0005","15.0002","0.0006","100.217","0.002","105.699","0.002","108.939","0.0019","1411","0.11","296","2","296","2","","","","","","","","3","P -1","-P 1","2","3-(2-methoxyphenyl)benzo[de]chromene-2,6-dione","3-(2-methoxyphenyl)benzo[de]chromene-2,6-dione","","- C19 H12 O4 -","- C19 H12 O4 -","- C76 H48 O16 -","4","2","","Devenderan Ramanathan; Kayambu Namitharan; Kasi Pitchumani","Copper(I)-Y zeolite catalyzed N-sulfonylketenimine mediated annulation of hydroxynaphthoquinones: syntheses of naphtho[2,1-b]furan-2,5-diones and benzo[de]chromene-2,6-diones","Chem.Commun.","2016","52","","8436","","","","","0.71073","MoKα","","0.075","0.0507","","","0.1251","0.1376","","","","","","1.06","","","","has coordinates","192271","2020-10-21","18:00:00",""
"7119678","9.081","0.0004","15.7891","0.0007","9.2543","0.0004","90","","97.431","0.002","90","","1315.74","0.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-phenylnaphtho[2,1-b]furan-2,5-dione","","- C18.25 H10.5 O3 -","- C18.25 H10.5 O3 -","- C73 H42 O12 -","4","1","","Devenderan Ramanathan; Kayambu Namitharan; Kasi Pitchumani","Copper(I)-Y zeolite catalyzed N-sulfonylketenimine mediated annulation of hydroxynaphthoquinones: syntheses of naphtho[2,1-b]furan-2,5-diones and benzo[de]chromene-2,6-diones","Chem.Commun.","2016","52","","8436","","","","","0.71073","MoKα","","0.0696","0.0429","","","0.1052","0.1194","","","","","","1.031","","","","has coordinates,has disorder","192271","2020-10-21","18:00:00",""
"7119679","14.3957","0.0007","18.2215","0.0008","16.1798","0.0007","90","","102.476","0.002","90","","4143.9","0.3","233","2","233","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C73 H82 Cl4 Co3 N10 O26 -","- C73 H66 Cl4 Co3 N10 O26 -","- C146 H132 Cl8 Co6 N20 O52 -","2","1","","Roberto Berardozzi; Elena Badetti; Nadia Alessandra Carmo dos Santos; Klaus Wurst; Giulia Licini; Gennaro Pescitelli; Cristiano Zonta; Lorenzo Di Bari","Co(II)-induced giant vibrational CD provides a new design of methods for rapid and sensitive chirality recognition","Chem.Commun.","2016","52","","8428","","","","","0.71073","MoKα","","0.096","0.0674","","","0.1574","0.1724","","","","","","1.026","","","","has coordinates,has disorder","192272","2020-10-21","18:00:00",""
"7119680","9.7234","0.0004","9.8305","0.0004","22.0952","0.0009","102.367","0.003","94.393","0.003","107.218","0.003","1948.22","0.15","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H17 N O3 S Se -","- C21 H17 N O3 S Se -","- C84 H68 N4 O12 S4 Se4 -","4","2","","Kai Sun; Xin Wang; Yunhe Lv; Gang Li; Hezhen Jiao; Changwei Dai; Yangyang Li; Chong Zhang; Lin Liu","Peroxodisulfate-mediated selenoamination of alkenes yielding amidoselenide-containing sulfamides and azoles","Chem.Commun.","2016","52","","8471","","","","","0.71073","MoKα","","0.0569","0.0331","","","0.0753","0.0846","","","","","","1.014","","","","has coordinates","192273","2020-10-21","18:00:00",""
"7119681","16.8676","0.0007","16.8676","0.0007","18.8186","0.0006","90","","90","","120","","4636.9","0.3","131.9","0.2","131.9","0.2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C24 H27 Co3 N12 O10 -","- C24 H12 Co3 N12 O10 -","- C48 H24 Co6 N24 O20 -","2","0.0833333","","Di-Ming Chen; Jia-Yue Tian; Chun-Sen Liu; Miao Du","A bracket approach to improve the stability and gas sorption performance of a metal-organic framework via in situ incorporating the size-matching molecular building blocks","Chem. Commun.","2016","52","","8413","","","","","0.71073","MoKα","","0.0484","0.0407","","","0.1459","0.1502","","","","","","1.033","","","","has coordinates,has disorder","192274","2020-10-21","18:00:00",""
"7119682","18.8605","0.0004","18.8605","0.0004","16.6183","0.0004","90","","90","","120","","5119.5","0.2","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C42 H24 Co5 N15 O15 -","- C42 H24 Co5 N15 O15 -","- C84 H48 Co10 N30 O30 -","2","0.0833333","","Di-Ming Chen; Jia-Yue Tian; Chun-Sen Liu; Miao Du","A bracket approach to improve the stability and gas sorption performance of a metal-organic framework via in situ incorporating the size-matching molecular building blocks","Chem. Commun.","2016","52","","8413","","","","x-ray","1.54184","CuKα","","0.0987","0.0968","","","0.2788","0.2881","","","","","","1.106","","","","has coordinates,has disorder","192274","2020-10-21","18:00:00",""
"7119826","18.2623","0.0006","18.2623","0.0006","39.6543","0.0013","90","","90","","120","","11453.3","0.7","296","2","296.15","","","","","","","","","5","R -3 m","-R 3 2""","166","","","","- C193.68 H54 Cu18 N18 O117 -","- C193.5 H54 Cu18 N18 O116.999 -","- C193.5 H54 Cu18 N18 O116.999 -","1","","","Xiaoping Zhang; Zhenjie Zhang; Jake Boissonnault; Seth M. Cohen","Design and synthesis of squaramide-based MOFs as efficient MOF-supported hydrogen-bonding organocatalysts","Chem.Commun.","2016","52","","8585","","","","","0.71073","MOKα","","0.0784","0.0689","","","0.2158","0.2267","","","","","","1.133","","","","has coordinates,has disorder","194264","2020-10-21","18:00:00",""
"7119827","18.816","0.002","18.816","0.002","38.416","0.005","90","","90","","120","","11779","2","296","2","296.15","","","","","","","","","5","R -3 m","-R 3 2""","166","","","","- C180 H54 N18 O108 Zn18 -","- C180 H54 N18 O108 Zn18 -","- C180 H54 N18 O108 Zn18 -","1","","","Xiaoping Zhang; Zhenjie Zhang; Jake Boissonnault; Seth M. Cohen","Design and synthesis of squaramide-based MOFs as efficient MOF-supported hydrogen-bonding organocatalysts","Chem.Commun.","2016","52","","8585","","","","","0.71073","MoKα","","0.0901","0.07","","","0.1823","0.19","","","","","","1.184","","","","has coordinates,has disorder","194264","2020-10-21","18:00:00",""
"7119828","8.562","0.003","8.839","0.003","16.904","0.005","82.238","0.007","89.592","0.007","78.252","0.004","1240.7","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H21 B Cd N9 O4 -","- C19 H21 B Cd N9 O4 -","- C38 H42 B2 Cd2 N18 O8 -","2","1","","Min Liu; Shumei Chen; Tian Wen; Jian Zhang","Encapsulation of LnIII ions/Ag nanoparticles within Cd(II) boron imidazolate frameworks for tuning luminescence emission","Chem.Commun.","2016","52","","8577","","","","","0.71073","MoKα","","0.0482","0.0416","","","0.143","0.1486","","","","","","1.106","","","","has coordinates","194265","2020-10-21","18:00:00",""
"7119829","28.187","0.01","14.002","0.004","27.657","0.01","90","","116.228","0.006","90","","9792","6","293.15","","293.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H31 B2 Cd3 N16 O12 -","- C42 H31 B2 Cd3 N16 O12 -","- C336 H248 B16 Cd24 N128 O96 -","8","1","","Min Liu; Shumei Chen; Tian Wen; Jian Zhang","Encapsulation of LnIII ions/Ag nanoparticles within Cd(II) boron imidazolate frameworks for tuning luminescence emission","Chem.Commun.","2016","52","","8577","","","","","0.71073","MoKα","","0.0464","0.0368","","","0.0955","0.1055","","","","","","1.101","","","","has coordinates","194265","2020-10-21","18:00:00",""
"7119830","17.4535","0.0004","8.0246","0.0002","17.7712","0.0004","90","","97.847","0.002","90","","2465.68","0.1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C52 H68 N8 O8 -","- C52 H67.86 N8 O8 -","- C104 H135.72 N16 O16 -","2","0.5","","Juhoon Lee; Nolan W. Waggoner; Luis Polanco; Ga Rim You; Vincent M. Lynch; Sung Kuk Kim; Simon M. Humphrey; Jonathan L. Sessler","Ship in a breakable bottle: fluoride-induced release of an organic molecule from a Pr(III)-linked molecular cage","Chem.Commun.","2016","52","","8514","","","","","1.54184","CuKα","","0.0668","0.0483","","","0.1235","0.1383","","","","","","1.012","","","","has coordinates,has disorder","194266","2020-10-21","18:00:00",""
"7119831","20.6712","0.0004","21.0386","0.0005","21.6281","0.0005","62.477","0.002","79.558","0.002","67.086","0.002","7683.2","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C286 H338 N38 O40 Pr4 -","- C266 H309 N36 O39 Pr4 -","- C266 H309 N36 O39 Pr4 -","1","0.5","","Juhoon Lee; Nolan W. Waggoner; Luis Polanco; Ga Rim You; Vincent M. Lynch; Sung Kuk Kim; Simon M. Humphrey; Jonathan L. Sessler","Ship in a breakable bottle: fluoride-induced release of an organic molecule from a Pr(III)-linked molecular cage","Chem.Commun.","2016","52","","8514","","","","","1.54184","CuKα","","0.0733","0.0555","","","0.1507","0.1704","","","","","","1.045","","","","has coordinates,has disorder","194266","2020-10-21","18:00:00",""
"7119832","28.896","0.0009","8.6749","0.0003","14.2513","0.0004","90","","116.056","0.001","90","","3209.29","0.18","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C60 H68 N16 O4 Pr2 -","- C52.02 H47.38 N3.34 O15.34 Pr2 -","- C104.04 H94.76 N6.68 O30.68 Pr4 -","2","0.5","","Juhoon Lee; Nolan W. Waggoner; Luis Polanco; Ga Rim You; Vincent M. Lynch; Sung Kuk Kim; Simon M. Humphrey; Jonathan L. Sessler","Ship in a breakable bottle: fluoride-induced release of an organic molecule from a Pr(III)-linked molecular cage","Chem.Commun.","2016","52","","8514","","","","","0.71073","MoKα","","0.0391","0.0322","","","0.0805","0.0828","","","","","","1.033","","","","has coordinates,has disorder","194266","2020-10-21","18:00:00",""
"7119833","14.2787","0.0009","9.4954","0.0004","14.5637","0.0008","90","","98.003","0.005","90","","1955.34","0.18","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-ethyl 4-(naphthalen-2-yl)-2-nitro-4-oxo-3-(piperidin-1-yl)but-2-enoate","","- C21 H22 N2 O5 -","- C21 H22 N2 O5 -","- C84 H88 N8 O20 -","4","1","","Yanan Li; Huihui Gao; Zhenlei Zhang; Peng Qian; Meixiang Bi; Zhenggen Zha; Zhiyong Wang","Electrochemical synthesis of alpha-enaminones from aryl ketones","Chem.Commun.","2016","52","","8600","","","","","0.71073","MoKα","","0.099","0.0575","","","0.1511","0.2113","","","","","","1.067","","","","has coordinates","194267","2020-10-21","18:00:00",""
"7120018","8.58","0.0003","13.5581","0.0005","13.8786","0.0005","85.002","0.003","87.556","0.003","85.019","0.003","1601.26","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H46 N4 O2 S4 -","- C29 H46 N4 O2 S4 -","- C58 H92 N8 O4 S8 -","2","1","","Luyi Zong; Yujun Xie; Can Wang; Jian-Rong Li; Qianqian Li; Zhen Li","From ACQ to AIE: the suppression of the strong pi-pi interaction of naphthalene diimide derivatives through the adjustment of their flexible chains","Chem.Commun.","2016","52","","11496","","","","","0.71073","MoKα","","0.0608","0.0517","","","0.1398","0.1537","","","","","","1.081","","","","has coordinates,has disorder","195781","2020-10-21","18:00:00",""
"7121007","14.0664","0.0012","27.41","0.002","9.4754","0.0007","90","","107.434","0.005","90","","3485.5","0.5","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H43 N3 O3 S2 -","- C37 H43 N3 O3 S2 -","- C148 H172 N12 O12 S8 -","4","1","","Chris L. Vonnegut; Airlia M. Shonkwiler; Lev N. Zakharov; Michael M. Haley; Darren W. Johnson","Harnessing solid-state packing for selective detection of chloride in a macrocyclic anionophore","Chemical Communications","2016","52","","9506","9509","10.1039/c6cc03795j","","","1.54178","CuKα","","0.0801","0.0556","","","0.1365","0.1504","","","","","","1.034","","","","has coordinates","204311","2020-10-21","18:00:00",""
"7121008","20.7737","0.0008","31.7155","0.0012","24.6016","0.001","90","","98.088","0.003","90","","16047.5","1.1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38.25 H44.5 Cl3.5 N3 O2 S2 -","- C38 H44 Cl3 N3 O2 S2 -","- C608 H704 Cl48 N48 O32 S32 -","16","4","","Chris L. Vonnegut; Airlia M. Shonkwiler; Lev N. Zakharov; Michael M. Haley; Darren W. Johnson","Harnessing solid-state packing for selective detection of chloride in a macrocyclic anionophore","Chemical Communications","2016","52","","9506","9509","10.1039/c6cc03795j","","","1.54178","CuKα","","0.1299","0.1091","","","0.328","0.353","","","","","","1.007","","","","has coordinates,has disorder","204312","2020-10-21","18:00:00",""
"7121015","9.6825","0.0004","10.3943","0.0005","11.758","0.0006","113.733","0.0012","102.543","0.0012","90.479","0.0012","1051.34","0.09","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C13 H54 N2 Na2 Ni O34 W6 -","- C13 H54 N2 Na2 Ni O34 W6 -","- C13 H54 N2 Na2 Ni O34 W6 -","1","0.5","","Nadiia I. Gumerova; Alexander Roller; Annette Rompel","[Ni(OH)3W6O18(OCH2)3CCH2OH]4-: the first tris-functionalized Anderson-type heteropolytungstate","Chemical Communications","2016","52","","9263","9266","10.1039/c6cc04326g","","","0.71073","MoKα","","0.0179","0.0179","","","0.0457","0.0457","","","","","","1.32","","","","has coordinates,has disorder","204351","2020-10-21","18:00:00",""
"7124582","9.4917","0.0007","18.4515","0.0014","16.3576","0.0012","90","","100.11","0.002","90","","2820.3","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","DAC-COPh-Cl-HCl Cation","","","- C31 H34 Cl2 N2 O3 -","- C31 H34 Cl2 N2 O3 -","- C124 H136 Cl8 N8 O12 -","4","1","","Deardorff, Cassie L.; Eric Sikma, R.; Rhodes, Christopher P.; Hudnall, Todd W.","Carbene-derived α-acyl formamidinium cations: organic molecules with readily tunable multiple redox processes.","Chemical communications (Cambridge, England)","2016","52","58","9024","9027","10.1039/c5cc06322a","","","0.71075","MoKα","","0.0392","0.0355","","","0.0844","0.0868","","","","","","1.011","","","","has coordinates","233415","2020-10-21","18:00:00",""
"7124583","10.4748","0.001","17.8218","0.0017","15.4388","0.0014","90","","105.179","0.007","90","","2781.6","0.5","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","MAAC-COPh-Cl Cation","","","- C31 H35 Cl N2 O2 -","- C31 H35 Cl N2 O2 -","- C124 H140 Cl4 N8 O8 -","4","1","","Deardorff, Cassie L.; Eric Sikma, R.; Rhodes, Christopher P.; Hudnall, Todd W.","Carbene-derived α-acyl formamidinium cations: organic molecules with readily tunable multiple redox processes.","Chemical communications (Cambridge, England)","2016","52","58","9024","9027","10.1039/c5cc06322a","","","0.71075","MoKα","","0.1093","0.057","","","0.0931","0.1093","","","","","","1.008","","","","has coordinates","233415","2020-10-21","18:00:00",""
"7124584","11.4742","0.0018","11.8275","0.0019","12.891","0.002","81.869","0.006","87.309","0.006","88.774","0.006","1729.8","0.5","223","2","223","2","","","","","","","","5","P -1","-P 1","2","IPr-COPh-Cl Cation","","","- C35 H43 Cl3 N2 O -","- C35 H43 Cl3 N2 O -","- C70 H86 Cl6 N4 O2 -","2","1","","Deardorff, Cassie L.; Eric Sikma, R.; Rhodes, Christopher P.; Hudnall, Todd W.","Carbene-derived α-acyl formamidinium cations: organic molecules with readily tunable multiple redox processes.","Chemical communications (Cambridge, England)","2016","52","58","9024","9027","10.1039/c5cc06322a","","","0.71075","MoKα","","0.1924","0.0786","","","0.1302","0.1685","","","","","","1.004","","","","has coordinates","233415","2020-10-21","18:00:00",""
"7124585","11.8892","0.001","16.2557","0.0014","13.7767","0.0012","90","","96.327","0.007","90","","2646.4","0.4","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DAC-COPh Radical","","","- C31 H33 N2 O3 -","- C31 H33 N2 O3 -","- C124 H132 N8 O12 -","4","1","","Deardorff, Cassie L.; Eric Sikma, R.; Rhodes, Christopher P.; Hudnall, Todd W.","Carbene-derived α-acyl formamidinium cations: organic molecules with readily tunable multiple redox processes.","Chemical communications (Cambridge, England)","2016","52","58","9024","9027","10.1039/c5cc06322a","","","0.71075","MoKα","","0.0788","0.0508","","","0.0875","0.0984","","","","","","1.004","","","","has coordinates","233415","2020-10-21","18:00:00",""
"7124586","9.3608","0.0013","11.0691","0.0002","13.0914","0.0009","90","","110.3","0.01","90","","1272.2","0.2","85","2","85","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Mercaptopurine Hemihydrate","","- C10 H10 N8 O S2 -","- C10 H10 N8 O S2 -","- C40 H40 N32 O4 S8 -","4","1","","Kersten, Kortney M.; Matzger, Adam J.","Improved pharmacokinetics of mercaptopurine afforded by a thermally robust hemihydrate.","Chemical communications (Cambridge, England)","2016","52","30","5281","5284","10.1039/c6cc00424e","","","1.54178","CuKα","","0.042","0.0391","","","0.1132","0.1154","","","","","","1.093","","","","has coordinates","233977","2020-10-21","18:00:00",""
"7124587","11.0573","0.0012","25.485","0.003","28.816","0.003","90","","90","","90","","8120.2","1.6","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C54 H40 N2 -","- C54 H40 N2 -","- C432 H320 N16 -","8","1","","Dai, Shengyu; Sui, Xuelin; Chen, Changle","Synthesis of high molecular weight polyethylene using iminopyridyl nickel catalysts.","Chemical communications (Cambridge, England)","2016","52","58","9113","9116","10.1039/c6cc00457a","","","0.71073","MoKα","","0.1135","0.0493","","","0.1173","0.1457","","","","","","1.02","","","","has coordinates","233979","2020-10-21","18:00:00",""
"7124588","11.398","0.006","11.272","0.005","16.887","0.008","90","","98.34","0.007","90","","2146.7","1.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H22 N2 O4 -","- C25 H22 N2 O4 -","- C100 H88 N8 O16 -","4","1","","Wang, Nan-Nan; Hao, Wen-Juan; Zhang, Tian-Shu; Li, Guigen; Wu, Ya-Nan; Tu, Shu-Jiang; Jiang, Bo","Metal-free C(sp(3))-H functionalization: oxidative carbo-oxygenation of α-diazo carbonyls via radical dediazotization.","Chemical communications (Cambridge, England)","2016","52","29","5144","5147","10.1039/c6cc00816j","","","0.71073","MoKα","","0.1179","0.0468","","","0.086","0.1049","","","","","","1.014","","","","has coordinates","233981","2020-10-21","18:00:00",""
"7124589","14.498","0.002","5.9876","0.0008","14.857","0.002","90","","103.208","0.007","90","","1255.6","0.3","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 O3 -","- C14 H16 O3 -","- C56 H64 O12 -","4","1","","Bankar, Siddheshwar K.; Mathew, Jopaul; Ramasastry, S. S. V.","Synthesis of benzofurans via an acid catalysed transacetalisation/Fries-type O →C rearrangement/Michael addition/ring-opening aromatisation cascade of β-pyrones.","Chemical communications (Cambridge, England)","2016","52","32","5569","5572","10.1039/c6cc01016d","","","0.71075","MoKα","","0.0688","0.0546","","","0.1515","0.1671","","","","","","1.0333","","","","has coordinates","233984","2020-10-21","18:00:00",""
"7124590","7.84","0.002","11.999","0.003","15.345","0.002","102.86","0.03","98.09","0.03","90.08","0.04","1392.5","0.6","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H30 Br2 O6 -","- C28 H30 Br2 O6 -","- C56 H60 Br4 O12 -","2","1","","Bankar, Siddheshwar K.; Mathew, Jopaul; Ramasastry, S. S. V.","Synthesis of benzofurans via an acid catalysed transacetalisation/Fries-type O →C rearrangement/Michael addition/ring-opening aromatisation cascade of β-pyrones.","Chemical communications (Cambridge, England)","2016","52","32","5569","5572","10.1039/c6cc01016d","","","0.71075","MoKα","","0.1231","0.077","","","0.2032","0.2399","","","","","","1.0101","","","","has coordinates","233984","2020-10-21","18:00:00",""
"7124591","8.931","0.004","10.538","0.005","28.633","0.013","90","","90","","90","","2695","2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H30 N2 O6 S -","- C27 H30 N2 O6 S -","- C108 H120 N8 O24 S4 -","4","1","","Zhang, Minmin; Yu, Shuowen; Hu, Fangzhi; Liao, Yijun; Liao, Lihua; Xu, Xiaoying; Yuan, Weicheng; Zhang, Xiaomei","Highly enantioselective [3+2] coupling of cyclic enamides with quinone monoimines promoted by a chiral phosphoric acid.","Chemical communications (Cambridge, England)","2016","52","56","8757","8760","10.1039/c6cc01200k","","","0.71073","MoKα","","0.0472","0.0416","","","0.1065","0.1094","","","","","","1.063","","","","has coordinates","233986","2020-10-21","18:00:00",""
"7124592","13.8539","0.0009","7.816","0.0005","15.243","0.001","90","","115.863","0.001","90","","1485.22","0.17","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H24 B N O2 -","- C15 H24 B N O2 -","- C60 H96 B4 N4 O8 -","4","1","","Légaré, Marc-André; Rochette, Étienne; Légaré Lavergne, Julien; Bouchard, Nicolas; Fontaine, Frédéric-Georges","Bench-stable frustrated Lewis pair chemistry: fluoroborate salts as precatalysts for the C-H borylation of heteroarenes.","Chemical communications (Cambridge, England)","2016","52","31","5387","5390","10.1039/c6cc01267a","","","0.71073","MoKα","","0.0537","0.0427","","","0.1166","0.1263","","","","","","1.015","","","","has coordinates","233988","2020-10-21","18:00:00",""
"7124593","7.6884","0.0007","13.7157","0.0012","15.1094","0.0013","90","","98.435","0.001","90","","1576.1","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 B F2 N O -","- C16 H26 B F2 N O -","- C64 H104 B4 F8 N4 O4 -","4","1","","Légaré, Marc-André; Rochette, Étienne; Légaré Lavergne, Julien; Bouchard, Nicolas; Fontaine, Frédéric-Georges","Bench-stable frustrated Lewis pair chemistry: fluoroborate salts as precatalysts for the C-H borylation of heteroarenes.","Chemical communications (Cambridge, England)","2016","52","31","5387","5390","10.1039/c6cc01267a","","","0.71073","MoKα","","0.0595","0.0447","","","0.117","0.128","","","","","","1.03","","","","has coordinates","233988","2020-10-21","18:00:00",""
"7124594","14.8666","0.0009","7.633","0.0005","14.4543","0.0009","90","","115.531","0.001","90","","1480.06","0.16","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H23 B F3 N -","- C15 H23 B F3 N -","- C60 H92 B4 F12 N4 -","4","1","","Légaré, Marc-André; Rochette, Étienne; Légaré Lavergne, Julien; Bouchard, Nicolas; Fontaine, Frédéric-Georges","Bench-stable frustrated Lewis pair chemistry: fluoroborate salts as precatalysts for the C-H borylation of heteroarenes.","Chemical communications (Cambridge, England)","2016","52","31","5387","5390","10.1039/c6cc01267a","","","0.71073","MoKα","","0.0659","0.0442","","","0.1359","0.1535","","","","","","1.003","","","","has coordinates","233988","2020-10-21","18:00:00",""
"7124595","11.6015","0.0019","12.822","0.002","13.428","0.002","90","","90","","90","","1997.5","0.5","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","6MACdippHCl","","","- C21 H32 Cl N O -","- C21 H32 Cl N O -","- C84 H128 Cl4 N4 O4 -","4","1","","McCarty, Zachary R.; Lastovickova, Dominika N.; Bielawski, Christopher W.","A cyclic (alkyl)(amido)carbene: synthesis, study and utility as a desulfurization reagent.","Chemical communications (Cambridge, England)","2016","52","31","5447","5450","10.1039/c6cc01376g","","","0.71075","MoKα","","0.0441","0.0406","","","0.1071","0.1096","","","","","","1.006","","","","has coordinates","233990","2020-10-21","18:00:00",""
"7124596","8.9044","0.0005","11.5431","0.0006","17.771","0.0008","90","","92.232","0.003","90","","1825.2","0.16","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","6MACdippCHinsertion","","","- C21 H31 N O -","- C21 H31 N O -","- C84 H124 N4 O4 -","4","1","","McCarty, Zachary R.; Lastovickova, Dominika N.; Bielawski, Christopher W.","A cyclic (alkyl)(amido)carbene: synthesis, study and utility as a desulfurization reagent.","Chemical communications (Cambridge, England)","2016","52","31","5447","5450","10.1039/c6cc01376g","","","0.71073","MoKα","","0.0464","0.0389","","","0.0984","0.1093","","","","","","1.006","","","","has coordinates","233990","2020-10-21","18:00:00",""
"7124597","8.6897","0.0005","29.0766","0.0018","10.8005","0.0007","90","","106.809","0.003","90","","2612.3","0.3","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","6MACdippCyclopropeneAdduct","","","- C31 H41 N O -","- C31 H41 N O -","- C124 H164 N4 O4 -","4","1","","McCarty, Zachary R.; Lastovickova, Dominika N.; Bielawski, Christopher W.","A cyclic (alkyl)(amido)carbene: synthesis, study and utility as a desulfurization reagent.","Chemical communications (Cambridge, England)","2016","52","31","5447","5450","10.1039/c6cc01376g","","","0.71073","MoKα","","0.055","0.0433","","","0.1186","0.1394","","","","","","1.006","","","","has coordinates","233990","2020-10-21","18:00:00",""
"7124598","15.8695","0.0019","11.8315","0.0013","14.6016","0.0017","90","","96.061","0.003","90","","2726.3","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","6MAC_IrCODCl","","","- C29 H43 Cl Ir N O -","- C29 H43 Cl Ir N O -","- C116 H172 Cl4 Ir4 N4 O4 -","4","1","","McCarty, Zachary R.; Lastovickova, Dominika N.; Bielawski, Christopher W.","A cyclic (alkyl)(amido)carbene: synthesis, study and utility as a desulfurization reagent.","Chemical communications (Cambridge, England)","2016","52","31","5447","5450","10.1039/c6cc01376g","","","0.71075","MoKα","","0.0351","0.0328","","","0.0897","0.0922","","","","","","1.006","","","","has coordinates","233990","2020-10-21","18:00:00",""
"7124599","19.8011","0.0002","14.62079","0.00012","21.27781","0.00015","90","","90","","90","","6160.09","0.09","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Sm(hfac)3(boaDTDA)]n","","","- C23 H7 F18 N3 O7 S2 Sm -","- C23 H7 F18 N3 O7 S2 Sm -","- C184 H56 F144 N24 O56 S16 Sm8 -","8","1","","Fatila, Elisabeth M.; Maahs, Adam C.; Mills, Michelle B.; Rouzières, Mathieu; Soldatov, Dmitriy V.; Clérac, Rodolphe; Preuss, Kathryn E.","Ferromagnetic ordering of -[Sm(iii)-radical]n- coordination polymers.","Chemical communications (Cambridge, England)","2016","52","31","5414","5417","10.1039/c6cc01548d","","","0.71073","MoKα","","0.0723","0.0426","","","0.0885","0.1041","","","","","","1.168","","","","has coordinates,has disorder","233994","2020-10-21","18:00:00",""
"7124600","19.9769","0.0002","14.811","0.00016","21.41308","0.00019","90","","90","","90","","6335.66","0.11","200","2","200","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Sm(hfac)3(boaDTDA)]n","","","- C23 H7 F18 N3 O7 S2 Sm -","- C23 H7 F18 N3 O7 S2 Sm -","- C184 H56 F144 N24 O56 S16 Sm8 -","8","1","","Fatila, Elisabeth M.; Maahs, Adam C.; Mills, Michelle B.; Rouzières, Mathieu; Soldatov, Dmitriy V.; Clérac, Rodolphe; Preuss, Kathryn E.","Ferromagnetic ordering of -[Sm(iii)-radical]n- coordination polymers.","Chemical communications (Cambridge, England)","2016","52","31","5414","5417","10.1039/c6cc01548d","","","0.71073","MoKα","","0.0596","0.0369","","","0.0974","0.1108","","","","","","1.106","","","","has coordinates,has disorder","233994","2020-10-21","18:00:00",""
"7124601","20.0503","0.0002","14.9396","0.0002","21.463","0.0002","90","","90","","90","","6429.1","0.12","250","2","250","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Sm(hfac)3(boaDTDA)]n","","","- C23 H7 F18 N3 O7 S2 Sm -","- C23 H7 F18 N3 O7 S2 Sm -","- C184 H56 F144 N24 O56 S16 Sm8 -","8","1","","Fatila, Elisabeth M.; Maahs, Adam C.; Mills, Michelle B.; Rouzières, Mathieu; Soldatov, Dmitriy V.; Clérac, Rodolphe; Preuss, Kathryn E.","Ferromagnetic ordering of -[Sm(iii)-radical]n- coordination polymers.","Chemical communications (Cambridge, England)","2016","52","31","5414","5417","10.1039/c6cc01548d","","","0.71073","MoKα","","0.0739","0.0412","","","0.0997","0.1179","","","","","","1.099","","","","has coordinates,has disorder","233994","2020-10-21","18:00:00",""
"7124602","20.1162","0.0002","15.14532","0.00019","21.5437","0.0002","90","","90","","90","","6563.64","0.12","300","2","300","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Sm(hfac)3(boaDTDA)]n","","","- C23 H7 F18 N3 O7 S2 Sm -","- C23 H7 F18 N3 O7 S2 Sm -","- C184 H56 F144 N24 O56 S16 Sm8 -","8","1","","Fatila, Elisabeth M.; Maahs, Adam C.; Mills, Michelle B.; Rouzières, Mathieu; Soldatov, Dmitriy V.; Clérac, Rodolphe; Preuss, Kathryn E.","Ferromagnetic ordering of -[Sm(iii)-radical]n- coordination polymers.","Chemical communications (Cambridge, England)","2016","52","31","5414","5417","10.1039/c6cc01548d","","","0.71073","MoKα","","0.069","0.0409","","","0.1042","0.1222","","","","","","1.094","","","","has coordinates,has disorder","233994","2020-10-21","18:00:00",""
"7124603","19.85308","0.00016","14.68673","0.0001","21.32145","0.00013","90","","90","","90","","6216.84","0.08","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[Sm(hfac)3(boaDTDA)]n","","","- C23 H7 F18 N3 O7 S2 Sm -","- C23 H7 F18 N3 O7 S2 Sm -","- C184 H56 F144 N24 O56 S16 Sm8 -","8","1","","Fatila, Elisabeth M.; Maahs, Adam C.; Mills, Michelle B.; Rouzières, Mathieu; Soldatov, Dmitriy V.; Clérac, Rodolphe; Preuss, Kathryn E.","Ferromagnetic ordering of -[Sm(iii)-radical]n- coordination polymers.","Chemical communications (Cambridge, England)","2016","52","31","5414","5417","10.1039/c6cc01548d","","","0.71073","MoKα","","0.0471","0.0268","","","0.0557","0.0626","","","","","","1.084","","","","has coordinates,has disorder","233994","2020-10-21","18:00:00",""
"7124604","12.4093","0.0004","13.1987","0.0002","18.3557","0.0004","79.4323","0.0017","76.229","0.002","84.6926","0.0019","2866.71","0.12","122.9","0.2","123","1","","","","","","","","5","P -1","-P 1","2","{[CpNi(IMes)]2P4}1.5(tol)","1","","- C62.5 H70 N4 Ni2 P4 -","- C62.5 H70 N4 Ni2 P4 -","- C125 H140 N8 Ni4 P8 -","2","1","","Pelties, Stefan; Ehlers, Andreas W.; Wolf, Robert","Insertion of phenyl isothiocyanate into a P-P bond of a nickel-substituted bicyclo[1.1.0]tetraphosphabutane.","Chemical communications (Cambridge, England)","2016","52","39","6601","6604","10.1039/c6cc01572g","","x-ray","1.54184","CuKα","","0.0426","0.0379","","","0.0966","0.1006","","","","","","1.03","","","","has coordinates,has disorder","233995","2020-10-21","18:00:00",""
"7124605","13.6251","0.0004","14.0607","0.0003","19.7007","0.0005","99.8667","0.0019","99.819","0.002","98.0922","0.0019","3607.33","0.17","122.8","0.7","123","1","","","","","","","","6","P -1","-P 1","2","[CpNi(IMes)]2(P4SCNPh)](tol)2.5","2a","","- C76.5 H83 N5 Ni2 P4 S -","- C76.5 H83 N5 Ni2 P4 S -","- C153 H166 N10 Ni4 P8 S2 -","2","1","","Pelties, Stefan; Ehlers, Andreas W.; Wolf, Robert","Insertion of phenyl isothiocyanate into a P-P bond of a nickel-substituted bicyclo[1.1.0]tetraphosphabutane.","Chemical communications (Cambridge, England)","2016","52","39","6601","6604","10.1039/c6cc01572g","","x-ray","1.54184","CuKα","","0.0845","0.0753","","","0.2095","0.2185","","","","","","1.05","","","","has coordinates,has disorder","233995","2020-10-21","18:00:00",""
"7124606","12.4533","0.0002","15.594","0.0003","19.3068","0.0003","104.227","0.0014","103.128","0.0014","106.371","0.0016","3305.15","0.11","123.01","0.1","123","1","","","","","","","","6","P -1","-P 1","2","[CpNi(IMes)]2(P4C(S)NPh)](tol)2","2b","","- C73 H79 N5 Ni2 P4 S -","- C73 H79 N5 Ni2 P4 S -","- C146 H158 N10 Ni4 P8 S2 -","2","1","","Pelties, Stefan; Ehlers, Andreas W.; Wolf, Robert","Insertion of phenyl isothiocyanate into a P-P bond of a nickel-substituted bicyclo[1.1.0]tetraphosphabutane.","Chemical communications (Cambridge, England)","2016","52","39","6601","6604","10.1039/c6cc01572g","","x-ray","1.54184","CuKα","","0.0721","0.0574","","","0.1647","0.1792","","","","","","1.032","","","","has coordinates,has disorder","233995","2020-10-21","18:00:00",""
"7124607","14.3392","0.0007","22.0014","0.0011","16.1601","0.0009","90","","107.299","0.002","90","","4867.6","0.4","149","2","149","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H38 Al B F20 N2 -","- C51 H38 Al B F20 N2 -","- C204 H152 Al4 B4 F80 N8 -","4","1","","Cao, Levy L.; Daley, Erika; Johnstone, Timothy C.; Stephan, Douglas W.","Cationic aluminum hydride complexes: reactions of carbene-alane adducts with trityl-borate.","Chemical communications (Cambridge, England)","2016","52","30","5305","5307","10.1039/c6cc01585a","","","0.71073","MoKα","","0.1286","0.0499","","","0.0917","0.1118","","","","","","0.998","","","","has coordinates","233997","2020-10-21","18:00:00",""
"7124608","11.8284","0.001","11.5141","0.001","12.6491","0.0011","90","","113.135","0.004","90","","1584.2","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 Al N2 -","- C17 H19 Al N2 -","- C68 H76 Al4 N8 -","4","1","","Cao, Levy L.; Daley, Erika; Johnstone, Timothy C.; Stephan, Douglas W.","Cationic aluminum hydride complexes: reactions of carbene-alane adducts with trityl-borate.","Chemical communications (Cambridge, England)","2016","52","30","5305","5307","10.1039/c6cc01585a","","","0.71073","MoKα","","0.0632","0.0402","","","0.0901","0.1003","","","","","","1.011","","","","has coordinates","233997","2020-10-21","18:00:00",""
"7124609","12.4696","0.001","13.5438","0.001","23.9484","0.0019","89.208","0.004","88.213","0.004","79.504","0.004","3974.8","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C88 H38 Al B2 Br F40 N4 -","- C88 H38 Al B2 Br F40 N4 -","- C176 H76 Al2 B4 Br2 F80 N8 -","2","1","","Cao, Levy L.; Daley, Erika; Johnstone, Timothy C.; Stephan, Douglas W.","Cationic aluminum hydride complexes: reactions of carbene-alane adducts with trityl-borate.","Chemical communications (Cambridge, England)","2016","52","30","5305","5307","10.1039/c6cc01585a","","","0.71073","MoKα","","0.12","0.074","","","0.2112","0.2421","","","","","","1.028","","","","has coordinates","233997","2020-10-21","18:00:00",""
"7124610","5.9605","0.0006","32.909","0.003","7.1915","0.0007","90","","91.991","0.003","90","","1409.8","0.2","90","0.2","90","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","C17H15BrO2","(Z)-(3-(4-Bromobenzylidene)-2-methyl-2,3-dihydrobenzofuran-2-yl)methanol","","- C17 H15 Br O2 -","- C17 H15 Br O2 -","- C68 H60 Br4 O8 -","4","2","","Kondoh, Azusa; Tran, Hoa Thi Quynh; Kimura, Kyoko; Terada, Masahiro","Enantioselective intramolecular cyclization of alkynyl esters catalyzed by a chiral Brønsted base.","Chemical communications (Cambridge, England)","2016","52","33","5726","5729","10.1039/c6cc01690a","","","1.54178","CuKα","","0.0226","0.0225","","","0.0575","0.0575","","","","","","1.075","","","","has coordinates","233999","2020-10-21","18:00:00",""
"7124611","17.181","0.002","26.757","0.003","21.323","0.003","90","","96.526","0.004","90","","9739","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H27 N3 O3 -","- C29 H27 N3 O3 -","- C464 H432 N48 O48 -","16","4","","Selvaraju, Manikandan; Ye, Tzuen-Yang; Li, Chia-Hsin; Ho, Pei-Heng; Sun, Chung-Ming","Copper catalyzed aerobic oxidative cyclization and ketonization: one pot synthesis of benzoimidazo[1,2-a]imidazolones.","Chemical communications (Cambridge, England)","2016","52","39","6621","6624","10.1039/c6cc01828a","","","0.71073","MoKα","","0.2285","0.0937","","","0.2148","0.3196","","","","","","0.979","","","","has coordinates","234000","2020-10-21","18:00:00",""
"7124612","11.6428","0.001","13.6677","0.0012","14.1795","0.0012","84.481","0.003","68.11","0.002","72.003","0.003","1990.8","0.3","120","2","120","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H44 Cl6 Cu N4 O4 -","- C36 H44 Cl6 Cu N4 O4 -","- C72 H88 Cl12 Cu2 N8 O8 -","2","1","","Gautam, R.; Chang, T. M.; Astashkin, A. V.; Lincoln, K. M.; Tomat, E.","Propentdyopent: the scaffold of a heme metabolite as an electron reservoir in transition metal complexes.","Chemical communications (Cambridge, England)","2016","52","39","6585","6588","10.1039/c6cc01961g","","x-ray","0.71073","MoKα","","0.1004","0.0556","","","0.1305","0.1517","","","","","","1.086","","","","has coordinates","234005","2020-10-21","18:00:00",""
"7124613","11.175","0.003","11.683","0.003","14.705","0.003","92.05","0.005","105.445","0.005","110.322","0.006","1717.8","0.7","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C37 H44 N4 O4 Zn -","- C37 H44 N4 O4 Zn -","- C74 H88 N8 O8 Zn2 -","2","1","","Gautam, R.; Chang, T. M.; Astashkin, A. V.; Lincoln, K. M.; Tomat, E.","Propentdyopent: the scaffold of a heme metabolite as an electron reservoir in transition metal complexes.","Chemical communications (Cambridge, England)","2016","52","39","6585","6588","10.1039/c6cc01961g","","x-ray","0.71073","MoKα","","0.0638","0.0379","","","0.0726","0.0808","","","","","","1.009","","","","has coordinates,has disorder","234005","2020-10-21","18:00:00",""
"7124614","17.3525","0.0011","13.834","0.0009","14.8976","0.0009","90","","102.894","0.003","90","","3486.1","0.4","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H44 Cl2 Co N4 O4 -","- C35 H44 Cl2 Co N4 O4 -","- C140 H176 Cl8 Co4 N16 O16 -","4","0.5","","Gautam, R.; Chang, T. M.; Astashkin, A. V.; Lincoln, K. M.; Tomat, E.","Propentdyopent: the scaffold of a heme metabolite as an electron reservoir in transition metal complexes.","Chemical communications (Cambridge, England)","2016","52","39","6585","6588","10.1039/c6cc01961g","","x-ray","0.71073","MoKα","","0.0755","0.0476","","","0.1055","0.116","","","","","","1.034","","","","has coordinates,has disorder","234005","2020-10-21","18:00:00",""
"7124615","12.2982","0.0007","14.0284","0.0007","14.0382","0.0008","76.426","0.002","67.944","0.002","64.685","0.002","2021.2","0.2","100","","99.69","","","","","","","","","7","P -1","-P 1","2","","","","- C36 H42 Cl6 D2 N4 Ni O4 -","- C36 H42 Cl6 D2 N4 Ni O4 -","- C72 H84 Cl12 D4 N8 Ni2 O8 -","2","1","","Gautam, R.; Chang, T. M.; Astashkin, A. V.; Lincoln, K. M.; Tomat, E.","Propentdyopent: the scaffold of a heme metabolite as an electron reservoir in transition metal complexes.","Chemical communications (Cambridge, England)","2016","52","39","6585","6588","10.1039/c6cc01961g","","x-ray","0.71073","MoKα","","0.0849","0.0503","","","0.101","0.1101","","","","","","1.054","","","","has coordinates","234005","2020-10-21","18:00:00",""
"7124616","32.8826","0.0006","30.1786","0.0006","40.0732","0.0008","90","","96.498","0.001","90","","39511.2","1.3","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C342 H280 B16 Co8 F64 N72 O3.5 P -","- C342 H279 B12 Co8 F48 N72 O3.5 P -","- C1368 H1116 B48 Co32 F192 N288 O14 P4 -","4","0.5","","Taylor, Christopher G. P.; Piper, Jerico R.; Ward, Michael D.","Binding of chemical warfare agent simulants as guests in a coordination cage: contributions to binding and a fluorescence-based response.","Chemical communications (Cambridge, England)","2016","52","37","6225","6228","10.1039/c6cc02021f","","","1.54178","CuKα","","0.1379","0.1143","","","0.3583","0.3782","","","","","","1.561","","","","has coordinates,has disorder","234010","2020-10-21","18:00:00",""
"7124617","32.7148","0.001","29.7919","0.0008","39.8554","0.0011","90","","96.733","0.002","90","","38576.6","1.9","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C343 H281 B16 Co8 F64 N72 O3 P -","- C343 H281 B13 Co8 F52 N72 O3 P -","- C1372 H1124 B52 Co32 F208 N288 O12 P4 -","4","0.5","","Taylor, Christopher G. P.; Piper, Jerico R.; Ward, Michael D.","Binding of chemical warfare agent simulants as guests in a coordination cage: contributions to binding and a fluorescence-based response.","Chemical communications (Cambridge, England)","2016","52","37","6225","6228","10.1039/c6cc02021f","","","0.71073","MoKα","","0.2367","0.1335","","","0.377","0.432","","","","","","1.284","","","","has coordinates,has disorder","234010","2020-10-21","18:00:00",""
"7124618","27.477","0.004","39.201","0.006","41.992","0.007","90","","107.133","0.005","90","","43223","12","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C366 H330 B16 Co8 F64 N72 O30 P2 -","- C366 H306 B9 Co8 F36 N72 O30.0002 P2 -","- C1464 H1224 B36 Co32 F144 N288 O120.001 P8 -","4","0.5","","Taylor, Christopher G. P.; Piper, Jerico R.; Ward, Michael D.","Binding of chemical warfare agent simulants as guests in a coordination cage: contributions to binding and a fluorescence-based response.","Chemical communications (Cambridge, England)","2016","52","37","6225","6228","10.1039/c6cc02021f","","","0.71073","MoKα","","0.3021","0.1481","","","0.4181","0.4972","","","","","","1.403","","","","has coordinates,has disorder","234010","2020-10-21","18:00:00",""
"7124619","12.0691","0.0008","21.178","0.0013","20.726","0.0012","90","","105.081","0.005","90","","5115.1","0.6","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","A1/A2-Diethynylbenzene functionalized Pillar[5]arene","","","- C60 H56 Cl2 O8 -","- C60 H56 Cl2 O8 -","- C240 H224 Cl8 O32 -","4","0.5","","Ma, Yingjie; Chen, Long; Li, Chen; Müllen, Klaus","A fishing rod-like conjugated polymer bearing pillar[5]arenes.","Chemical communications (Cambridge, England)","2016","52","40","6662","6664","10.1039/c6cc02059c","","","0.71073","MoKα","","0.1083","0.0584","","","0.1455","0.1774","","","","","","1.045","","","","has coordinates,has disorder","234014","2020-10-21","18:00:00",""
"7124620","9.6363","0.0004","10.354","0.0004","10.4978","0.0004","107.019","0.001","113.605","0.001","91.585","0.001","905.11","0.06","100","2","100","2","","","","","","","","4","P 1","P 1","1","(BDI)Nb(NtBu)Ph","","","- C39 H54 N3 Nb -","- C39 H54 N3 Nb -","- C39 H54 N3 Nb -","1","1","","Camp, Clément; Grant, Lauren N.; Bergman, Robert G.; Arnold, John","Photo-activation of d(0) niobium imido azides: en route to nitrido complexes.","Chemical communications (Cambridge, England)","2016","52","32","5538","5541","10.1039/c6cc02081j","","","0.71073","mokα","","0.0412","0.0393","","","0.0773","0.0786","","","","","","1.057","","","","has coordinates","234016","2020-10-21","18:00:00",""
"7124621","11.649","0.0006","18.9555","0.001","17.0768","0.0009","90","","97.526","0.002","90","","3738.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C39 H55 N6 Nb -","- C39 H55 N6 Nb -","- C156 H220 N24 Nb4 -","4","1","","Camp, Clément; Grant, Lauren N.; Bergman, Robert G.; Arnold, John","Photo-activation of d(0) niobium imido azides: en route to nitrido complexes.","Chemical communications (Cambridge, England)","2016","52","32","5538","5541","10.1039/c6cc02081j","","","0.71073","MoKα","","0.06","0.04","","","0.0744","0.0824","","","","","","1.071","","","","has coordinates","234016","2020-10-21","18:00:00",""
"7124622","12.4801","0.0005","13.772","0.0005","19.2824","0.0008","90","","90","","90","","3314.2","0.2","100","2","100","2","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C38 H49 N3 Nb -","- C38 H49 N3 Nb -","- C152 H196 N12 Nb4 -","4","0.5","","Camp, Clément; Grant, Lauren N.; Bergman, Robert G.; Arnold, John","Photo-activation of d(0) niobium imido azides: en route to nitrido complexes.","Chemical communications (Cambridge, England)","2016","52","32","5538","5541","10.1039/c6cc02081j","","","0.71073","MoKα","","0.0426","0.0406","","","0.0969","0.0988","","","","","","1.097","","","","has coordinates","234016","2020-10-21","18:00:00",""
"7124623","12.5396","0.0009","17.4757","0.0011","29.99","0.002","84.127","0.003","82.987","0.003","73.602","0.003","6241.6","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C67 H72 B F15 N5 Nb -","- C67 H72 B F15 N5 Nb -","- C268 H288 B4 F60 N20 Nb4 -","4","2","","Camp, Clément; Grant, Lauren N.; Bergman, Robert G.; Arnold, John","Photo-activation of d(0) niobium imido azides: en route to nitrido complexes.","Chemical communications (Cambridge, England)","2016","52","32","5538","5541","10.1039/c6cc02081j","","","0.71073","MoKα","","0.1424","0.0799","","","0.1818","0.2127","","","","","","1.025","","","","has coordinates,has disorder","234016","2020-10-21","18:00:00",""
"7124624","12.2684","0.0005","12.7008","0.0005","19.2268","0.0008","79.4526","0.0019","83.1067","0.0017","68.923","0.0016","2743.4","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H55 B F15 N6 Nb -","- C57 H55 B F15 N6 Nb -","- C114 H110 B2 F30 N12 Nb2 -","2","1","","Camp, Clément; Grant, Lauren N.; Bergman, Robert G.; Arnold, John","Photo-activation of d(0) niobium imido azides: en route to nitrido complexes.","Chemical communications (Cambridge, England)","2016","52","32","5538","5541","10.1039/c6cc02081j","","","0.71073","MoKα","","0.0366","0.0311","","","0.0713","0.0749","","","","","","1.06","","","","has coordinates","234016","2020-10-21","18:00:00",""
"7124625","19.3473","0.0005","22.4336","0.0007","25.5172","0.0009","90","","90","","90","","11075.2","0.6","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","[Nb(BDI)(NPhtBu)(NB(C6F5)3)].(toluene)0.5","","","- C121 H118 B2 F30 N8 Nb2 -","- C121 H118 B2 F30 N8 Nb2 -","- C484 H472 B8 F120 N32 Nb8 -","4","0.5","","Camp, Clément; Grant, Lauren N.; Bergman, Robert G.; Arnold, John","Photo-activation of d(0) niobium imido azides: en route to nitrido complexes.","Chemical communications (Cambridge, England)","2016","52","32","5538","5541","10.1039/c6cc02081j","","","0.71073","MoKα","","0.053","0.036","","","0.0801","0.0905","","","","","","1.059","","","","has coordinates,has disorder","288501","2023-12-22","13:20:51",""
"7124626","12.6421","0.0009","14.2612","0.001","17.0125","0.0011","90.192","0.003","96.38","0.003","113.941","0.003","2782","0.3","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H32 Cu3 N12 O16 -","- C15 H32 Cu3 N12 O16 -","- C60 H128 Cu12 N48 O64 -","4","2","","Kennedy, Zachary C.; Cardenas, Allan Jay P.; Corbey, Jordan F.; Warner, Marvin G.","2,6-Diiminopiperidin-1-ol: an overlooked motif relevant to uranyl and transition metal binding on poly(amidoxime) adsorbents.","Chemical communications (Cambridge, England)","2016","52","57","8802","8805","10.1039/c6cc02488b","","","0.71073","MoKα","","0.0364","0.0273","","","0.0651","0.071","","","","","","1.062","","","","has coordinates,has disorder","234027","2020-10-21","18:00:00",""
"7124627","17.1605","0.0012","13.4761","0.001","14.8097","0.0011","90","","111.774","0.004","90","","3180.5","0.4","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H44 Cl3 N9 Ni3 O13 -","- C15 H44 Cl3 N9 Ni3 O13 -","- C60 H176 Cl12 N36 Ni12 O52 -","4","1","","Kennedy, Zachary C.; Cardenas, Allan Jay P.; Corbey, Jordan F.; Warner, Marvin G.","2,6-Diiminopiperidin-1-ol: an overlooked motif relevant to uranyl and transition metal binding on poly(amidoxime) adsorbents.","Chemical communications (Cambridge, England)","2016","52","57","8802","8805","10.1039/c6cc02488b","","","0.71073","MoKα","","0.0351","0.0294","","","0.0733","0.0765","","","","","","1.027","","","","has coordinates,has disorder","234027","2020-10-21","18:00:00",""
"7124628","8.3529","0.0004","21.2854","0.0008","8.9198","0.0004","90","","111.884","0.0015","90","","1471.61","0.11","568","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H32 N8 O14 U2 -","- C18 H32 N8 O14 U2 -","- C36 H64 N16 O28 U4 -","2","0.5","","Kennedy, Zachary C.; Cardenas, Allan Jay P.; Corbey, Jordan F.; Warner, Marvin G.","2,6-Diiminopiperidin-1-ol: an overlooked motif relevant to uranyl and transition metal binding on poly(amidoxime) adsorbents.","Chemical communications (Cambridge, England)","2016","52","57","8802","8805","10.1039/c6cc02488b","","","0.71073","MoKα","","0.0375","0.0336","","","0.0759","0.0778","","","","","","1.21","","","","has coordinates,has disorder","234027","2020-10-21","18:00:00",""
"7124629","14.4081","0.0009","22.6704","0.0015","19.5045","0.0014","90","","109.072","0.002","90","","6021.2","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H32 F2 I N O4 S -","- C31 H32 F2 I N O4 S -","- C248 H256 F16 I8 N8 O32 S8 -","8","2","","Yu, Liu-Zhu; Zhu, Zi-Zhong; Hu, Xu-Bo; Tang, Xiang-Ying; Shi, Min","Palladium-catalyzed cascade cyclization of allylamine-tethered alkylidenecyclopropanes: facile access to iodine/difluoromethylene- and perfluoroalkyl-containing 1-benzazepine scaffolds.","Chemical communications (Cambridge, England)","2016","52","39","6581","6584","10.1039/c6cc02496c","","","0.71073","MoKα","","0.0846","0.0524","","","0.1316","0.1511","","","","","","1.023","","","","has coordinates,has disorder","234030","2020-10-21","18:00:00",""
"7124630","9.9138","0.0003","10.3236","0.0003","13.6951","0.0004","76.806","0.002","71.844","0.002","82.615","0.002","1294.2","0.07","149","2","148.8","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H36 B F2 P -","- C30 H36 B F2 P -","- C60 H72 B2 F4 P2 -","2","1","","Möbus, Juri; Vom Stein, Thorsten; Stephan, Douglas W.","Cooperative Lewis acidity in borane-substituted fluorophosphonium cations.","Chemical communications (Cambridge, England)","2016","52","38","6387","6390","10.1039/c6cc02607a","","","0.71073","MoKα","","0.0514","0.0409","","","0.1038","0.1127","","","","","","1.0467","","","","has coordinates","234034","2020-10-21","18:00:00",""
"7124631","10.7299","0.0005","19.7985","0.0008","12.1281","0.0005","90","","95.89","0.002","90","","2562.84","0.19","150","2","150.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C54 H32 B2 F25 P -","- C54 H32 B2 F25 P -","- C108 H64 B4 F50 P2 -","2","1","","Möbus, Juri; Vom Stein, Thorsten; Stephan, Douglas W.","Cooperative Lewis acidity in borane-substituted fluorophosphonium cations.","Chemical communications (Cambridge, England)","2016","52","38","6387","6390","10.1039/c6cc02607a","","","0.71073","MoKα","","0.069","0.0457","","","0.0892","0.0992","","","","","","1.0045","","","","has coordinates","234034","2020-10-21","18:00:00",""
"7124632","11.4351","0.0008","9.5654","0.0005","24.6131","0.0017","90","","92.863","0.003","90","","2688.9","0.3","150","2","150.03","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H32 B F6 P -","- C30 H32 B F6 P -","- C120 H128 B4 F24 P4 -","4","1","","Möbus, Juri; Vom Stein, Thorsten; Stephan, Douglas W.","Cooperative Lewis acidity in borane-substituted fluorophosphonium cations.","Chemical communications (Cambridge, England)","2016","52","38","6387","6390","10.1039/c6cc02607a","","","0.71073","MoKα","","0.0806","0.0455","","","0.0904","0.1062","","","","","","1.0406","","","","has coordinates","234034","2020-10-21","18:00:00",""
"7124633","9.9916","0.0011","15.7747","0.0018","16.8287","0.0019","86.925","0.006","79.345","0.006","75.871","0.006","2527.8","0.5","149","2","149","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H36 B2 F21 P -","- C54 H36 B2 F21 P -","- C108 H72 B4 F42 P2 -","2","1","","Möbus, Juri; Vom Stein, Thorsten; Stephan, Douglas W.","Cooperative Lewis acidity in borane-substituted fluorophosphonium cations.","Chemical communications (Cambridge, England)","2016","52","38","6387","6390","10.1039/c6cc02607a","","","0.71073","MoKα","","0.0669","0.0399","","","0.0872","0.0976","","","","","","1.031","","","","has coordinates","234034","2020-10-21","18:00:00",""
"7124634","8.9638","0.0018","10.52","0.002","11.467","0.002","90","","109.75","0.03","90","","1017.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 N O2 -","- C11 H13 N O2 -","- C44 H52 N4 O8 -","4","1","","Tang, Baolei; Liu, Huapeng; Li, Feng; Wang, Yue; Zhang, Hongyu","Single-benzene solid emitters with lasing properties based on aggregation-induced emissions.","Chemical communications (Cambridge, England)","2016","52","39","6577","6580","10.1039/c6cc02616h","","","0.71073","MoKα","","0.0608","0.0509","","","0.149","0.1583","","","","","","1.083","","","","has coordinates","234037","2020-10-21","18:00:00",""
"7124635","7.7034","0.0015","22.119","0.004","12.573","0.003","90","","105.27","0.03","90","","2066.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 F N O2 -","- C11 H12 F N O2 -","- C88 H96 F8 N8 O16 -","8","2","","Tang, Baolei; Liu, Huapeng; Li, Feng; Wang, Yue; Zhang, Hongyu","Single-benzene solid emitters with lasing properties based on aggregation-induced emissions.","Chemical communications (Cambridge, England)","2016","52","39","6577","6580","10.1039/c6cc02616h","","","0.71073","MoKα","","0.0714","0.0486","","","0.1271","0.1391","","","","","","0.979","","","","has coordinates","234037","2020-10-21","18:00:00",""
"7124636","7.4266","0.0015","11.889","0.002","13.141","0.003","90","","102.2","0.03","90","","1134.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","1","","Tang, Baolei; Liu, Huapeng; Li, Feng; Wang, Yue; Zhang, Hongyu","Single-benzene solid emitters with lasing properties based on aggregation-induced emissions.","Chemical communications (Cambridge, England)","2016","52","39","6577","6580","10.1039/c6cc02616h","","","0.71073","MoKα","","0.0606","0.047","","","0.1311","0.1486","","","","","","1.039","","","","has coordinates","234037","2020-10-21","18:00:00",""
"7124637","9.0682","0.0018","10.39","0.002","11.58","0.002","90","","109.17","0.03","90","","1030.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 F N O2 -","- C11 H12 F N O2 -","- C44 H48 F4 N4 O8 -","4","1","","Tang, Baolei; Liu, Huapeng; Li, Feng; Wang, Yue; Zhang, Hongyu","Single-benzene solid emitters with lasing properties based on aggregation-induced emissions.","Chemical communications (Cambridge, England)","2016","52","39","6577","6580","10.1039/c6cc02616h","","","0.71073","MoKα","","0.0653","0.0528","","","0.1456","0.1566","","","","","","1.082","","","","has coordinates","234037","2020-10-21","18:00:00",""
"7124638","16.1244","0.0015","17.6398","0.0017","17.7651","0.0019","65.152","0.002","64.342","0.002","81.391","0.004","4129.8","0.7","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C158 H178 Au24 Pd S18 -","- C158 H178 Au24 Pd S18 -","- C158 H178 Au24 Pd S18 -","1","0.5","","Tian, Shubo; Liao, Lingwen; Yuan, Jinyun; Yao, Chuanhao; Chen, Jishi; Yang, Jinlong; Wu, Zhikun","Structures and magnetism of mono-palladium and mono-platinum doped Au25(PET)18 nanoclusters.","Chemical communications (Cambridge, England)","2016","52","64","9873","9876","10.1039/c6cc02698b","","","0.71073","MoKα","","0.0727","0.0394","","","0.0724","0.081","","","","","","1.049","","","","has coordinates","234044","2020-10-21","18:00:00",""
"7124639","16.19","0.0018","17.714","0.0012","17.8666","0.0011","65.106","0.002","64.289","0.002","81.343","0.002","4184.5","0.6","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C158 H178 Au24 Pt S18 -","- C158 H178 Au24 Pt S18 -","- C158 H178 Au24 Pt S18 -","1","0.5","","Tian, Shubo; Liao, Lingwen; Yuan, Jinyun; Yao, Chuanhao; Chen, Jishi; Yang, Jinlong; Wu, Zhikun","Structures and magnetism of mono-palladium and mono-platinum doped Au25(PET)18 nanoclusters.","Chemical communications (Cambridge, England)","2016","52","64","9873","9876","10.1039/c6cc02698b","","","0.71073","MoKα","","0.0339","0.0298","","","0.0748","0.0752","","","","","","1.082","","","","has coordinates","234044","2020-10-21","18:00:00",""
"7124640","25.569","0.007","25.569","0.007","16.707","0.006","90","","90","","90","","10923","6","113","2","113","2","","","","","","","","5","P 42/m b c","-P 4c 2ab","135","","","","- C44 H42 Co4 N4 O14 -","- C44 H42 Co4 N4 O14 -","- C352 H336 Co32 N32 O112 -","8","0.5","","Su, Lei; Song, Wei-Chao; Zhao, Jiong-Peng; Liu, Fu-Chen","Crystal engineering to control the magnetic interaction between weak ferromagnetic single-chain magnets assembled in a 3D framework.","Chemical communications (Cambridge, England)","2016","52","56","8722","8725","10.1039/c6cc02702d","","","0.71073","MoKα","","0.0558","0.0482","","","0.1415","0.148","","","","","","1.04","","","","has coordinates,has disorder","234045","2020-10-21","18:00:00",""
"7124641","19.3263","0.0009","9.6193","0.0004","25.4228","0.0011","90","","108.384","0.005","90","","4485","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H51 Cl3 Co N2 O2 S2 -","- C43 H51 Cl3 Co N2 O2 S2 -","- C172 H204 Cl12 Co4 N8 O8 S8 -","4","1","","Sarkar, Prasenjit; Tiwari, Archana; Sarmah, Amrit; Bhandary, Subhrajyoti; Roy, Ram Kinkar; Mukherjee, Chandan","An elusive vinyl radical isolated as an appended unit in a five-coordinate Co(iii)-bis(iminobenzosemiquinone) complex formed via ligand-centered C-S bond cleavage.","Chemical communications (Cambridge, England)","2016","52","70","10613","10616","10.1039/c6cc02751b","","","0.71073","MoKα","","0.0829","0.0577","","","0.1491","0.1653","","","","","","1.035","","","","has coordinates,has disorder","234049","2020-10-21","18:00:00",""
"7124642","7.7879","0.0013","20.327","0.003","11.9549","0.0019","90","","93.558","0.003","90","","1888.9","0.5","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 O7 P -","- C21 H15 O7 P -","- C84 H60 O28 P4 -","4","1","","Feng, Genfeng; Liu, Wei; Peng, Yuxin; Zhao, Bo; Huang, Wei; Dai, Yafei","Cavity partition and functionalization of a [2+3] organic molecular cage by inserting polar P[double bond, length as m-dash]O bonds.","Chemical communications (Cambridge, England)","2016","52","59","9267","9270","10.1039/c6cc02801b","","","0.71073","MoKα","","0.0882","0.0692","","","0.1813","0.1957","","","","","","0.988","","","","has coordinates","234052","2020-10-21","18:00:00",""
"7124643","19.1327","0.0011","19.1327","0.0011","19.1327","0.0011","90","","90","","90","","7003.7","0.7","291","2","291","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C60 H60 N6 O8 P2 -","- C60 H60 N6 O8 P2 -","- C240 H240 N24 O32 P8 -","4","0.333333","","Feng, Genfeng; Liu, Wei; Peng, Yuxin; Zhao, Bo; Huang, Wei; Dai, Yafei","Cavity partition and functionalization of a [2+3] organic molecular cage by inserting polar P[double bond, length as m-dash]O bonds.","Chemical communications (Cambridge, England)","2016","52","59","9267","9270","10.1039/c6cc02801b","","","0.71073","MoKα","","0.1512","0.0989","","","0.2181","0.2456","","","","","","1.136","","","","has coordinates","234052","2020-10-21","18:00:00",""
"7124644","8.8259","0.0014","9.7216","0.0008","12.7688","0.0013","104.695","0.008","100.791","0.011","108.868","0.011","958.4","0.2","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","N,N'-bisbenzyl-1,4-bis(4-pyridin-1-iumylethynyl)benzenebishexafluorophosphate","","- C38 H32 F12 N4 P2 -","- C38 H32 F12 N4 P2 -","- C38 H32 F12 N4 P2 -","1","0.5","","Wang, Zhaoyang; Bai, Wei; Tong, Jiaqi; Wang, Yi Jia; Qin, Anjun; Sun, Jing Zhi; Tang, Ben Zhong","A macrocyclic 1,4-bis(4-pyridylethynyl)benzene showing unique aggregation-induced emission properties.","Chemical communications (Cambridge, England)","2016","52","68","10365","10368","10.1039/c6cc02851a","","","0.71073","MoKα","","0.1472","0.109","","","0.3342","0.3863","","","","","","1.394","","","","has coordinates","234055","2020-10-21","18:00:00",""
"7124645","16.8244","0.0006","6.0896","0.0002","41.9414","0.0016","90","","101.245","0.004","90","","4214.6","0.3","293.66","0.1","293.66","0.1","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C21 H27 N3 O4 -","- C21 H27 N3 O4 -","- C168 H216 N24 O32 -","8","2","","Li, Dan; Wang, Yijie; Wang, Linqing; Wang, Jie; Wang, Pengxin; Wang, Kezhou; Lin, Li; Liu, Dongsheng; Jiang, Xianxing; Yang, Dongxu","Simple magnesium catalyst mediated γ-butyrolactams in desymmetrization of meso-aziridines.","Chemical communications (Cambridge, England)","2016","52","62","9640","9643","10.1039/c6cc02877b","","x-ray","1.54184","CuKα","","0.074","0.0496","","","0.1075","0.1189","","","","","","1.042","","","","has coordinates,has disorder","234057","2020-10-21","18:00:00",""
"7124646","10.016","0.004","9.223","0.003","13.978","0.005","90","","94.662","0.004","90","","1287","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 3j","6-phenylpyrrolo[1,2-b]isoquinolin-10(5H)-one","","- C18 H13 N O -","- C18 H13 N O -","- C72 H52 N4 O4 -","4","1","","Wu, Shanchao; Liu, Na; Dong, Guoqiang; Ma, Lin; Wang, Shengzheng; Shi, Wencai; Fang, Kun; Chen, Shuqiang; Li, Jian; Zhang, Wannian; Sheng, Chunquan; Wang, Wei","Facile construction of pyrrolo[1,2-b]isoquinolin-10(5H)-ones via a redox-amination-aromatization-Friedel-Crafts acylation cascade reaction and discovery of novel topoisomerase inhibitors.","Chemical communications (Cambridge, England)","2016","52","61","9593","9596","10.1039/c6cc03071h","","","0.71073","MoKα","","0.0716","0.0488","","","0.1156","0.1226","","","","","","0.927","","","","has coordinates","234064","2020-10-21","18:00:00",""
"7124647","8.4109","0.0004","11.4169","0.0006","11.725","0.0006","74.801","0.002","76.758","0.002","87.087","0.002","1057.59","0.09","103","2","103","2","","","","","","","","7","P -1","-P 1","2","","Ru(bpa)(NH3)2","","- C36 H45 F12 N7 O4 P2 Ru -","- C36 H45 F12 N7 O4 P2 Ru -","- C36 H45 F12 N7 O4 P2 Ru -","1","0.5","","He, Lei; Chen, Xiang; Meng, Zhenyu; Wang, Jintao; Tian, Keyin; Li, Tianhu; Shao, Fangwei","Octahedral ruthenium complexes selectively stabilize G-quadruplexes.","Chemical communications (Cambridge, England)","2016","52","52","8095","8098","10.1039/c6cc03117j","","","0.71073","MoKα","","0.0506","0.0365","","","0.0723","0.0796","","","","","","1.088","","","","has coordinates,has disorder","234067","2020-10-21","18:00:00",""
"7124648","11.5273","0.0004","12.9572","0.0004","24.0256","0.0007","90","","97.6261","0.0017","90","","3556.8","0.2","103","2","103","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Ru(bpa)(NH3)(DMSO)","","- C29 H32 F12 N6 O3 P2 Ru S -","- C29 H32 F12 N6 O3 P2 Ru S -","- C116 H128 F48 N24 O12 P8 Ru4 S4 -","4","1","","He, Lei; Chen, Xiang; Meng, Zhenyu; Wang, Jintao; Tian, Keyin; Li, Tianhu; Shao, Fangwei","Octahedral ruthenium complexes selectively stabilize G-quadruplexes.","Chemical communications (Cambridge, England)","2016","52","52","8095","8098","10.1039/c6cc03117j","","","0.71073","MoKα","","0.136","0.0722","","","0.1928","0.2432","","","","","","1.084","","","","has coordinates,has disorder","234067","2020-10-21","18:00:00",""
"7124649","15.8312","0.0004","18.6954","0.0005","21.7724","0.0007","90","","90","","90","","6444","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C64 H59 Cl2 N6 O14 -","- C64 H59 Cl2 N6 O14 -","- C256 H236 Cl8 N24 O56 -","4","1","","Liu, Kang; Xiong, Yong; Wang, Zuo-Fei; Tao, Hai-Yan; Wang, Chun-Jiang","Ligand-controlled stereodivergent 1,3-dipolar cycloaddition of azomethine ylides with 3-methyl-4-nitro-5-styrylisoxazoles.","Chemical communications (Cambridge, England)","2016","52","60","9458","9461","10.1039/c6cc03169b","","","1.54178","CuKα","","0.0659","0.0537","","","0.1428","0.1516","","","","","","1.004","","","","has coordinates","234072","2020-10-21","18:00:00",""
"7124650","5.8187","0.0008","11.7632","0.0017","11.9555","0.0018","79.413","0.003","87.509","0.003","78.478","0.002","788.2","0.2","296","2","296","2","","","","","","","","5","P 1","P 1","1","","","","- C29 H24 Cl N3 O8 -","- C29 H24 Cl N3 O8 -","- C29 H24 Cl N3 O8 -","1","1","","Liu, Kang; Xiong, Yong; Wang, Zuo-Fei; Tao, Hai-Yan; Wang, Chun-Jiang","Ligand-controlled stereodivergent 1,3-dipolar cycloaddition of azomethine ylides with 3-methyl-4-nitro-5-styrylisoxazoles.","Chemical communications (Cambridge, England)","2016","52","60","9458","9461","10.1039/c6cc03169b","","","0.71073","MoKα","","0.0811","0.0735","","","0.1829","0.1946","","","","","","0.924","","","","has coordinates","234072","2020-10-21","18:00:00",""
"7124651","12.2483","0.0004","15.51","0.0005","15.3013","0.0005","90","","90.094","0.001","90","","2906.8","0.16","193","2","193","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H31 B Br4 Ga P -","- C25 H31 B Br4 Ga P -","- C100 H124 B4 Br16 Ga4 P4 -","4","1","","Devillard, Marc; Mallet-Ladeira, Sonia; Bouhadir, Ghenwa; Bourissou, Didier","Diverse reactivity of borenium cations with >N-H compounds.","Chemical communications (Cambridge, England)","2016","52","57","8877","8880","10.1039/c6cc03183h","","x-ray","0.71073","MoKα","","0.0595","0.0382","","","0.088","0.0972","","","","","","1.042","","","","has coordinates","234076","2020-10-21","18:00:00",""
"7124652","30.337","0.003","7.7017","0.0006","19.3533","0.0017","90","","90","","90","","4521.8","0.7","193","2","193","2","","","","","","","synthesis as described","8","P b c n","-P 2n 2ab","60","","","","- C18 H21 B F6 N O4 P S2 -","- C18 H21 B F6 N O4 P S2 -","- C144 H168 B8 F48 N8 O32 P8 S16 -","8","1","","Devillard, Marc; Mallet-Ladeira, Sonia; Bouhadir, Ghenwa; Bourissou, Didier","Diverse reactivity of borenium cations with >N-H compounds.","Chemical communications (Cambridge, England)","2016","52","57","8877","8880","10.1039/c6cc03183h","","x-ray","0.71073","MoKα","","0.1046","0.0517","","","0.1256","0.1524","","","","","","1.03","","","","has coordinates","234076","2020-10-21","18:00:00",""
"7124653","12.5932","0.0011","14.1435","0.0011","19.2716","0.0016","90","","107.068","0.003","90","","3281.3","0.5","193","2","193","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H26 B Br4 Ga N P -","- C34 H26 B Br4 Ga N P -","- C136 H104 B4 Br16 Ga4 N4 P4 -","4","1","","Devillard, Marc; Mallet-Ladeira, Sonia; Bouhadir, Ghenwa; Bourissou, Didier","Diverse reactivity of borenium cations with >N-H compounds.","Chemical communications (Cambridge, England)","2016","52","57","8877","8880","10.1039/c6cc03183h","","x-ray","0.71073","MoKα","","0.0868","0.08","","","0.2398","0.248","","","","","","1.044","","","","has coordinates","234076","2020-10-21","18:00:00",""
"7124654","6.9184","0.0003","22.8078","0.0012","16.1979","0.0008","90","","101.927","0.002","90","","2500.7","0.2","193","2","193","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H29 B N P -","- C31 H29 B N P -","- C124 H116 B4 N4 P4 -","4","1","","Devillard, Marc; Mallet-Ladeira, Sonia; Bouhadir, Ghenwa; Bourissou, Didier","Diverse reactivity of borenium cations with >N-H compounds.","Chemical communications (Cambridge, England)","2016","52","57","8877","8880","10.1039/c6cc03183h","","x-ray","0.71073","MoKα","","0.0517","0.0399","","","0.0952","0.1028","","","","","","1.039","","","","has coordinates","234076","2020-10-21","18:00:00",""
"7124655","8.9898","0.0004","12.2194","0.0006","15.5624","0.0008","91.453","0.002","91.387","0.002","106.552","0.002","1637.28","0.14","173","2","173","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C33 H30 B F6 N2 O4 P S2 -","- C33 H30 B F6 N2 O4 P S2 -","- C66 H60 B2 F12 N4 O8 P2 S4 -","2","1","","Devillard, Marc; Mallet-Ladeira, Sonia; Bouhadir, Ghenwa; Bourissou, Didier","Diverse reactivity of borenium cations with >N-H compounds.","Chemical communications (Cambridge, England)","2016","52","57","8877","8880","10.1039/c6cc03183h","","x-ray","0.71073","MoKα","","0.1415","0.0818","","","0.2047","0.2558","","","","","","1.068","","","","has coordinates","234076","2020-10-21","18:00:00",""
"7124656","7.8691","0.0007","7.8691","0.0007","22.353","0.003","90","","90","","90","","1384.2","0.3","100","2","100","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","Poly[(mu-6-aminopyridine-3-carboxylato-kN:kO)zinc(II)]","","- C12 H10 N4 O4 Zn -","- C12 H10 N4 O4 Zn -","- C48 H40 N16 O16 Zn4 -","4","0.5","","Cepeda, Javier; Sebastian, Eider San; Padro, Daniel; Rodríguez-Diéguez, Antonio; García, Jose A; Ugalde, Jesus M.; Seco, Jose M.","A Zn based coordination polymer exhibiting long-lasting phosphorescence.","Chemical communications (Cambridge, England)","2016","52","56","8671","8674","10.1039/c6cc03242g","","","0.71073","MoKα","","0.0525","0.0494","","","0.1038","0.1047","","","","","","1.235","","","","has coordinates","234079","2020-10-21","18:00:00",""
"7124657","14.9097","0.0004","6.6345","0.0002","16.6553","0.0004","90","","92.822","0.002","90","","1645.52","0.08","290","2","290","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C21 H19 B O2 -","- C21 H19 B O2 -","- C84 H76 B4 O8 -","4","1","","Wang, Taisheng; Zhang, Na; Zhang, Ke; Dai, Jingwen; Bai, Wei; Bai, Ruke","Pyrene boronic acid cyclic ester: a new fast self-recovering mechanoluminescent material at room temperature.","Chemical communications (Cambridge, England)","2016","52","62","9679","9682","10.1039/c6cc03248f","","","1.54184","CuKα","","0.052","0.0457","","","0.1299","0.1389","","","","","","1.048","","","","has coordinates","234081","2020-10-21","18:00:00",""
"7124658","11.7096","0.0013","10.8168","0.0011","14.2151","0.0015","90","","91.551","0.01","90","","1799.8","0.3","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H21 B O2 -","- C22 H21 B O2 -","- C88 H84 B4 O8 -","4","1","","Wang, Taisheng; Zhang, Na; Zhang, Ke; Dai, Jingwen; Bai, Wei; Bai, Ruke","Pyrene boronic acid cyclic ester: a new fast self-recovering mechanoluminescent material at room temperature.","Chemical communications (Cambridge, England)","2016","52","62","9679","9682","10.1039/c6cc03248f","","","0.71073","MoKα","","0.1076","0.0627","","","0.1164","0.136","","","","","","1.009","","","","has coordinates","234081","2020-10-21","18:00:00",""
"7124659","8.45","0.0004","11.0004","0.0005","42.68","0.002","90","","90","","90","","3967.3","0.3","123","2","123","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","perfluororubrene, F28-rubrene","5,6,11,12-tetrakis(perfluorophenyl)1,2,3,4,7,8,9,10-octafluorotetracene- perfluororubrene chloroform solvate","","- C42 F28 -","- C42 F28 -","- C168 F112 -","4","1","","Zhang, Zhuoran; Ogden, William A.; Young, Victor G.; Douglas, Christopher J.","Synthesis, electrochemical properties, and crystal packing of perfluororubrene.","Chemical communications (Cambridge, England)","2016","52","52","8127","8130","10.1039/c6cc03259a","","","1.54178","CuKα","","0.0267","0.0252","","","0.0648","0.0656","","","","","","1.045","","","","has coordinates","234083","2020-10-21","18:00:00",""
"7124660","16.6651","0.0006","11.1489","0.0005","19.1918","0.0007","90","","90.213","0.003","90","","3565.8","0.2","123","2","123","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","perfluororubrene, F28-rubrene","5,6,11,12-tetrakis(perfluorophenyl)1,2,3,4,7,8,9,10-octafluorotetracene- perfluororubrene","","- C42 F28 -","- C42 F28 -","- C168 F112 -","4","1","","Zhang, Zhuoran; Ogden, William A.; Young, Victor G.; Douglas, Christopher J.","Synthesis, electrochemical properties, and crystal packing of perfluororubrene.","Chemical communications (Cambridge, England)","2016","52","52","8127","8130","10.1039/c6cc03259a","","","1.54178","CuKα","","0.083","0.0562","","","0.1428","0.1636","","","","","","1.045","","","","has coordinates","234083","2020-10-21","18:00:00",""
"7124661","12.5285","0.0007","17.8163","0.0009","24.7339","0.0013","90.202","0.004","101.264","0.003","90.695","0.003","5414","0.5","123","2","123","2","","","","","","","","2","P -1","-P 1","2","perfluororubrene, F28-rubrene","5,6,11,12-tetrakis(perfluorophenyl)1,2,3,4,7,8,9,10-octafluorotetracene- perfluororubrene","","- C42 F28 -","- C42 F28 -","- C252 F168 -","6","3","","Zhang, Zhuoran; Ogden, William A.; Young, Victor G.; Douglas, Christopher J.","Synthesis, electrochemical properties, and crystal packing of perfluororubrene.","Chemical communications (Cambridge, England)","2016","52","52","8127","8130","10.1039/c6cc03259a","","","1.54178","CuKα","","0.0946","0.0687","","","0.1499","0.1681","","","","","","1.053","","","","has coordinates,has disorder","234083","2020-10-21","18:00:00",""
"7124662","12.0803","0.0007","12.3966","0.0009","14.483","0.001","106.375","0.006","96.145","0.005","108.074","0.006","1932.7","0.3","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H61 N O10 -","- C44 H61 N O10 -","- C88 H122 N2 O20 -","2","1","","Puttreddy, Rakesh; Beyeh, Ngong Kodiah; Kalenius, Elina; Ras, Robin H. A.; Rissanen, Kari","2-Methylresorcinarene: a very high packing coefficient in a mono-anion based dimeric capsule and the X-ray crystal structure of the tetra-anion.","Chemical communications (Cambridge, England)","2016","52","52","8115","8118","10.1039/c6cc03289c","","x-ray","0.71073","MoKα","","0.1218","0.0662","","","0.1391","0.1666","","","","","","1.022","","","","has coordinates","234086","2020-10-21","18:00:00",""
"7124663","13.3506","0.0009","15.7389","0.0011","17.8889","0.0012","69.234","0.006","75.125","0.006","87.036","0.005","3393.7","0.4","170","","170","","","","","","","","","4","P -1","-P 1","2","","","","- C125 H227 N10 O31.5 -","- C125 H227 N10 O31.5 -","- C125 H227 N10 O31.5 -","1","0.5","","Puttreddy, Rakesh; Beyeh, Ngong Kodiah; Kalenius, Elina; Ras, Robin H. A.; Rissanen, Kari","2-Methylresorcinarene: a very high packing coefficient in a mono-anion based dimeric capsule and the X-ray crystal structure of the tetra-anion.","Chemical communications (Cambridge, England)","2016","52","52","8115","8118","10.1039/c6cc03289c","","x-ray","0.71073","MoKα","","0.1252","0.0829","","","0.2304","0.2623","","","","","","1.029","","","","has coordinates,has disorder","234086","2020-10-21","18:00:00",""
"7124664","15.4204","0.0002","15.4204","0.0002","43.9852","0.0006","90","","90","","90","","10459.2","0.2","100","","100","","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C98 H120 N16 O18 -","- C98 H120 N16 O18 -","- C392 H480 N64 O72 -","4","0.5","","Chung, Mee-Kyung; Lee, Stephen J.; Waters, Marcey L.; Gagné, Michel R","Tetrameric psuedo-peptide receptors with allosteric properties.","Chemical communications (Cambridge, England)","2016","52","52","8103","8106","10.1039/c6cc03296f","","","1.54178","CuKα","","0.0707","0.0652","","","0.1764","0.1815","","","","","","1.043","","","","has coordinates","234089","2020-10-21","18:00:00",""
"7124665","22.2194","0.0006","26.8073","0.0008","30.7909","0.0008","90","","90","","90","","18340.4","0.9","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C68 H80 N16 O12 -","- C68 H80 N16 O12 -","- C544 H640 N128 O96 -","8","2","","Chung, Mee-Kyung; Lee, Stephen J.; Waters, Marcey L.; Gagné, Michel R","Tetrameric psuedo-peptide receptors with allosteric properties.","Chemical communications (Cambridge, England)","2016","52","52","8103","8106","10.1039/c6cc03296f","","","1.54178","CuKα","","0.0995","0.0743","","","0.1892","0.2046","","","","","","0.945","","","","has coordinates","234089","2020-10-21","18:00:00",""
"7124666","10.5604","0.0007","12.5871","0.001","20.6289","0.0015","90","","103.411","0.003","90","","2667.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H35 N O2 Si -","- C31 H35 N O2 Si -","- C124 H140 N4 O8 Si4 -","4","1","","Shinde, Popat S.; Shaikh, Aslam C.; Patil, Nitin T.","Efficient access to alkynylated quinalizinones via the gold(i)-catalyzed aminoalkynylation of alkynes.","Chemical communications (Cambridge, England)","2016","52","52","8152","8155","10.1039/c6cc03414d","","","0.71073","MoKα","","0.0425","0.0377","","","0.0898","0.093","","","","","","1.037","","","","has coordinates","234093","2020-10-21","18:00:00",""
"7124667","17.0259","0.0011","19.7058","0.0012","8.2013","0.0005","90","","101.746","0.004","90","","2694","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H33 N O2 Si -","- C31 H33 N O2 Si -","- C124 H132 N4 O8 Si4 -","4","1","","Shinde, Popat S.; Shaikh, Aslam C.; Patil, Nitin T.","Efficient access to alkynylated quinalizinones via the gold(i)-catalyzed aminoalkynylation of alkynes.","Chemical communications (Cambridge, England)","2016","52","52","8152","8155","10.1039/c6cc03414d","","","0.71073","MoKα","","0.166","0.1156","","","0.1769","0.1963","","","","","","1.127","","","","has coordinates","234093","2020-10-21","18:00:00",""
"7124668","12.1203","0.0003","21.6638","0.0005","27.3069","0.0009","90","","91.372","0.003","90","","7168","0.3","140","2","140","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis-(2-(4,4'-di(tert-butyl)-6-phenyl-2,2'-bipyridine platinum(II) acetylide)-5-phenyl-thiophene-3-yl)-hexafluorocyclopent-1-en-1-yl","","- C78 H68 Cl2 F6 N4 Pt2 S2 -","- C78 H68 Cl2 F6 N4 Pt2 S2 -","- C312 H272 Cl8 F24 N16 Pt8 S8 -","4","1","","Boixel, Julien; Zhu, Yifan; Le Bozec, Hubert; Benmensour, Mohamed Ali; Boucekkine, Abdou; Wong, Keith Man-Chung; Colombo, Alessia; Roberto, Dominique; Guerchais, Véronique; Jacquemin, Denis","Contrasted photochromic and luminescent properties in dinuclear Pt(ii) complexes linked through a central dithienylethene unit.","Chemical communications (Cambridge, England)","2016","52","63","9833","9836","10.1039/c6cc03431d","","x-ray","1.54184","CuKα","","0.1402","0.1265","","","0.3255","0.3373","","","","","","1.196","","","","has coordinates,has disorder","234095","2020-10-21","18:00:00",""
"7124669","10.2417","0.0002","18.3288","0.0003","21.5881","0.0004","90","","95.3341","0.0011","90","","4034.93","0.13","100","2","100","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C34 H58 F4 Mo N6 P4 -","- C34 H58 F4 Mo N6 P4 -","- C136 H232 F16 Mo4 N24 P16 -","4","2","","Egbert, Jonathan D.; O'Hagan, Molly; Wiedner, Eric S.; Bullock, R. Morris; Piro, Nicholas A.; Kassel, W. Scott; Mock, Michael T.","Putting chromium on the map for N2 reduction: production of hydrazine and ammonia. A study of cis-M(N2)2 (M = Cr, Mo, W) bis(diphosphine) complexes.","Chemical communications (Cambridge, England)","2016","52","60","9343","9346","10.1039/c6cc03449g","","","0.71073","MoKα","","0.0969","0.0528","","","0.0908","0.1071","","","","","","1.003","","","","has coordinates","234098","2020-10-21","18:00:00",""
"7124670","10.8985","0.0006","13.441","0.0007","13.4741","0.0007","90","","101.392","0.003","90","","1934.89","0.18","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 Cr F4 N6 P4 -","- C34 H58 Cr F4 N6 P4 -","- C68 H116 Cr2 F8 N12 P8 -","2","0.5","","Egbert, Jonathan D.; O'Hagan, Molly; Wiedner, Eric S.; Bullock, R. Morris; Piro, Nicholas A.; Kassel, W. Scott; Mock, Michael T.","Putting chromium on the map for N2 reduction: production of hydrazine and ammonia. A study of cis-M(N2)2 (M = Cr, Mo, W) bis(diphosphine) complexes.","Chemical communications (Cambridge, England)","2016","52","60","9343","9346","10.1039/c6cc03449g","","","0.71073","MoKα","","0.0561","0.0344","","","0.0743","0.083","","","","","","1.024","","","","has coordinates","234098","2020-10-21","18:00:00",""
"7124671","10.301","0.0002","18.8047","0.0004","20.7192","0.0004","90","","93.77","0.001","90","","4004.77","0.14","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H58 Cr F4 N6 P4 -","- C34 H58 Cr F4 N6 P4 -","- C136 H232 Cr4 F16 N24 P16 -","4","1","","Egbert, Jonathan D.; O'Hagan, Molly; Wiedner, Eric S.; Bullock, R. Morris; Piro, Nicholas A.; Kassel, W. Scott; Mock, Michael T.","Putting chromium on the map for N2 reduction: production of hydrazine and ammonia. A study of cis-M(N2)2 (M = Cr, Mo, W) bis(diphosphine) complexes.","Chemical communications (Cambridge, England)","2016","52","60","9343","9346","10.1039/c6cc03449g","","","0.71073","MoKα","","0.0639","0.0387","","","0.0859","0.0969","","","","","","1.027","","","","has coordinates","234098","2020-10-21","18:00:00",""
"7124672","10.2469","0.0002","18.3292","0.0003","21.5498","0.0004","90","","95.426","0.001","90","","4029.29","0.13","100","","100","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C34 H58 F4 N6 P4 W -","- C34 H58 F4 N6 P4 W -","- C136 H232 F16 N24 P16 W4 -","4","2","","Egbert, Jonathan D.; O'Hagan, Molly; Wiedner, Eric S.; Bullock, R. Morris; Piro, Nicholas A.; Kassel, W. Scott; Mock, Michael T.","Putting chromium on the map for N2 reduction: production of hydrazine and ammonia. A study of cis-M(N2)2 (M = Cr, Mo, W) bis(diphosphine) complexes.","Chemical communications (Cambridge, England)","2016","52","60","9343","9346","10.1039/c6cc03449g","","","0.71073","MoKα","","0.0383","0.0312","","","0.0601","0.063","","","","","","1.043","","","","has coordinates","234098","2020-10-21","18:00:00",""
"7124673","32.7165","0.0018","16.1948","0.0008","39.103","0.002","90","","90","","90","","20718.2","1.9","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","iPrCS","pentaisopropylcyanostar","","- C105 H105 N5 -","- C105 H105 N5 -","- C840 H840 N40 -","8","1","","Qiao, Bo; Anderson, Joseph R.; Pink, Maren; Flood, Amar H.","Size-matched recognition of large anions by cyanostar macrocycles is saved when solvent-bias is avoided.","Chemical communications (Cambridge, England)","2016","52","56","8683","8686","10.1039/c6cc03463b","","","0.41328","","","0.2476","0.1623","","","0.4146","0.4414","","","","","","2.558","","","","has coordinates,has disorder","234100","2020-10-21","18:00:00",""
"7124674","8.9419","0.0018","20.446","0.004","7.9832","0.0016","90","","111.874","0.003","90","","1354.5","0.5","296.15","","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","","Li, Jiu-Ling; Li, Wei-Ze; Wang, Ying-Chun; Ren, Qiu; Wang, Heng-Shan; Pan, Ying-Ming","Palladium(ii)-catalyzed C-C and C-O bond formation for the synthesis of C1-benzoyl isoquinolines from isoquinoline N-oxides and nitroalkenes.","Chemical communications (Cambridge, England)","2016","52","65","10028","10031","10.1039/c6cc03530b","","","0.71073","MoKα","","0.0694","0.0606","","","0.1814","0.1873","","","","","","1.158","","","","has coordinates","234105","2020-10-21","18:00:00",""
"7124675","5.43","0.0002","7.8748","0.0005","20.6997","0.0009","90","","90","","90","","885.12","0.08","200","","200","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-methyl-2-nitro-3-phenyloxirane","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C36 H36 N4 O12 -","4","1","","Vidal-Albalat, A; Swiderek, K.; Izquierdo, J.; Rodríguez, S; Moliner, V.; González, F V","Catalytic enantioselective epoxidation of nitroalkenes.","Chemical communications (Cambridge, England)","2016","52","65","10060","10063","10.1039/c6cc03539f","","x-ray","1.54184","CuKα","","0.0465","0.0414","","","0.1126","0.1189","","","","","","1.0944","","","","has coordinates","234107","2020-10-21","18:00:00",""
"7124676","8.6028","0.0003","6.2292","0.0003","11.4861","0.0004","90","","94.415","0.003","90","","613.7","0.04","200","2","200","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3R)-2-nitro-2,3-diphenyloxirane","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C28 H22 N2 O6 -","2","1","","Vidal-Albalat, A; Swiderek, K.; Izquierdo, J.; Rodríguez, S; Moliner, V.; González, F V","Catalytic enantioselective epoxidation of nitroalkenes.","Chemical communications (Cambridge, England)","2016","52","65","10060","10063","10.1039/c6cc03539f","","x-ray","1.54184","CuKα","","0.0585","0.0541","","","0.1324","0.1369","","","","","","1.051","","","","has coordinates","234107","2020-10-21","18:00:00",""
"7124677","12.741","0.003","13.235","0.004","17.923","0.004","89.94","0.01","85.741","0.01","86.594","0.011","3008.6","1.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H76 Cl3 Dy O35 -","- C42 H76 Cl3 Dy O35 -","- C84 H152 Cl6 Dy2 O70 -","2","1","","Al Hareri, M.; Gavey, E. L.; Regier, J.; Ras Ali, Z.; Carlos, L. D.; Ferreira, R. A. S.; Pilkington, M.","Encapsulation of a [Dy(OH2)8](3+) cation: magneto-optical and theoretical studies of a caged, emissive SMM.","Chemical communications (Cambridge, England)","2016","52","76","11335","11338","10.1039/c6cc03578g","","","0.71073","MoKα","","0.0746","0.0686","","","0.173","0.1794","","","","","","1.091","","","","has coordinates","234111","2020-10-21","18:00:00",""
"7124678","7.791","0.0004","13.1164","0.0006","16.9526","0.0008","90","","96.895","0.001","90","","1719.86","0.14","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","en07310-73","","- C19 H20 N2 O4 -","- C19 H20 N2 O4 -","- C76 H80 N8 O16 -","4","1","","Briones, John F.; Basarab, Gregory S.","Expedient synthesis of tetrahydroquinoline-3-spirohydantoin derivatives via the Lewis acid-catalyzed tert-amino effect reaction.","Chemical communications (Cambridge, England)","2016","52","55","8541","8544","10.1039/c6cc03600g","","","0.71073","MoKα","","0.0798","0.0515","","","0.1438","0.1659","","","","","","1.048","","","","has coordinates","234113","2020-10-21","18:00:00",""
"7124679","13.595","0.0013","20.8235","0.0019","23.687","0.002","74.639","0.002","84.656","0.002","76.364","0.002","6280.5","1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H62 F12 N2 O14 P2 -","- C52 H62 F12 N2 O14 P2 -","- C208 H248 F48 N8 O56 P8 -","4","2","","Cheng, Ming; Yao, Chenhao; Cao, Yihan; Wang, Qi; Pan, Yi; Jiang, Juli; Wang, Leyong","4-Methylcoumarin-bridged fluorescent responsive cryptand: from [2+2] photodimerization to supramolecular polymer.","Chemical communications (Cambridge, England)","2016","52","56","8715","8718","10.1039/c6cc03624d","","","0.71073","MoKα","","0.1375","0.0893","","","0.174","0.1904","","","","","","1.184","","","","has coordinates","234115","2020-10-21","18:00:00",""
"7124680","9.1828","0.0017","9.0675","0.0017","26.107","0.005","90","","91.376","0.003","90","","2173.2","0.7","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 N2 O3 -","- C26 H24 N2 O3 -","- C104 H96 N8 O12 -","4","1","","An, Yuanyuan; Xia, Hongguang; Wu, Jie","Base-controlled [3+3] cycloaddition of isoquinoline N-oxides with azaoxyallyl cations.","Chemical communications (Cambridge, England)","2016","52","68","10415","10418","10.1039/c6cc03650c","","","0.71073","MoKα","","0.0766","0.0571","","","0.1575","0.1714","","","","","","1.062","","","","has coordinates","234117","2020-10-21","18:00:00",""
"7124681","38.327","0.012","12.158","0.004","9.715","0.003","90","","95.51","0.006","90","","4506","2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H24 N2 O3 -","- C26 H24 N2 O3 -","- C208 H192 N16 O24 -","8","1","","An, Yuanyuan; Xia, Hongguang; Wu, Jie","Base-controlled [3+3] cycloaddition of isoquinoline N-oxides with azaoxyallyl cations.","Chemical communications (Cambridge, England)","2016","52","68","10415","10418","10.1039/c6cc03650c","","","0.71073","MoKα","","0.1166","0.0547","","","0.148","0.1817","","","","","","1.006","","","","has coordinates","234117","2020-10-21","18:00:00",""
"7124682","13.5981","0.0006","14.8764","0.0007","21.2531","0.0009","75.799","0.002","87.413","0.002","75.372","0.002","4032.2","0.3","100","","100","1","","","","","","","","9","P -1","-P 1","2","","","","- C66 H57 Ce F15 N3 O2 P2 S6 Si3 -","- C66 H57 Ce F15 N3 O2 P2 S6 Si3 -","- C132 H114 Ce2 F30 N6 O4 P4 S12 Si6 -","2","1","","Yin, Haolin; Carroll, Patrick J.; Schelter, Eric J.","Reactions of a cerium(iii) amide with heteroallenes: insertion, silyl-migration and de-insertion.","Chemical communications (Cambridge, England)","2016","52","63","9813","9816","10.1039/c6cc03719d","","","0.71073","MoKα","","0.0623","0.0511","","","0.1185","0.1253","","","","","","1.096","","","","has coordinates,has disorder","234120","2020-10-21","18:00:00",""
"7124683","23.8","0.0014","12.7595","0.0007","40.727","0.002","90","","97.599","0.003","90","","12259.2","1.2","100","","100","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H69 Ce F15 N9 Si3 -","- C48 H69 Ce F15 N9 Si3 -","- C384 H552 Ce8 F120 N72 Si24 -","8","1","","Yin, Haolin; Carroll, Patrick J.; Schelter, Eric J.","Reactions of a cerium(iii) amide with heteroallenes: insertion, silyl-migration and de-insertion.","Chemical communications (Cambridge, England)","2016","52","63","9813","9816","10.1039/c6cc03719d","","","0.71073","MoKα","","0.0535","0.0499","","","0.1189","0.1204","","","","","","1.166","","","","has coordinates,has disorder","234120","2020-10-21","18:00:00",""
"7124684","13.33","0.05","15.13","0.05","7.59","0.03","90","","100.77","0.05","90","","1504","10","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 O -","- C21 H16 O -","- C84 H64 O4 -","4","1","","Jin, Ruiwen; Chen, Yiyong; Liu, Wangsheng; Xu, Dawen; Li, Yawei; Ding, Aishun; Guo, Hao","Merging photoredox catalysis with Lewis acid catalysis: activation of carbon-carbon triple bonds.","Chemical communications (Cambridge, England)","2016","52","64","9909","9912","10.1039/c6cc03725a","","","0.71073","MoKα","","0.1321","0.0476","","","0.0826","0.0939","","","","","","0.692","","","","has coordinates","234122","2020-10-21","18:00:00",""
"7124685","8.4933","0.0008","10.7736","0.001","14.1815","0.0014","90","","92.817","0.001","90","","1296.1","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 O5 -","- C16 H14 O5 -","- C64 H56 O20 -","4","1","","Chen, Dong; Xu, Wen-Dan; Liu, Hao-Miao; Li, Ming-Ming; Yan, Yong-Min; Li, Xiao-Nian; Li, Yan; Cheng, Yong-Xian; Qin, Hong-Bo","Enantioselective total synthesis of (+)-Lingzhiol via tandem semipinacol rearrangement/Friedel-Crafts type cyclization.","Chemical communications (Cambridge, England)","2016","52","55","8561","8564","10.1039/c6cc03764j","","","0.71073","MoKα","","0.041","0.0376","","","0.1017","0.1045","","","","","","1.041","","","","has coordinates","234124","2020-10-21","18:00:00",""
"7124686","8.1765","0.0007","10.7366","0.0009","16.4944","0.0013","90","","90","","90","","1448","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H13 Br O5 -","- C16 H13 Br O5 -","- C64 H52 Br4 O20 -","4","1","","Chen, Dong; Xu, Wen-Dan; Liu, Hao-Miao; Li, Ming-Ming; Yan, Yong-Min; Li, Xiao-Nian; Li, Yan; Cheng, Yong-Xian; Qin, Hong-Bo","Enantioselective total synthesis of (+)-Lingzhiol via tandem semipinacol rearrangement/Friedel-Crafts type cyclization.","Chemical communications (Cambridge, England)","2016","52","55","8561","8564","10.1039/c6cc03764j","","","0.71073","MoKα","","0.0247","0.0206","","","0.0514","0.0676","","","","","","1.078","","","","has coordinates","234124","2020-10-21","18:00:00",""
"7124687","9.7836","0.0014","19.184","0.003","7.2536","0.0011","90","","110.113","0.003","90","","1278.4","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C60 H56 N8 O12 -","4","1","","Alcaide, Benito; Almendros, Pedro; Cembellín, Sara; Fernández, Israel; Martínez Del Campo, Teresa","Stereoselective synthesis of strained cage compounds via gold-catalyzed allene functionalization.","Chemical communications (Cambridge, England)","2016","52","67","10265","10268","10.1039/c6cc03779h","","","0.71073","MoKα","","0.1275","0.0531","","","0.132","0.1653","","","","","","0.997","","","","has coordinates","234126","2020-10-21","18:00:00",""
"7124688","12.8179","0.001","4.8463","0.0003","18.2472","0.0012","90","","100.494","0.003","90","","1114.55","0.13","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H4 N6 O2 -","- C2 H4 N6 O2 -","- C16 H32 N48 O16 -","8","1","","He, Chunlin; Yin, Ping; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.","Energetic aminated-azole assemblies from intramolecular and intermolecular N-HO and N-HN hydrogen bonds.","Chemical communications (Cambridge, England)","2016","52","52","8123","8126","10.1039/c6cc03833f","","","0.71073","MoKα","","0.0334","0.0279","","","0.0699","0.0738","","","","","","1.014","","","","has coordinates","234129","2020-10-21","18:00:00",""
"7124689","12.7338","0.0004","9.977","0.0003","5.136","0.0002","90","","90","","90","","652.5","0.04","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2,4-dinitro-1H-imidazole-1,5-diamine","","- C3 H4 N6 O4 -","- C3 H4 N6 O4 -","- C12 H16 N24 O16 -","4","1","","He, Chunlin; Yin, Ping; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.","Energetic aminated-azole assemblies from intramolecular and intermolecular N-HO and N-HN hydrogen bonds.","Chemical communications (Cambridge, England)","2016","52","52","8123","8126","10.1039/c6cc03833f","","","1.54178","CuKα","","0.0318","0.0318","","","0.0882","0.0882","","","","","","1.066","","","","has coordinates","234129","2020-10-21","18:00:00",""
"7124690","3.5852","0.0003","16.3937","0.0012","9.4278","0.0007","90","","98.448","0.003","90","","548.1","0.07","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C2 H4 N6 O2 -","- C2 H4 N6 O2 -","- C8 H16 N24 O8 -","4","2","","He, Chunlin; Yin, Ping; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.","Energetic aminated-azole assemblies from intramolecular and intermolecular N-HO and N-HN hydrogen bonds.","Chemical communications (Cambridge, England)","2016","52","52","8123","8126","10.1039/c6cc03833f","","","0.71073","MoKα","","0.0918","0.048","","","0.0897","0.1114","","","","","","1.045","","","","has coordinates","234129","2020-10-21","18:00:00",""
"7124691","8.0055","0.0007","6.4742","0.0006","10.7844","0.001","90","","96.224","0.001","90","","555.65","0.09","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H4 N6 O2 -","- C2 H4 N6 O2 -","- C8 H16 N24 O8 -","4","1","","He, Chunlin; Yin, Ping; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.","Energetic aminated-azole assemblies from intramolecular and intermolecular N-HO and N-HN hydrogen bonds.","Chemical communications (Cambridge, England)","2016","52","52","8123","8126","10.1039/c6cc03833f","","","0.71073","MoKα","","0.0326","0.0312","","","0.0855","0.0869","","","","","","1.096","","","","has coordinates","234129","2020-10-21","18:00:00",""
"7124692","15.924","0.005","8.289","0.002","15.498","0.006","90","","99.13","0.006","90","","2019.7","1.1","566","2","566","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C H N O S -","- C2.92308 H3.07692 N0.153846 O0.923077 S0.153846 -","- C76 H80 N4 O24 S4 -","26","6.5","","Wang, Sasa; Chen, Xinzheng; Ao, Qiaoqiao; Wang, Huifei; Zhai, Hongbin","Decarboxylative Csp(3)-Csp(3) coupling for benzylation of unstable ketone enolates: synthesis of p-(acylethyl)phenols.","Chemical communications (Cambridge, England)","2016","52","60","9454","9457","10.1039/c6cc03835b","","","0.71073","MoKα","","0.0886","0.0802","","","0.2216","0.2515","","","","","","1.754","","","","has coordinates","234131","2020-10-21","18:00:00",""
"7124693","12.6576","0.0002","14.5099","0.0002","13.416","0.0002","90","","106.523","0.001","90","","2362.24","0.06","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 F6 N2 Rh Sb -","- C22 H26 F6 N2 Rh Sb -","- C88 H104 F24 N8 Rh4 Sb4 -","4","1","","Hou, Wei; Yang, Yaxi; Wu, Yunxiang; Feng, Huijin; Li, Yuanchao; Zhou, Bing","Rhodium(iii)-catalyzed alkylation of primary C(sp(3))-H bonds with α-diazocarbonyl compounds.","Chemical communications (Cambridge, England)","2016","52","62","9672","9675","10.1039/c6cc03846h","","","0.71073","MoKα","","0.0299","0.028","","","0.0733","0.0745","","","","","","1.056","","","","has coordinates","234133","2020-10-21","18:00:00",""
"7124694","23.9036","0.0008","21.2261","0.0006","18.0968","0.0004","90","","90","","90","","9182","0.5","293","2","293","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C64 H256 Co16 N64 Nb32 O205 S4 V39 -","- C64 H256 Co16 N64 Nb32 O205 S4 V39 -","- C64 H256 Co16 N64 Nb32 O205 S4 V39 -","1","0.125","","Hu, Ju-Fang; Han, Tian; Chi, Ying-Nan; Lin, Zheng-Guo; Xu, Yan-Qing; Yang, Song; Wei, Ding; Zheng, Yan-Zhen; Hu, Chang-Wen","Sulfur-centred polyoxoniobate-based 3D organic-inorganic hybrid compound and its magnetic behavior.","Chemical communications (Cambridge, England)","2016","52","72","10846","10849","10.1039/c6cc03915d","","","0.71073","MoKα","","0.1409","0.0996","","","0.2783","0.3177","","","","","","1.038","","","","has coordinates","234135","2020-10-21","18:00:00",""
"7124695","10.1048","0.0008","12.9834","0.0008","15.341","0.001","90","","102.567","0.004","90","","1964.4","0.2","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H30 Li N3 -","- C21 H30 Li N3 -","- C84 H120 Li4 N12 -","4","2","","Blair, V. L.; Stevens, M. A.; Thompson, C. D.","The importance of the Lewis base in lithium mediated metallation and bond cleavage reaction of allyl amines and allyl phosphines.","Chemical communications (Cambridge, England)","2016","52","52","8111","8114","10.1039/c6cc03947b","","","0.71073","MoKα","","0.0502","0.0417","","","0.1051","0.1103","","","","","","1.021","","","","has coordinates","234137","2020-10-21","18:00:00",""
"7124696","10.592","0.002","18.626","0.004","9.119","0.0018","90","","95.24","0.03","90","","1791.5","0.6","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C38 H48 Li2 O2 P2 -","- C38 H48 Li2 O2 P2 -","- C76 H96 Li4 O4 P4 -","2","0.5","","Blair, V. L.; Stevens, M. A.; Thompson, C. D.","The importance of the Lewis base in lithium mediated metallation and bond cleavage reaction of allyl amines and allyl phosphines.","Chemical communications (Cambridge, England)","2016","52","52","8111","8114","10.1039/c6cc03947b","","","0.71073","synchrotron","","0.0352","0.0343","","","0.0902","0.0908","","","","","","1.046","","","","has coordinates","234137","2020-10-21","18:00:00",""
"7124697","10.1275","0.0004","8.6095","0.0003","27.5008","0.0012","90","","91.558","0.003","90","","2396.98","0.16","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H37 Li N4 -","- C24 H37 Li N4 -","- C96 H148 Li4 N16 -","4","1","","Blair, V. L.; Stevens, M. A.; Thompson, C. D.","The importance of the Lewis base in lithium mediated metallation and bond cleavage reaction of allyl amines and allyl phosphines.","Chemical communications (Cambridge, England)","2016","52","52","8111","8114","10.1039/c6cc03947b","","","0.71073","MoKα","","0.0898","0.0478","","","0.0979","0.1154","","","","","","1.005","","","","has coordinates,has disorder","234137","2020-10-21","18:00:00",""
"7124698","26.8526","0.0007","13.8261","0.0004","26.9848","0.0007","90","","111.812","0.001","90","","9301.3","0.4","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H57 N9 O6 -","- C51 H57 N9 O6 -","- C408 H456 N72 O48 -","8","2","","Pfletscher, Michael; Wölper, Christoph; Gutmann, Jochen S.; Mezger, Markus; Giese, Michael","A modular approach towards functional supramolecular aggregates - subtle structural differences inducing liquid crystallinity.","Chemical communications (Cambridge, England)","2016","52","55","8549","8552","10.1039/c6cc03966a","","","0.71073","MoKα","","0.1297","0.0592","","","0.1373","0.1749","","","","","","1.026","","","","has coordinates,has disorder","234139","2020-10-21","18:00:00",""
"7124699","12.1709","0.0006","14.4443","0.0006","15.9292","0.0007","90","","97.855","0.002","90","","2774.1","0.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(MeSiP2)CoBr","(MeSiP2)CoBr","","- C25 H39 Br Co P2 Si -","- C25 H39 Br Co P2 Si -","- C100 H156 Br4 Co4 P8 Si4 -","4","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.043","0.0324","","","0.079","0.0843","","","","","","1.036","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124700","11.0181","0.001","18.0167","0.0017","15.4914","0.0015","90","","98.734","0.003","90","","3039.5","0.5","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(PhSiP2)CoBr","(PhSiP2)CoBr","","- C30 H41 Br Co P2 Si -","- C30 H41 Br Co P2 Si -","- C120 H164 Br4 Co4 P8 Si4 -","4","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.0889","0.0533","","","0.1167","0.1326","","","","","","1.062","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124701","17.6793","0.0006","16.195","0.0006","23.2286","0.0008","90","","90","","90","","6650.7","0.4","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","[MeSiHPH2][CoBr4]","[MeSiHPH2][CoBr4]","","- C25 H42 Br4 Co P2 Si -","- C25 H42 Br4 Co P2 Si -","- C200 H336 Br32 Co8 P16 Si8 -","8","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.1037","0.0411","","","0.07","0.0851","","","","","","1.019","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124702","13.1415","0.0006","14.3471","0.0006","16.6192","0.0007","90","","112.798","0.002","90","","2888.6","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","PhSiHP2","PhSiHP2","","- C30 H42 P2 Si -","- C30 H42 P2 Si -","- C120 H168 P8 Si4 -","4","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.0621","0.0411","","","0.0906","0.1016","","","","","","1.031","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124703","17.1233","0.0013","9.7303","0.0008","17.9002","0.0013","90","","110.977","0.002","90","","2784.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(MeSiHP2)CoBr2","(MeSiHP2)CoBr2","","- C25 H40 Br2 Co P2 Si -","- C25 H39 Br2 Co P2 Si -","- C100 H156 Br8 Co4 P8 Si4 -","4","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.1535","0.0664","","","0.1046","0.1259","","","","","","1.012","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124704","12.3228","0.0007","13.1299","0.0006","26.5742","0.0015","90","","90","","90","","4299.6","0.4","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","[Et3NH]2[CoBr4]","[Et3NH]2[CoBr4]","","- C12 H32 Br4 Co N2 -","- C12 H32 Br4 Co N2 -","- C96 H256 Br32 Co8 N16 -","8","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.0692","0.0454","","","0.0966","0.1077","","","","","","1.051","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124705","17.387","0.003","11.5644","0.0017","15.641","0.002","90","","92.891","0.005","90","","3140.9","0.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(PhSiHP2)CoBr2","(PhSiHP2)CoBr2","","- C30 H42 Br2 Co P2 Si -","- C30 H41 Br2 Co P2 Si -","- C120 H164 Br8 Co4 P8 Si4 -","4","1","","Kim, Jin; Kim, Yujeong; Sinha, Indranil; Park, Koeun; Kim, Sun Hee; Lee, Yunho","The unusual hydridicity of a cobalt bound Si-H moiety.","Chemical communications (Cambridge, England)","2016","52","60","9367","9370","10.1039/c6cc03983a","","","0.71073","MoKα","","0.1694","0.1175","","","0.2","0.2229","","","","","","1.114","","","","has coordinates","234143","2020-10-21","18:00:00",""
"7124706","15.8008","0.0007","16.2412","0.0011","19.6284","0.0011","107.027","0.004","102.696","0.003","109.127","0.002","4263.5","0.5","296","2","296.15","","","","","","","","","7","P -1","-P 1","2","","","","- C62 H59 F12 N11 O11 P2 Ru3 -","- C62 H59 F12 N11 O11 P2 Ru3 -","- C124 H118 F24 N22 O22 P4 Ru6 -","2","1","","Zhang, Biaobiao; Li, Fei; Zhang, Rong; Ma, Chengbing; Chen, Lin; Sun, Licheng","Characterization of a trinuclear ruthenium species in catalytic water oxidation by Ru(bda)(pic)2 in neutral media.","Chemical communications (Cambridge, England)","2016","52","55","8619","8622","10.1039/c6cc04003a","","","0.71073","MoKα","","0.1127","0.0706","","","0.1891","0.216","","","","","","1.04","","","","has coordinates","234146","2020-10-21","18:00:00",""
"7124707","26.853","0.002","10.1988","0.001","27.005","0.003","90","","90","","90","","7395.8","1.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C47 H34 N6 O3 -","- C47 H34 N6 O3 -","- C376 H272 N48 O24 -","8","2","","Luciano, M.; Tardie, W.; Zeller, M.; Brückner, C","Supersizing pyrrole-modified porphyrins by reversal of the 'breaking and mending' strategy.","Chemical communications (Cambridge, England)","2016","52","66","10133","10136","10.1039/c6cc04028d","","","1.54178","CuKα","","0.2411","0.157","","","0.3456","0.4136","","","","","","1.046","","","","has coordinates","234148","2020-10-21","18:00:00",""
"7124708","11.887","0.0004","10.4572","0.0004","14.8193","0.0005","90","","100.36","0.001","90","","1812.08","0.11","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 O3 -","- C24 H20 O3 -","- C96 H80 O12 -","4","1","","Ma, Ben; Wu, Ziang; Huang, Ben; Liu, Lu; Zhang, Junliang","Gold-catalysed facile access to indene scaffolds via sequential C-H functionalization and 5-endo-dig carbocyclization.","Chemical communications (Cambridge, England)","2016","52","60","9351","9354","10.1039/c6cc04034a","","","0.71073","MoKα","","0.0853","0.0698","","","0.1698","0.1809","","","","","","1.058","","","","has coordinates","234150","2020-10-21","18:00:00",""
"7124709","12.6203","0.0007","10.0898","0.0006","15.4768","0.0009","90","","106.857","0.002","90","","1886.08","0.19","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 O4 -","- C24 H20 O4 -","- C96 H80 O16 -","4","1","","Ma, Ben; Wu, Ziang; Huang, Ben; Liu, Lu; Zhang, Junliang","Gold-catalysed facile access to indene scaffolds via sequential C-H functionalization and 5-endo-dig carbocyclization.","Chemical communications (Cambridge, England)","2016","52","60","9351","9354","10.1039/c6cc04034a","","","0.71073","MoKα","","0.0421","0.0343","","","0.0896","0.0964","","","","","","1.02","","","","has coordinates","234150","2020-10-21","18:00:00",""
"7124710","8.0971","0.0003","11.2035","0.0004","12.1077","0.0004","87.795","0.001","71.122","0.001","74.233","0.001","998.7","0.06","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H16 Br2 O4 -","- C23 H16 Br2 O4 -","- C46 H32 Br4 O8 -","2","1","","Ma, Ben; Wu, Ziang; Huang, Ben; Liu, Lu; Zhang, Junliang","Gold-catalysed facile access to indene scaffolds via sequential C-H functionalization and 5-endo-dig carbocyclization.","Chemical communications (Cambridge, England)","2016","52","60","9351","9354","10.1039/c6cc04034a","","","0.71073","MoKα","","0.0366","0.0295","","","0.0742","0.078","","","","","","1.045","","","","has coordinates","234150","2020-10-21","18:00:00",""
"7124711","12.3202","0.0014","4.6501","0.0005","32.022","0.004","90","","90","","90","","1834.5","0.4","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Chlorphenesin","3-(p-Chlorophenoxy)propane-1,2-diol","","- C18 H22 Cl2 O6 -","- C18 H22 Cl2 O6 -","- C72 H88 Cl8 O24 -","4","1","","Kaufmann, Lena; Kennedy, Stuart R.; Jones, Christopher D.; Steed, Jonathan W.","Cavity-containing supramolecular gels as a crystallization tool for hydrophobic pharmaceuticals.","Chemical communications (Cambridge, England)","2016","52","66","10113","10116","10.1039/c6cc04037c","","","0.71073","MoKα","","0.1131","0.0591","","","0.0948","0.108","","","","","","1.03","","","","has coordinates","234152","2020-10-21","18:00:00",""
"7124712","9.7393","0.0012","9.7393","0.0012","18.532","0.003","90","","90","","120","","1522.3","0.4","293","2","293","2","","","","","","","","6","P 31","P 31","144","","(S)-Diisopropyl(2,2-dioxido-4-phenyl-3,4-dihydrobenzo[e][1,2,3]oxathiazin-4-yl)phosphonate","","- C19 H24 N O6 P S -","- C19 H24 N O6 P S -","- C57 H72 N3 O18 P3 S3 -","3","1","","Yan, Zhong; Wu, Bo; Gao, Xiang; Zhou, Yong-Gui","Enantioselective synthesis of quaternary α-aminophosphonates by Pd-catalyzed arylation of cyclic α-ketiminophosphonates with arylboronic acids.","Chemical communications (Cambridge, England)","2016","52","72","10882","10885","10.1039/c6cc04096a","","","0.71073","MoKα","","0.0409","0.0381","","","0.0876","0.0892","","","","","","1.036","","","","has coordinates","234154","2020-10-21","18:00:00",""
"7124713","14.5223","0.0019","14.5223","0.0019","10.2703","0.0012","90","","90","","120","","1875.8","0.4","110","2","110","2","","","","","","","","5","P 63","P 6c","173","","tris-(4-methylthiazolyl)cyclotriguaiacylene hydrate","","- C36 H41 N3 O10 S3 -","- C36 H33 N3 O10 S3 -","- C72 H66 N6 O20 S6 -","2","0.333333","","Fowler, Jonathan M.; Thorp-Greenwood, Flora L; Warriner, Stuart L.; Willans, Charlotte E.; Hardie, Michaele J.","M12L8 metallo-supramolecular cube with cyclotriguaiacylene-type ligand: spontaneous resolution of cube and its constituent host ligand.","Chemical communications (Cambridge, England)","2016","52","56","8699","8702","10.1039/c6cc04130b","","x-ray","1.54184","CuKα","","0.1323","0.0886","","","0.226","0.2598","","","","","","0.997","","","","has coordinates","234157","2020-10-21","18:00:00",""
"7124714","35.7237","0.0004","35.7237","0.0004","35.7237","0.0004","90","","90","","90","","45590","0.9","120","2","120","2","","","","","","","","7","F 4 3 2","F 4 2 3","209","","octa[tris-(4-methylthiazolyl)cyclotriguaiacylene]dodecasilver(I)rhenate","","- C288 H264 Ag12 N24 O96 Re12 S24 -","- C288 H264 Ag12 N24 O96.02 Re12.02 S24 -","- C1152 H1056 Ag48 N96 O384.08 Re48.08 S96 -","4","0.0416667","","Fowler, Jonathan M.; Thorp-Greenwood, Flora L; Warriner, Stuart L.; Willans, Charlotte E.; Hardie, Michaele J.","M12L8 metallo-supramolecular cube with cyclotriguaiacylene-type ligand: spontaneous resolution of cube and its constituent host ligand.","Chemical communications (Cambridge, England)","2016","52","56","8699","8702","10.1039/c6cc04130b","","x-ray","1.54184","CuKα","","0.1086","0.0847","","","0.2499","0.2886","","","","","","1.035","","","","has coordinates","234157","2020-10-21","18:00:00",""
"7124715","35.4548","0.0007","35.4548","0.0007","35.4548","0.0007","90","","90","","90","","44568.2","1.5","120","2","120","2","","","","","","","","8","F 4 3 2","F 4 2 3","209","","octa[tris-(4-methylthiazolyl)cyclotriguaiacylene]dodecasilver(I)tetrafluoroborate","","- C288 H264 Ag12 B12 F48 N24 O48 S24 -","- C288 H264 Ag12 N24 O48 S24 -","- C1152 H1056 Ag48 N96 O192 S96 -","4","0.0416667","","Fowler, Jonathan M.; Thorp-Greenwood, Flora L; Warriner, Stuart L.; Willans, Charlotte E.; Hardie, Michaele J.","M12L8 metallo-supramolecular cube with cyclotriguaiacylene-type ligand: spontaneous resolution of cube and its constituent host ligand.","Chemical communications (Cambridge, England)","2016","52","56","8699","8702","10.1039/c6cc04130b","","x-ray","1.54184","CuKα","","0.0985","0.0718","","","0.2054","0.2256","","","","","","1.042","","","","has coordinates","234157","2020-10-21","18:00:00",""
"7124716","28.138","0.003","28.138","0.003","4.4445","0.0005","90","","90","","120","","3047.5","0.6","120","2","120","2","","","","","","","","5","R 3 :H","R 3","146","","tris-(4-methylthiazolyl)cyclotriguaiacylene nitromethane clathrate","","- C39 H42 N6 O12 S3 -","- C39 H42 N6 O12 S3 -","- C117 H126 N18 O36 S9 -","3","0.333333","","Fowler, Jonathan M.; Thorp-Greenwood, Flora L; Warriner, Stuart L.; Willans, Charlotte E.; Hardie, Michaele J.","M12L8 metallo-supramolecular cube with cyclotriguaiacylene-type ligand: spontaneous resolution of cube and its constituent host ligand.","Chemical communications (Cambridge, England)","2016","52","56","8699","8702","10.1039/c6cc04130b","","x-ray","1.54184","CuKα","","0.0965","0.0719","","","0.1663","0.1873","","","","","","1.052","","","","has coordinates","234157","2020-10-21","18:00:00",""
"7124717","14.018","0.0001","17.0222","0.0001","19.3743","0.0001","90","","90","","90","","4623.04","0.05","150","","150","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C42.98 H46.96 Ag Cl3.96 N3 O4 P -","- C42.981 H46.96 Ag Cl3.961 N3 O4 P -","- C171.924 H187.84 Ag4 Cl15.844 N12 O16 P4 -","4","1","","de la Campa, Raquel; Gammack Yamagata, Adam D.; Ortín, Irene; Franchino, Allegra; Thompson, Amber L.; Odell, Barbara; Dixon, Darren J.","Catalytic enantio- and diastereoselective Mannich reaction of α-substituted isocyanoacetates and ketimines.","Chemical communications (Cambridge, England)","2016","52","70","10632","10635","10.1039/c6cc04132a","","","1.5418","CuKα","","0.0276","0.027","","0.0715","0.0709","0.0715","","","","","","1.0014","","","","has coordinates,has disorder","234159","2020-10-21","18:00:00",""
"7124718","9.4569","0.001","19.807","0.002","21.941","0.002","90","","96.83","0.002","90","","4080.7","0.7","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C28 H20 O2 -","- C28 H20 O2 -","- C224 H160 O16 -","8","4","","Zhang, Xin; Chen, Lin; Chen, Xiang-Yu; Zhang, Hanzhi; Yang, Liuqing; Yang, Fengchun","Effective separation of single-walled carbon nanotubes and their very different electrochemical behaviours.","Chemical communications (Cambridge, England)","2016","52","59","9287","9290","10.1039/c6cc04139f","","","0.71073","MoKα","","0.0736","0.0473","","","0.1067","0.1277","","","","","","1.017","","","","has coordinates","234161","2020-10-21","18:00:00",""
"7124719","10.784","0.003","10.784","0.003","10.863","0.003","90","","90","","120","","1094.1","0.5","296","2","296","2","","","","","","","","3","P 31","P 31","144","","","","- C20 H14 O2 -","- C20 H14 O2 -","- C60 H42 O6 -","3","1","","Zhang, Xin; Chen, Lin; Chen, Xiang-Yu; Zhang, Hanzhi; Yang, Liuqing; Yang, Fengchun","Effective separation of single-walled carbon nanotubes and their very different electrochemical behaviours.","Chemical communications (Cambridge, England)","2016","52","59","9287","9290","10.1039/c6cc04139f","","","0.71073","MoKα","","0.046","0.0372","","","0.0673","0.0717","","","","","","1.036","","","","has coordinates","234161","2020-10-21","18:00:00",""
"7124720","10.8759","0.0002","13.4395","0.0003","21.2985","0.0004","85.907","0.002","88.885","0.002","88.995","0.002","3104.2","0.11","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H84 Ge10 N7 O12 Rb2 -","- C39 H84 Ge10 N7 O12 Rb2 -","- C78 H168 Ge20 N14 O24 Rb4 -","2","1","","Bentlohner, Manuel M.; Fischer, Christina; Fässler, Thomas F","Synthesis and characterization of pristine closo-[Ge10](2.).","Chemical communications (Cambridge, England)","2016","52","63","9841","9843","10.1039/c6cc04143d","","","0.71073","MoKα","","0.0954","0.0407","","","0.0782","0.0908","","","","","","0.855","","","","has coordinates","234163","2020-10-21","18:00:00",""
"7124721","11.4777","0.0005","15.9325","0.0007","17.0968","0.0008","90","","103.233","0.002","90","","3043.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H32 N4 O2 -","- C38 H32 N4 O2 -","- C152 H128 N16 O8 -","4","1","","Krick, Marcel; Holstein, Julian; Würtele, Christian; Clever, Guido H.","Endohedral dynamics of push-pull rotor-functionalized cages.","Chemical communications (Cambridge, England)","2016","52","68","10411","10414","10.1039/c6cc04155h","","","0.71073","MoKα","","0.0473","0.0411","","","0.1192","0.1246","","","","","","1.116","","","","has coordinates","234166","2020-10-21","18:00:00",""
"7124722","9.7141","0.0003","13.7175","0.0004","13.8642","0.0004","92.206","0.002","97.198","0.002","98.744","0.002","1808.46","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H32 D8 N4 O3 -","- C46 H32 D8 N4 O3 -","- C92 H64 D16 N8 O6 -","2","1","","Krick, Marcel; Holstein, Julian; Würtele, Christian; Clever, Guido H.","Endohedral dynamics of push-pull rotor-functionalized cages.","Chemical communications (Cambridge, England)","2016","52","68","10411","10414","10.1039/c6cc04155h","","","1.54178","CuKα","","0.0643","0.0477","","","0.1094","0.1183","","","","","","1.047","","","","has coordinates,has disorder","234166","2020-10-21","18:00:00",""
"7124723","15.79","0.003","17.796","0.003","16.457","0.003","90","","104.672","0.004","90","","4473.6","1.4","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H43 Br6 N9 P2 -","- C40 H43 Br6 N9 P2 -","- C160 H172 Br24 N36 P8 -","4","1","","Đorđević, Nemanja; Ganguly, Rakesh; Petković, Milena; Vidović, Dragoslav","Bis(carbodicarbene)phosphenium trication: the case against hypervalency.","Chemical communications (Cambridge, England)","2016","52","63","9789","9792","10.1039/c6cc04161b","","","0.71073","MoKα","","0.1305","0.0771","","","0.1104","0.1273","","","","","","1.062","","","","has coordinates","234168","2020-10-21","18:00:00",""
"7124724","12.1048","0.0003","13.7318","0.0004","16.1379","0.0005","108.884","0.0016","98.2298","0.0014","102.753","0.0014","2407.61","0.12","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C84 H93.9 Br2 F24 N19.05 O0.47 P2 Sb4 -","- C84 H93.896 Br2 F24 N19.052 O0.474 P2 Sb4 -","- C84 H93.896 Br2 F24 N19.052 O0.474 P2 Sb4 -","1","0.5","","Đorđević, Nemanja; Ganguly, Rakesh; Petković, Milena; Vidović, Dragoslav","Bis(carbodicarbene)phosphenium trication: the case against hypervalency.","Chemical communications (Cambridge, England)","2016","52","63","9789","9792","10.1039/c6cc04161b","","","0.71073","MoKα","","0.117","0.0532","","","0.0988","0.1178","","","","","","1.021","","","","has coordinates,has disorder","234168","2020-10-21","18:00:00",""
"7124725","9.3318","0.0006","16.3035","0.0009","18.6019","0.001","94.673","0.002","90.768","0.002","100.362","0.002","2773.6","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H26 F2 -","- C38 H26 F2 -","- C152 H104 F8 -","4","2","","Zhuang, Zeyan; Shen, Pingchuan; Ding, Siyang; Luo, Wenwen; He, Bairong; Nie, Han; Wang, Bohan; Huang, Tianbai; Hu, Rongrong; Qin, Anjun; Zhao, Zujin; Tang, Ben Zhong","Synthesis, aggregation-enhanced emission, polymorphism and piezochromism of TPE-cored foldamers with through-space conjugation.","Chemical communications (Cambridge, England)","2016","52","72","10842","10845","10.1039/c6cc04233c","","","0.71073","MoKα","","0.1145","0.0486","","","0.0878","0.1049","","","","","","1.055","","","","has coordinates","234172","2020-10-21","18:00:00",""
"7124726","10.2875","0.001","9.5469","0.0008","30.516","0.003","90","","90.739","0.002","90","","2996.8","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H28 Cl2 N2 -","- C37 H28 Cl2 N2 -","- C148 H112 Cl8 N8 -","4","1","","Zhuang, Zeyan; Shen, Pingchuan; Ding, Siyang; Luo, Wenwen; He, Bairong; Nie, Han; Wang, Bohan; Huang, Tianbai; Hu, Rongrong; Qin, Anjun; Zhao, Zujin; Tang, Ben Zhong","Synthesis, aggregation-enhanced emission, polymorphism and piezochromism of TPE-cored foldamers with through-space conjugation.","Chemical communications (Cambridge, England)","2016","52","72","10842","10845","10.1039/c6cc04233c","","","0.71073","MoKα","","0.1042","0.0524","","","0.1159","0.1383","","","","","","1.044","","","","has coordinates","234172","2020-10-21","18:00:00",""
"7124727","9.6317","0.0006","9.5173","0.0005","33.0419","0.0018","90","","96.269","0.002","90","","3010.8","0.3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 S2 -","- C40 H32 S2 -","- C160 H128 S8 -","4","1","","Zhuang, Zeyan; Shen, Pingchuan; Ding, Siyang; Luo, Wenwen; He, Bairong; Nie, Han; Wang, Bohan; Huang, Tianbai; Hu, Rongrong; Qin, Anjun; Zhao, Zujin; Tang, Ben Zhong","Synthesis, aggregation-enhanced emission, polymorphism and piezochromism of TPE-cored foldamers with through-space conjugation.","Chemical communications (Cambridge, England)","2016","52","72","10842","10845","10.1039/c6cc04233c","","","0.71073","MoKα","","0.0776","0.0455","","","0.0977","0.109","","","","","","1.035","","","","has coordinates","234172","2020-10-21","18:00:00",""
"7124728","16.2653","0.0011","11.5962","0.0006","18.2995","0.0016","90","","115.9","0.002","90","","3104.9","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 S2 -","- C40 H32 S2 -","- C160 H128 S8 -","4","1","","Zhuang, Zeyan; Shen, Pingchuan; Ding, Siyang; Luo, Wenwen; He, Bairong; Nie, Han; Wang, Bohan; Huang, Tianbai; Hu, Rongrong; Qin, Anjun; Zhao, Zujin; Tang, Ben Zhong","Synthesis, aggregation-enhanced emission, polymorphism and piezochromism of TPE-cored foldamers with through-space conjugation.","Chemical communications (Cambridge, England)","2016","52","72","10842","10845","10.1039/c6cc04233c","","","0.71073","MoKα","","0.0907","0.0446","","","0.0882","0.1053","","","","","","1.032","","","","has coordinates","234172","2020-10-21","18:00:00",""
"7124729","11.5187","0.0001","12.8279","0.0002","23.1283","0.0003","90","","96.529","0.001","90","","3395.29","0.08","140","2","140","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H36 Br Cl4 Ir N2 -","- C35 H36 Br Cl4 Ir N2 -","- C140 H144 Br4 Cl16 Ir4 N8 -","4","1","","Hellou, Nora; Jahier-Diallo, Claire; Baslé, Olivier; Srebro-Hooper, Monika; Toupet, Loïc; Roisnel, Thierry; Caytan, Elsa; Roussel, Christian; Vanthuyne, Nicolas; Autschbach, Jochen; Mauduit, Marc; Crassous, Jeanne","Electronic and chiroptical properties of chiral cycloiridiated complexes bearing helicenic NHC ligands.","Chemical communications (Cambridge, England)","2016","52","59","9243","9246","10.1039/c6cc04257k","","","0.71073","MoKα","","0.0471","0.0375","","","0.0941","0.103","","","","","","1.11","","","","has coordinates","234174","2020-10-21","18:00:00",""
"7124730","13.7643","0.0008","14.1122","0.0007","16.9238","0.0009","90","","90","","90","","3287.4","0.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C41 H36 Br Ir N2 -","- C41 H36 Br Ir N2 -","- C164 H144 Br4 Ir4 N8 -","4","1","","Hellou, Nora; Jahier-Diallo, Claire; Baslé, Olivier; Srebro-Hooper, Monika; Toupet, Loïc; Roisnel, Thierry; Caytan, Elsa; Roussel, Christian; Vanthuyne, Nicolas; Autschbach, Jochen; Mauduit, Marc; Crassous, Jeanne","Electronic and chiroptical properties of chiral cycloiridiated complexes bearing helicenic NHC ligands.","Chemical communications (Cambridge, England)","2016","52","59","9243","9246","10.1039/c6cc04257k","","x-ray","1.54184","CuKα","","0.0204","0.0203","","","0.0544","0.0544","","","","","","1.044","","","","has coordinates","234174","2020-10-21","18:00:00",""
"7124731","9.2873","0.0008","16.9087","0.0016","17.495","0.0016","90","","90","","90","","2747.3","0.4","150","","150","","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H32 Br Ir N2 -","- C33 H32 Br Ir N2 -","- C132 H128 Br4 Ir4 N8 -","4","1","","Hellou, Nora; Jahier-Diallo, Claire; Baslé, Olivier; Srebro-Hooper, Monika; Toupet, Loïc; Roisnel, Thierry; Caytan, Elsa; Roussel, Christian; Vanthuyne, Nicolas; Autschbach, Jochen; Mauduit, Marc; Crassous, Jeanne","Electronic and chiroptical properties of chiral cycloiridiated complexes bearing helicenic NHC ligands.","Chemical communications (Cambridge, England)","2016","52","59","9243","9246","10.1039/c6cc04257k","","x-ray","0.71073","MoKα","","0.0681","0.0487","","","0.1137","0.1267","","","","","","1.138","","","","has coordinates","234174","2020-10-21","18:00:00",""
"7124732","9.797","0.0002","9.3477","0.0002","19.3037","0.0005","90","","103.385","0.001","90","","1719.8","0.07","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 N2 O2 -","- C20 H20 N2 O2 -","- C80 H80 N8 O8 -","4","1","","Kim, Won Young; Shi, Hu; Jung, Hyo Sung; Cho, Daeheum; Verwilst, Peter; Lee, Jin Yong; Kim, Jong Seung","Coumarin-decorated Schiff base hydrolysis as an efficient driving force for the fluorescence detection of water in organic solvents.","Chemical communications (Cambridge, England)","2016","52","56","8675","8678","10.1039/c6cc04285f","","","0.71073","MoKα","","0.0819","0.0507","","","0.1422","0.1623","","","","","","1.043","","","","has coordinates","234176","2020-10-21","18:00:00",""
"7124733","7.9685","0.0009","10.0372","0.0013","20.628","0.003","90","","91.778","0.008","90","","1649.1","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N3 O2 -","- C19 H19 N3 O2 -","- C76 H76 N12 O8 -","4","1","","Kim, Won Young; Shi, Hu; Jung, Hyo Sung; Cho, Daeheum; Verwilst, Peter; Lee, Jin Yong; Kim, Jong Seung","Coumarin-decorated Schiff base hydrolysis as an efficient driving force for the fluorescence detection of water in organic solvents.","Chemical communications (Cambridge, England)","2016","52","56","8675","8678","10.1039/c6cc04285f","","","0.71073","MoKα","","0.1772","0.0648","","","0.1466","0.1963","","","","","","0.912","","","","has coordinates","234176","2020-10-21","18:00:00",""
"7124734","8.2754","0.0017","12.082","0.002","13.332","0.003","90","","90","","90","","1333","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 F N O3 -","- C14 H14 F N O3 -","- C56 H56 F4 N4 O12 -","4","1","","Liu, Jianchao; Xu, Xiaobing; Li, Jiuyi; Liu, Bo; Jiang, Huanfeng; Yin, Biaolin","Palladium-catalyzed dearomatizing 2,5-alkoxyarylation of furan rings: diastereospecific access to spirooxindoles.","Chemical communications (Cambridge, England)","2016","52","61","9550","9553","10.1039/c6cc04298h","","","0.71073","MoKα","","0.0513","0.033","","","0.0777","0.0902","","","","","","1.008","","","","has coordinates","234178","2020-10-21","18:00:00",""
"7124735","14.349","0.003","7.2477","0.0014","14.692","0.003","90","","105.12","0.03","90","","1475","0.6","571","2","571","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 N O4 -","- C17 H19 N O4 -","- C68 H76 N4 O16 -","4","1","","Liu, Jianchao; Xu, Xiaobing; Li, Jiuyi; Liu, Bo; Jiang, Huanfeng; Yin, Biaolin","Palladium-catalyzed dearomatizing 2,5-alkoxyarylation of furan rings: diastereospecific access to spirooxindoles.","Chemical communications (Cambridge, England)","2016","52","61","9550","9553","10.1039/c6cc04298h","","","0.71073","MoKα","","0.156","0.0476","","","0.0894","0.1202","","","","","","0.845","","","","has coordinates","234178","2020-10-21","18:00:00",""
"7124736","6.0661","0.0004","7.8841","0.0005","12.8564","0.0008","91.07","0.004","94.098","0.004","97.33","0.003","608.04","0.07","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C28 H24 N4 O4 -","2","1","","Singh, RahulKumar Rajmani; Pawar, Samir Kundlik; Huang, Min-Jie; Liu, Rai-Shung","Gold-catalyzed [3+2]-annulations of α-aryl diazonitriles with ynamides and allenamides to yield 1-amino-1H-indenes.","Chemical communications (Cambridge, England)","2016","52","76","11434","11437","10.1039/c6cc04308a","","","0.71073","MoKα","","0.0609","0.046","","","0.135","0.1556","","","","","","1.127","","","","has coordinates","234180","2020-10-21","18:00:00",""
"7124737","9.2837","0.0004","9.9699","0.0004","9.9836","0.0004","92.401","0.002","112.162","0.002","116.147","0.002","743.75","0.06","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H16 N2 O2 -","- C16 H18 N2 O3 -","- C32 H36 N4 O6 -","2","1","","Singh, RahulKumar Rajmani; Pawar, Samir Kundlik; Huang, Min-Jie; Liu, Rai-Shung","Gold-catalyzed [3+2]-annulations of α-aryl diazonitriles with ynamides and allenamides to yield 1-amino-1H-indenes.","Chemical communications (Cambridge, England)","2016","52","76","11434","11437","10.1039/c6cc04308a","","","0.71073","MoKα","","0.0601","0.049","","","0.1503","0.1634","","","","","","1.091","","","","has coordinates","234180","2020-10-21","18:00:00",""
"7124738","8.4209","0.0005","28.5775","0.0016","6.9049","0.0004","90","","101.544","0.002","90","","1628.04","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 N2 O2 S -","- C18 H16 N2 O2 S -","- C72 H64 N8 O8 S4 -","4","1","","Singh, RahulKumar Rajmani; Pawar, Samir Kundlik; Huang, Min-Jie; Liu, Rai-Shung","Gold-catalyzed [3+2]-annulations of α-aryl diazonitriles with ynamides and allenamides to yield 1-amino-1H-indenes.","Chemical communications (Cambridge, England)","2016","52","76","11434","11437","10.1039/c6cc04308a","","","0.71073","MoKα","","0.0405","0.0341","","","0.0965","0.1087","","","","","","1.138","","","","has coordinates","234180","2020-10-21","18:00:00",""
"7124739","6.5556","0.0003","11.4813","0.0006","12.6356","0.0007","113.781","0.003","98.198","0.003","93.092","0.003","854.85","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H17 N O4 S -","- C18 H17 N O4 S -","- C36 H34 N2 O8 S2 -","2","1","","Singh, RahulKumar Rajmani; Pawar, Samir Kundlik; Huang, Min-Jie; Liu, Rai-Shung","Gold-catalyzed [3+2]-annulations of α-aryl diazonitriles with ynamides and allenamides to yield 1-amino-1H-indenes.","Chemical communications (Cambridge, England)","2016","52","76","11434","11437","10.1039/c6cc04308a","","","0.71073","MoKα","","0.0685","0.0454","","","0.1305","0.1637","","","","","","1.126","","","","has coordinates","234180","2020-10-21","18:00:00",""
"7124740","16.2768","0.0007","16.3003","0.0007","23.6077","0.0008","94.242","0.003","95.588","0.003","115.579","0.004","5575.6","0.4","100","","100","","","","","","","","","5","P -1","-P 1","2","","hexakis(carboxyphenyl)dodecadehydrotribenzo[18]annulene, fullerene, N,N-dimethylformamide, 1,2,4-trichlorobenzene solvate","","- C162 H66 Cl8 N2 O14 -","- C162 H66 Cl8 N2 O14 -","- C324 H132 Cl16 N4 O28 -","2","1","","Hisaki, Ichiro; Nakagawa, Shoichi; Sato, Hiroyasu; Tohnai, Norimitsu","Alignment of paired molecules of C60 within a hexagonal platform networked through hydrogen-bonds.","Chemical communications (Cambridge, England)","2016","52","63","9781","9784","10.1039/c6cc04310k","","","1.54187","CuKα","","0.2061","0.1414","","","0.3894","0.4453","","","","","","1.513","","","","has coordinates,has disorder","234183","2020-10-21","18:00:00",""
"7124741","13.8208","0.0004","17.4812","0.0006","24.2884","0.0009","76.082","0.003","87.204","0.003","70.991","0.003","5382.5","0.3","100","","100","","","","","","","","","4","P -1","-P 1","2","","hexakis(carboxyphenyl)dodecadehydrotribenzo[18]annulene, fullerene, 1,2,4-trichlorobenzene solvate","","- C156 H51 Cl8 O12 -","- C155.994 H51 Cl8 O12 -","- C311.988 H102 Cl16 O24 -","2","1","","Hisaki, Ichiro; Nakagawa, Shoichi; Sato, Hiroyasu; Tohnai, Norimitsu","Alignment of paired molecules of C60 within a hexagonal platform networked through hydrogen-bonds.","Chemical communications (Cambridge, England)","2016","52","63","9781","9784","10.1039/c6cc04310k","","","1.54187","CuKα","","0.2079","0.1497","","","0.4025","0.4352","","","","","","1.478","","","","has coordinates,has disorder","234183","2020-10-21","18:00:00",""
"7124742","12.0893","0.0003","17.1939","0.0004","24.6711","0.0006","104.88","0.002","90.051","0.0019","98.347","0.0019","4899.8","0.2","213","","213","","","","","","","","","5","P -1","-P 1","2","","hexakis(carboxyphenyl)dodecadehydrotribenzo[18]annulene 1,2-dichlorobenzene N,N-dimethylformamide solvate","","- C93 H55 Cl6 N O13 -","- C93 H55 Cl6 N O13 -","- C186 H110 Cl12 N2 O26 -","2","1","","Hisaki, Ichiro; Nakagawa, Shoichi; Sato, Hiroyasu; Tohnai, Norimitsu","Alignment of paired molecules of C60 within a hexagonal platform networked through hydrogen-bonds.","Chemical communications (Cambridge, England)","2016","52","63","9781","9784","10.1039/c6cc04310k","","","0.8","synchrotron","","0.1353","0.1254","","","0.3936","0.4149","","","","","","1.892","","","","has coordinates,has disorder","234183","2020-10-21","18:00:00",""
"7124743","13.7506","0.0003","7.06591","0.00011","19.8176","0.0004","90","","109.476","0.002","90","","1815.31","0.06","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","PPA-Ru(II) 5","","- C18 H23 Cl2 N O2 Ru -","- C18 H23 Cl2 N O2 Ru -","- C72 H92 Cl8 N4 O8 Ru4 -","4","1","","Ma, Lili; Ma, Rong; Wang, Zhigang; Yiu, Shek-Man; Zhu, Guangyu","Heterodinuclear Pt(iv)-Ru(ii) anticancer prodrugs to combat both drug resistance and tumor metastasis.","Chemical communications (Cambridge, England)","2016","52","71","10735","10738","10.1039/c6cc04354b","","","1.54178","CuKα","","0.0565","0.0539","","","0.1584","0.164","","","","","","1.105","","","","has coordinates","234185","2020-10-21","18:00:00",""
"7124744","8.8701","0.0003","12.497","0.0004","17.2431","0.0006","92.445","0.003","103.722","0.003","104.921","0.003","1783.24","0.11","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","PPA-Pt(IV)","","- C9.5 H20 Cl3 N3 O4 Pt S0.5 -","- C9.5 H20 Cl3 N3 O4 Pt S0.5 -","- C38 H80 Cl12 N12 O16 Pt4 S2 -","4","2","","Ma, Lili; Ma, Rong; Wang, Zhigang; Yiu, Shek-Man; Zhu, Guangyu","Heterodinuclear Pt(iv)-Ru(ii) anticancer prodrugs to combat both drug resistance and tumor metastasis.","Chemical communications (Cambridge, England)","2016","52","71","10735","10738","10.1039/c6cc04354b","","","0.71073","MoKα","","0.0404","0.0304","","","0.0714","0.0789","","","","","","1.083","","","","has coordinates,has disorder","234185","2020-10-21","18:00:00",""
"7124745","12.8054","0.0014","12.7662","0.0014","20.774","0.002","90","","104.821","0.002","90","","3283.1","0.6","168","2","168","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H46 Ir O2 P3 -","- C28 H46 Ir O2 P3 -","- C112 H184 Ir4 O8 P12 -","4","1","","Paul, Ursula S. D.; Braunschweig, Holger; Radius, Udo","Iridium-catalysed dehydrocoupling of aryl phosphine-borane adducts: synthesis and characterisation of high molecular weight poly(phosphinoboranes).","Chemical communications (Cambridge, England)","2016","52","55","8573","8576","10.1039/c6cc04363a","","","0.71073","MoKα","","0.0243","0.0199","","","0.0463","0.0485","","","","","","1.069","","","","has coordinates","234188","2020-10-21","18:00:00",""
"7124746","10.2215","0.0011","11.864","0.0013","16.0253","0.0018","103.712","0.002","100.633","0.002","93.622","0.002","1843.9","0.4","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H48 Ir O2 P3 -","- C29 H48 Ir O2 P3 -","- C58 H96 Ir2 O4 P6 -","2","1","","Paul, Ursula S. D.; Braunschweig, Holger; Radius, Udo","Iridium-catalysed dehydrocoupling of aryl phosphine-borane adducts: synthesis and characterisation of high molecular weight poly(phosphinoboranes).","Chemical communications (Cambridge, England)","2016","52","55","8573","8576","10.1039/c6cc04363a","","","0.71073","MoKα","","0.0247","0.0218","","","0.0524","0.0541","","","","","","1.067","","","","has coordinates,has disorder","234188","2020-10-21","18:00:00",""
"7124747","10.5197","0.0011","20.993","0.002","30.334","0.003","90","","99.463","0.002","90","","6607.8","1.1","168","2","168","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H52 Ir O2 P3 -","- C31 H52 Ir O2 P3 -","- C248 H416 Ir8 O16 P24 -","8","1","","Paul, Ursula S. D.; Braunschweig, Holger; Radius, Udo","Iridium-catalysed dehydrocoupling of aryl phosphine-borane adducts: synthesis and characterisation of high molecular weight poly(phosphinoboranes).","Chemical communications (Cambridge, England)","2016","52","55","8573","8576","10.1039/c6cc04363a","","","0.71073","MoKα","","0.0394","0.0328","","","0.0676","0.07","","","","","","1.212","","","","has coordinates,has disorder","234188","2020-10-21","18:00:00",""
"7124748","12.8121","0.0012","12.7747","0.0012","20.771","0.002","90","","104.573","0.001","90","","3290.2","0.5","168","2","168","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H48 Ir O2 P3 -","- C28 H48 Ir O2 P3 -","- C112 H192 Ir4 O8 P12 -","4","1","","Paul, Ursula S. D.; Braunschweig, Holger; Radius, Udo","Iridium-catalysed dehydrocoupling of aryl phosphine-borane adducts: synthesis and characterisation of high molecular weight poly(phosphinoboranes).","Chemical communications (Cambridge, England)","2016","52","55","8573","8576","10.1039/c6cc04363a","","","0.71073","MoKα","","0.0185","0.0161","","","0.0397","0.0404","","","","","","1.05","","","","has coordinates","234188","2020-10-21","18:00:00",""
"7124749","10.23","0.0009","11.9105","0.001","15.9818","0.0014","103.735","0.001","100.957","0.001","93.714","0.001","1844.8","0.3","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H50 Ir O2 P3 -","- C29 H50 Ir O2 P3 -","- C58 H100 Ir2 O4 P6 -","2","1","","Paul, Ursula S. D.; Braunschweig, Holger; Radius, Udo","Iridium-catalysed dehydrocoupling of aryl phosphine-borane adducts: synthesis and characterisation of high molecular weight poly(phosphinoboranes).","Chemical communications (Cambridge, England)","2016","52","55","8573","8576","10.1039/c6cc04363a","","","0.71073","MoKα","","0.0204","0.0187","","","0.0474","0.0482","","","","","","1.068","","","","has coordinates","234188","2020-10-21","18:00:00",""
"7124750","10.901","0.0013","12.686","0.0015","15.2272","0.0017","78.184","0.001","72.973","0.001","73.418","0.001","1912.8","0.4","168","2","168","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H66 Ir O2 P3 -","- C36 H66 Ir O2 P3 -","- C72 H132 Ir2 O4 P6 -","2","1","","Paul, Ursula S. D.; Braunschweig, Holger; Radius, Udo","Iridium-catalysed dehydrocoupling of aryl phosphine-borane adducts: synthesis and characterisation of high molecular weight poly(phosphinoboranes).","Chemical communications (Cambridge, England)","2016","52","55","8573","8576","10.1039/c6cc04363a","","","0.71073","MoKα","","0.0189","0.0176","","","0.0412","0.0418","","","","","","1.069","","","","has coordinates,has disorder","234188","2020-10-21","18:00:00",""
"7124751","7.2874","0.0003","14.4206","0.0005","15.0229","0.0006","64.011","0.004","79.684","0.003","83.373","0.003","1394.93","0.11","123","0.3","123","0.3","","","","","","","","4","P -1","-P 1","2","","","","- C40 H30 N2 O2 -","- C40 H30 N2 O2 -","- C80 H60 N4 O4 -","2","1","","Das, Amrita; Ghosh, Indrajit; König, Burkhard","Synthesis of pyrrolo[1,2-a]quinolines and ullazines by visible light mediated one- and twofold annulation of N-arylpyrroles with arylalkynes.","Chemical communications (Cambridge, England)","2016","52","56","8695","8698","10.1039/c6cc04366f","","x-ray","1.54184","CuKα","","0.0596","0.0547","","","0.1595","0.1658","","","","","","1.029","","","","has coordinates","234191","2020-10-21","18:00:00",""
"7124752","16.4245","0.0003","7.25848","0.00014","13.1153","0.0003","90","","108.39","0.002","90","","1483.72","0.05","123.01","0.1","123.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 Cl N O -","- C20 H14 Cl N O -","- C80 H56 Cl4 N4 O4 -","4","1","","Das, Amrita; Ghosh, Indrajit; König, Burkhard","Synthesis of pyrrolo[1,2-a]quinolines and ullazines by visible light mediated one- and twofold annulation of N-arylpyrroles with arylalkynes.","Chemical communications (Cambridge, England)","2016","52","56","8695","8698","10.1039/c6cc04366f","","x-ray","1.54184","CuKα","","0.0383","0.0327","","","0.0851","0.0893","","","","","","1.056","","","","has coordinates","234191","2020-10-21","18:00:00",""
"7124753","10.3206","0.0004","11.6585","0.0005","18.3971","0.0008","90","","90","","90","","2213.59","0.16","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","ME4","","","- C25 H24 Cl N3 O -","- C25 H24 Cl N3 O -","- C100 H96 Cl4 N12 O4 -","4","1","","Ma, Jiajia; Harms, Klaus; Meggers, Eric","Enantioselective rhodium/ruthenium photoredox catalysis en route to chiral 1,2-aminoalcohols.","Chemical communications (Cambridge, England)","2016","52","66","10183","10186","10.1039/c6cc04397f","","","0.71073","MoKα","","0.0447","0.0352","","","0.0705","0.0736","","","","","","1.06","","","","has coordinates","234193","2020-10-21","18:00:00",""
"7124754","17.1583","0.0011","17.7095","0.0011","18.8292","0.0012","66.918","0.002","69.054","0.002","76.796","0.002","4889.7","0.5","110","2","110","2","","","","","","","","9","P -1","-P 1","2","","","","- C48.4 H49.6 Cl2 F6 N4 O P Rh S2 -","- C48.4 H49.6 Cl2 F6 N4 O P Rh S2 -","- C193.6 H198.4 Cl8 F24 N16 O4 P4 Rh4 S8 -","4","2","","Ma, Jiajia; Harms, Klaus; Meggers, Eric","Enantioselective rhodium/ruthenium photoredox catalysis en route to chiral 1,2-aminoalcohols.","Chemical communications (Cambridge, England)","2016","52","66","10183","10186","10.1039/c6cc04397f","","","0.71073","MoKα","","0.0785","0.0565","","","0.1329","0.1437","","","","","","1.039","","","","has coordinates,has disorder","234193","2020-10-21","18:00:00",""
"7124755","12.0683","0.0006","10.1464","0.0005","12.6315","0.0006","90","","91.893","0.001","90","","1545.88","0.13","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H46 Mo2 N2 Ni2 O16 -","- C16 H46 Mo2 N2 Ni2 O16 -","- C32 H92 Mo4 N4 Ni4 O32 -","2","0.5","","Kuznetsov, Denis A.; Konev, Dmitry V.; Komarova, Natal'ya S.; Ionov, Andrey M.; Mozhchil, Rais N.; Fedyanin, Ivan V.","Ni-based heterogeneous catalyst from a designed molecular precursor for the efficient electrochemical water oxidation.","Chemical communications (Cambridge, England)","2016","52","59","9255","9258","10.1039/c6cc04400j","","","0.71073","MoKα","","0.0264","0.0217","","","0.0502","0.0522","","","","","","1.04","","","","has coordinates","234195","2020-10-21","18:00:00",""
"7124756","42.9184","0.0007","20.7337","0.0003","28.9827","0.0004","90","","125.086","0.001","90","","21104.1","0.6","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C106 H74.5 B3.5 F13.88 I0.5 N21 O4 Pd2 -","- C106 H87 B3.487 F13.948 I0.513 N21 O4 Pd2 -","- C848 H696 B27.896 F111.584 I4.104 N168 O32 Pd16 -","8","1","","Li, Yu-Hao; Jiang, Ji-Jun; Fan, Yan-Zhong; Wei, Zhang-Wen; Chen, Cheng-Xia; Yu, Hui-Juan; Zheng, Shao-Ping; Fenske, Dieter; Su, Cheng-Yong; Barboiu, Mihail","Solvent- and anion-induced interconversions of metal-organic cages.","Chemical communications (Cambridge, England)","2016","52","56","8745","8748","10.1039/c6cc04420d","","","1.54178","CuKα","","0.0739","0.0547","","","0.1468","0.164","","","","","","1.033","","","","has coordinates,has disorder","234197","2020-10-21","18:00:00",""
"7124757","43.0462","0.0013","20.744","0.0004","28.9748","0.0007","90","","125.766","0.003","90","","20993.7","1.2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C98 H75 B4 F16 N17 O4 Pd2 -","- C98 H75 B4 F16 N17 O4 Pd2 -","- C784 H600 B32 F128 N136 O32 Pd16 -","8","1","","Li, Yu-Hao; Jiang, Ji-Jun; Fan, Yan-Zhong; Wei, Zhang-Wen; Chen, Cheng-Xia; Yu, Hui-Juan; Zheng, Shao-Ping; Fenske, Dieter; Su, Cheng-Yong; Barboiu, Mihail","Solvent- and anion-induced interconversions of metal-organic cages.","Chemical communications (Cambridge, England)","2016","52","56","8745","8748","10.1039/c6cc04420d","","","1.54178","CuKα","","0.1496","0.0927","","","0.2049","0.2488","","","","","","1.045","","","","has coordinates","234197","2020-10-21","18:00:00",""
"7124758","16.792","0.003","19.978","0.004","23.171","0.005","102.93","0.03","101.11","0.03","112.55","0.03","6654","4","100","2","100","","","","","","","","","4","P -1","-P 1","2","","","","- C106 H56 N6 O2 -","- C106 H56 N6 O2 -","- C212 H112 N12 O4 -","2","1","","Burgun, Alexandre; Valente, Peter; Evans, Jack D.; Huang, David M.; Sumby, Christopher J.; Doonan, Christian J.","Endohedrally functionalised porous organic cages.","Chemical communications (Cambridge, England)","2016","52","57","8850","8853","10.1039/c6cc04423a","","","0.71073","Synchrotron","","0.1527","0.1241","","","0.3369","0.3559","","","","","","1.328","","","","has coordinates","234200","2020-10-21","18:00:00",""
"7124759","31.58","0.006","18.296","0.004","20.075","0.004","90","","90","","90","","11599","4","100","2","100","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C110 H60 N2 O2 -","- C110 H60.0002 N1.9998 O2 -","- C440.001 H240.001 N7.9992 O8 -","4","0.5","","Burgun, Alexandre; Valente, Peter; Evans, Jack D.; Huang, David M.; Sumby, Christopher J.; Doonan, Christian J.","Endohedrally functionalised porous organic cages.","Chemical communications (Cambridge, England)","2016","52","57","8850","8853","10.1039/c6cc04423a","","","0.71073","Synchrotron","","0.1068","0.0942","","","0.2643","0.2764","","","","","","1.084","","","","has coordinates,has disorder","234200","2020-10-21","18:00:00",""
"7124760","39.28","0.006","39.28","0.006","39.78","0.008","90","","90","","90","","61377","18","100","2","100","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- C116 H66 N2 O2 -","- C116 H66.0002 N1.9998 O2 -","- C1856 H1056 N31.9968 O32 -","16","0.5","","Burgun, Alexandre; Valente, Peter; Evans, Jack D.; Huang, David M.; Sumby, Christopher J.; Doonan, Christian J.","Endohedrally functionalised porous organic cages.","Chemical communications (Cambridge, England)","2016","52","57","8850","8853","10.1039/c6cc04423a","","","0.71073","Synchrotron","","0.105","0.091","","","0.263","0.2806","","","","","","1.141","","","","has coordinates,has disorder","234200","2020-10-21","18:00:00",""
"7124761","8.0877","0.0004","8.9461","0.0004","10.5339","0.0005","93.626","0.002","92.834","0.002","94.652","0.002","756.99","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H21 N O3 -","- C17 H21 N O3 -","- C34 H42 N2 O6 -","2","1","","Kaishap, Partha Pratim; Sarma, Bipul; Gogoi, Sanjib","The amide C-N bond of isatins as the directing group and the internal oxidant in Ru-catalyzed C-H activation and annulation reactions: access to 8-amido isocoumarins.","Chemical communications (Cambridge, England)","2016","52","63","9809","9812","10.1039/c6cc04461a","","","0.71073","MoKα","","0.0476","0.0447","","","0.1174","0.1211","","","","","","1.062","","","","has coordinates","234202","2020-10-21","18:00:00",""
"7124762","44.593","0.009","51.642","0.01","38.959","0.008","90","","107.1","0.03","90","","85751","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C798 H638 Ca17 N72 O322 -","- C798 H710 Ca19 N72 O322 -","- C1596 H1420 Ca38 N144 O644 -","2","0.5","","Mandal, Pradeep K.; Kauffmann, Brice; Destecroix, Harry; Ferrand, Yann; Davis, Anthony P.; Huc, Ivan","Crystal structure of a complex between β-glucopyranose and a macrocyclic receptor with dendritic multicharged water solubilizing chains.","Chemical communications (Cambridge, England)","2016","52","60","9355","9358","10.1039/c6cc04466b","","","0.8726","synchrotronradiation","","0.1832","0.1428","","","0.4199","0.4574","","","","","","1.801","","","","has coordinates","234205","2020-10-21","18:00:00",""
"7124763","12.865","0.003","18.623","0.005","22.483","0.006","90","","90.143","0.004","90","","5387","2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cis-DNP-Calix[4]pyrrole-TBABr","Cis-Dinitrophenyl-Calix[4]pyrrole-Tetrabutylammonium bromide","","- C54 H72 Br N9 O8 -","- C54 H72 Br N9 O8 -","- C216 H288 Br4 N36 O32 -","4","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.1348","0.1197","","","0.2515","0.2598","","","","","","1.366","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124764","13.0109","0.0016","18.833","0.002","22.702","0.003","90","","90.423","0.003","90","","5562.6","1.2","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cis-DNP-Calix[4]pyrrole-TBACl","Cis-Dintrophenyl-calix[4]pyrrole-tetrabutylammonium chloride","","- C54 H72 Cl N9 O8 -","- C54 H72 Cl N9 O8 -","- C216 H288 Cl4 N36 O32 -","4","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.1187","0.0666","","","0.1447","0.1677","","","","","","1.099","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124765","21.335","0.012","15.168","0.008","37.948","0.019","90","","90","","90","","12280","11","223","2","223","2","","","","","","","","5","P c a 21","P 2c -2ac","29","Cis-DNP-Calix[4]pyrrole-TBAI","Cis-dinitrophenyl-cali[4]pyrrole, terabutylammonium iodide","","- C54 H72 I N9 O8 -","- C54 H72 I N9 O8 -","- C432 H576 I8 N72 O64 -","8","2","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.0916","0.0688","","","0.1835","0.209","","","","","","1.016","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124766","12.9168","0.0007","18.9009","0.001","22.5896","0.0012","90","","90.65","0.003","90","","5514.7","0.5","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Cis-DNP-C4P-TBAF/Cl","Cis-Dintrophenyl-calix[4]pyrrole-Tetrabutylammonium fluoride/chloride","","- C54 H72 Cl0.63 F0.37 N9 O8 -","- C54 H72 Cl0.63 F0.37 N9 O8 -","- C216 H288 Cl2.52 F1.48 N36 O32 -","4","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.1487","0.0757","","","0.1577","0.2084","","","","","","1.278","","","","has coordinates,has disorder","234208","2020-10-21","18:00:00",""
"7124767","18.5581","0.0012","19.3272","0.0012","23.1017","0.0015","86.218","0.002","87.845","0.002","81.721","0.002","8178.5","0.9","123","2","123","2","","","","","","","","6","P -1","-P 1","2","Cis-DNP-Calix[4]pyrrole-TBAH2PO4","Cis-dinitrophenyl-calix[4]pyrrole-tetrabutylammonium dihydrogenphosphate","","- C72 H116 Cl3 N10 O18 P2 -","- C72 H116 Cl3 N10 O18 P2 -","- C288 H464 Cl12 N40 O72 P8 -","4","2","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.09","0.0686","","","0.1846","0.2032","","","","","","1.045","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124768","11.224","0.006","13.636","0.008","22.374","0.013","101.011","0.008","98.751","0.009","91.381","0.011","3317","3","123","2","123","2","","","","","","","","5","P -1","-P 1","2","DNP-Calix[4]pyrrole-TEAHCO3","Cis-dinitrophenyl-calix[4]pyrrole-tetraethylammonium hydrogencarbonate","","- C58 H60 Cl6 N10 O14 -","- C58 H60 Cl6 N10 O14 -","- C116 H120 Cl12 N20 O28 -","2","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.1301","0.1123","","","0.2536","0.2644","","","","","","1.354","","","","has coordinates,has disorder","234208","2020-10-21","18:00:00",""
"7124769","14.239","0.003","21.245","0.004","24.51","0.005","90","","92.19","0.03","90","","7409","3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cis-DNP-Calix[4]pyrrole-TBAHSO4","Cis-dinitrophenyl-calix[4]pyrrole-tetrabutylammonium chloride","","- C70 H110 N10 O16 S2 -","- C70 H110 N10 O16 S2 -","- C280 H440 N40 O64 S8 -","4","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71073","MoKα","","0.0798","0.0504","","","0.1155","0.1292","","","","","","1.033","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124770","12.8705","0.0012","18.6776","0.0018","23.141","0.002","90","","90.418","0.002","90","","5562.7","0.9","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Cis-DNP-Calix[4]pyrrole-TBANO3","Cis-Dinitrophenyl-calix[4]pyrrole-tetrabutylammonium nitrate","","- C54 H72 N10 O11 -","- C54 H72 N10 O11 -","- C216 H288 N40 O44 -","4","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.1598","0.0688","","","0.1394","0.1714","","","","","","1.057","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124771","12.773","0.004","19.067","0.006","23.221","0.007","90","","91.69","0.004","90","","5653","3","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Cis-DNP-Calix[4]pyrrole-TBAOAc","Cis-Dinitrophenyl-calix[4]pyrrole-etrabutylammonium acetate","","- C56 H75 N9 O10 -","- C56 H75 N9 O10 -","- C224 H300 N36 O40 -","4","1","","Kim, Ajeong; Ali, Rashid; Park, Seok Ho; Kim, Yong-Hoon; Park, Jung Su","Probing and evaluating anion-π interaction in meso-dinitrophenyl functionalized calix[4]pyrrole isomers.","Chemical communications (Cambridge, England)","2016","52","74","11139","11142","10.1039/c6cc04562f","","","0.71075","MoKα","","0.0968","0.0636","","","0.1269","0.1492","","","","","","1.196","","","","has coordinates","234208","2020-10-21","18:00:00",""
"7124772","14.3039","0.0016","17.603","0.002","20.104","0.002","64.648","0.006","74.715","0.007","86.046","0.007","4407.1","0.9","100.1","","100.1","","","","","","","","","5","P -1","-P 1","2","","","","- C87 H129 N4 O16 Zn2 -","- C87 H129 N4 O16 Zn2 -","- C174 H258 N8 O32 Zn4 -","2","1","","Gonawala, Sunalee; Leopoldino, Verônica R; Kpogo, Kenneth; Verani, Cláudio N","Langmuir-Blodgett films of salophen-based metallosurfactants as surface pretreatment coatings for corrosion mitigation.","Chemical communications (Cambridge, England)","2016","52","74","11155","11158","10.1039/c6cc04563d","","x-ray","0.71073","MoKα","","0.1996","0.1384","","","0.3298","0.359","","","","","","1.161","","","","has coordinates","234211","2020-10-21","18:00:00",""
"7124773","7.634","0.005","13.084","0.008","14.166","0.01","105.216","0.013","105.376","0.009","94.884","0.009","1298.1","1.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H28 Br4 N8 O12 Pb4 Pd -","- C44 H28 Br4 N8 O12 Pb4 Pd -","- C44 H28 Br4 N8 O12 Pb4 Pd -","1","0.5","","Dong, Ying; Li, Yue; Wei, Yong-Liang; Wang, Jian-Cheng; Ma, Jian-Ping; Ji, Jun; Yao, Bing-Jian; Dong, Yu-Bin","A N-heterocyclic tetracarbene Pd(ii) moiety containing a Pd(ii)-Pb(ii) bimetallic MOF for three-component cyclotrimerization via benzyne.","Chemical communications (Cambridge, England)","2016","52","69","10505","10508","10.1039/c6cc04570g","","","0.71073","MoKα","","0.1032","0.0718","","","0.1639","0.1723","","","","","","1.001","","","","has coordinates","234213","2020-10-21","18:00:00",""
"7124774","21.927","0.005","21.927","0.005","21.927","0.005","90","","90","","90","","10542","4","298","2","298.15","","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- C126 H250 N10 O102 S4 V24 -","- C84 H132 O100 S4 V24 -","- C168 H264 O200 S8 V48 -","2","0.0416667","","Zhang, Yu-Teng; Wang, Xin-Long; Li, Shuang-Bao; Gong, Ya-Ru; Song, Bai-Qiao; Shao, Kui-Zhan; Su, Zhong-Min","Anderson-like alkoxo-polyoxovanadate clusters serving as unprecedented second building units to construct metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","62","9632","9635","10.1039/c6cc04583a","","","0.71069","MoKα","","0.0445","0.0351","","","0.072","0.0748","","","","","","1.032","","","","has coordinates","234216","2020-10-21","18:00:00",""
"7124775","21.841","0.005","21.841","0.005","21.841","0.005","90","0.005","90","0.005","90","0.005","10419","4","293","2","293","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- C123.5 H250.5 N15.5 O101.5 S4 V24 -","- C84 H108 N6 O100 S4 V24 -","- C168 H216 N12 O200 S8 V48 -","2","0.0416667","","Zhang, Yu-Teng; Wang, Xin-Long; Li, Shuang-Bao; Gong, Ya-Ru; Song, Bai-Qiao; Shao, Kui-Zhan; Su, Zhong-Min","Anderson-like alkoxo-polyoxovanadate clusters serving as unprecedented second building units to construct metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","62","9632","9635","10.1039/c6cc04583a","","","0.71069","MoKα","","0.0439","0.0372","","","0.0882","0.0914","","","","","","1.032","","","","has coordinates","234216","2020-10-21","18:00:00",""
"7124776","22.108","0.005","22.108","0.005","22.108","0.005","90","","90","","90","","10806","4","298","2","298.15","","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- C121 H152 Br6 O101 S4 V24 -","- C84 H108 Br6 O100 S4 V24 -","- C168 H216 Br12 O200 S8 V48 -","2","0.0416667","","Zhang, Yu-Teng; Wang, Xin-Long; Li, Shuang-Bao; Gong, Ya-Ru; Song, Bai-Qiao; Shao, Kui-Zhan; Su, Zhong-Min","Anderson-like alkoxo-polyoxovanadate clusters serving as unprecedented second building units to construct metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","62","9632","9635","10.1039/c6cc04583a","","","0.71069","MoKα","","0.0505","0.0389","","","0.0886","0.0925","","","","","","1.011","","","","has coordinates,has disorder","234216","2020-10-21","18:00:00",""
"7124777","21.848","0.005","21.848","0.005","19.081","0.005","90","0.005","90","0.005","90","0.005","9108","4","298","2","298.15","","","","","","","","","6","I -4","I -4","82","","","","- C106.5 H221.5 N8.5 O100.5 S4 V24 -","- C72 H120 O100 S4 V24 -","- C144 H240 O200 S8 V48 -","2","0.25","","Zhang, Yu-Teng; Wang, Xin-Long; Li, Shuang-Bao; Gong, Ya-Ru; Song, Bai-Qiao; Shao, Kui-Zhan; Su, Zhong-Min","Anderson-like alkoxo-polyoxovanadate clusters serving as unprecedented second building units to construct metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","62","9632","9635","10.1039/c6cc04583a","","","0.71069","MoKα","","0.0644","0.0418","","","0.0905","0.0975","","","","","","0.903","","","","has coordinates,has disorder","234216","2020-10-21","18:00:00",""
"7124778","28.983","0.005","28.983","0.005","25.744","0.005","90","","90","","90","","21625","7","298","2","298.15","","","","","","","","","6","I -4","I -4","82","","","","- C183.5 H280.5 N9.5 O101.5 S4 V24 -","- C144 H168 O100 S4 V24 -","- C288 H336 O200 S8 V48 -","2","0.25","","Zhang, Yu-Teng; Wang, Xin-Long; Li, Shuang-Bao; Gong, Ya-Ru; Song, Bai-Qiao; Shao, Kui-Zhan; Su, Zhong-Min","Anderson-like alkoxo-polyoxovanadate clusters serving as unprecedented second building units to construct metal-organic polyhedra.","Chemical communications (Cambridge, England)","2016","52","62","9632","9635","10.1039/c6cc04583a","","","0.71069","MoKα","","0.115","0.0474","","","0.1017","0.115","","","","","","0.763","","","","has coordinates,has disorder","234216","2020-10-21","18:00:00",""
"7124779","10.50766","0.00019","14.738","0.0002","35.4339","0.0006","90","","90","","90","","5487.36","0.15","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C48 H69 N O6 Si2 -","- C48 H69 N O6 Si2 -","- C192 H276 N4 O24 Si8 -","4","1","","Gan, Zubao; Chu, Zhiwen; Hu, Jia; Su, Zhishan; Hu, Changwei; Gao, Lu; Song, Zhenlei","Tunable reactivity of geminal bis(silyl) enol derivatives leading to selective exo-IEDDA or Sakurai allylation with a β,γ-unsaturated ketoester.","Chemical communications (Cambridge, England)","2016","52","66","10137","10140","10.1039/c6cc04593f","","x-ray","1.54184","CuKα","","0.0624","0.0589","","","0.1553","0.1607","","","","","","1.041","","","","has coordinates","234218","2020-10-21","18:00:00",""
"7124780","17.8945","0.0006","19.5103","0.0006","20.507","0.0007","90.134","0.002","99.808","0.003","110.635","0.003","6587.2","0.4","180","0.1","180","0.1","","","","","","","","8","P -1","-P 1","2","","","","- C226 H226 Cl16 F24 N26 O68 Pd4 S8 -","- C208 H172 Cl16 F24 N8 O32 Pd4 S8 -","- C208 H172 Cl16 F24 N8 O32 Pd4 S8 -","1","0.5","","Szalóki, György; Croué, Vincent; Allain, Magali; Goeb, Sébastien; Sallé, Marc","Neutral versus polycationic coordination cages: a comparison regarding neutral guest inclusion.","Chemical communications (Cambridge, England)","2016","52","65","10012","10015","10.1039/c6cc04610j","","x-ray","1.54184","CuKα","","0.1165","0.0866","","","0.2317","0.2625","","","","","","0.969","","","","has coordinates,has disorder","234220","2020-10-21","18:00:00",""
"7124781","16.3201","0.0003","29.0112","0.0003","27.2545","0.0003","90","","105.883","0.001","90","","12411.4","0.3","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C210 H199 Cl16 F24 N21 O32 Pd4 S8 -","- C174 Cl16 F24 N8 O28 Pd4 S8 -","- C348 Cl32 F48 N16 O56 Pd8 S16 -","2","0.5","","Szalóki, György; Croué, Vincent; Allain, Magali; Goeb, Sébastien; Sallé, Marc","Neutral versus polycationic coordination cages: a comparison regarding neutral guest inclusion.","Chemical communications (Cambridge, England)","2016","52","65","10012","10015","10.1039/c6cc04610j","","x-ray","0.67","synchrotron","","0.1039","0.0794","","","0.2232","0.2423","","","","","","1.065","","","","has coordinates","234220","2020-10-21","18:00:00",""
"7124782","6.8103","0.0002","12.0335","0.0004","15.7289","0.0005","70.566","0.002","78.711","0.002","88.033","0.002","1191.39","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Piperidine axle","","","- C21 H28 B2 F8 N2 O2 -","- C21 H28 B2 F8.003 N2 O2 -","- C42 H56 B4 F16.006 N4 O4 -","2","1","","Catalán, Aldo C; Tiburcio, Jorge","Self-assembly of pseudo-rotaxane and rotaxane complexes using an electrostatic slippage approach.","Chemical communications (Cambridge, England)","2016","52","61","9526","9529","10.1039/c6cc04619c","","","0.71073","MoKα","","0.0753","0.0567","","","0.1534","0.1678","","","","","","1.056","","","","has coordinates,has disorder","234222","2020-10-21","18:00:00",""
"7124783","22.3944","0.0003","10.7588","0.0002","19.4913","0.0003","90","","105.44","0.002","90","","4526.69","0.13","291","2","291","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C24 H25 N3 O4 -","- C24 H25 N3 O4 -","- C192 H200 N24 O32 -","8","1","","Ren, Shichao; Song, Shengjin; Ye, Lu; Feng, Chao; Loh, Teck-Peng","Copper-catalyzed oxyamination of electron-deficient alkenes with N-acyloxyamines.","Chemical communications (Cambridge, England)","2016","52","68","10373","10376","10.1039/c6cc04638j","","","1.54184","CuKα","","0.0787","0.0707","","","0.1977","0.2049","","","","","","1.055","","","","has coordinates","234224","2020-10-21","18:00:00",""
"7124784","31.23","0.005","17.481","0.003","26.747","0.004","90","","102.845","0.002","90","","14237","4","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Ir-Co1","","- C118 H108 Cl6 Co3 Ir2 N24 O29 -","- C118 H100 Cl6 Co3 Ir2 N24 O29 -","- C472 H400 Cl24 Co12 Ir8 N96 O116 -","4","0.5","","Li, Xuezhao; Wu, Jinguo; Chen, Liyong; Zhong, Xiaoming; He, Cheng; Zhang, Rong; Duan, Chunying","Engineering an iridium-containing metal-organic molecular capsule for induced-fit geometrical conversion and dual catalysis.","Chemical communications (Cambridge, England)","2016","52","62","9628","9631","10.1039/c6cc04647a","","","0.71073","MoKα","","0.1024","0.0643","","","0.1654","0.1793","","","","","","1.049","","","","has coordinates,has disorder","234226","2020-10-21","18:00:00",""
"7124785","20.973","0.003","20.973","0.003","30.067","0.005","90","","90","","90","","13225","3","173","2","173","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","Ir-Co2","","- C121 H107 Cl4 Co3 Ir2 N25 O22 -","- C121 H103 Cl4 Co3 Ir2 N25 O22 -","- C484 H412 Cl16 Co12 Ir8 N100 O88 -","4","0.5","","Li, Xuezhao; Wu, Jinguo; Chen, Liyong; Zhong, Xiaoming; He, Cheng; Zhang, Rong; Duan, Chunying","Engineering an iridium-containing metal-organic molecular capsule for induced-fit geometrical conversion and dual catalysis.","Chemical communications (Cambridge, England)","2016","52","62","9628","9631","10.1039/c6cc04647a","","","0.71073","MoKα","","0.0887","0.0763","","","0.1987","0.2056","","","","","","1.023","","","","has coordinates","234226","2020-10-21","18:00:00",""
"7124786","9.5812","0.0012","10.2719","0.0013","12.371","0.002","114.389","0.002","96.569","0.003","105.237","0.002","1034.9","0.3","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H20 O -","- C29 H20 O -","- C58 H40 O2 -","2","1","","Chen, Ling; Cao, Jian; Xu, Zheng; Zheng, Zhan-Jiang; Cui, Yu-Ming; Xu, Li-Wen","Lewis acid catalyzed [2+2] cycloaddition of ynamides and propargyl silyl ethers: synthesis of alkylidenecyclobutenones and their reactivity in ring-opening and ring expansion.","Chemical communications (Cambridge, England)","2016","52","61","9574","9577","10.1039/c6cc04648g","","","0.71073","MoKα","","0.0543","0.0384","","","0.1027","0.1141","","","","","","1.027","","","","has coordinates","234229","2020-10-21","18:00:00",""
"7124787","9.688","0.003","9.724","0.003","14.142","0.004","92.269","0.009","93.742","0.009","99.428","0.009","1309.8","0.7","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H31 N O -","- C33 H31 N O -","- C66 H62 N2 O2 -","2","1","","Chen, Ling; Cao, Jian; Xu, Zheng; Zheng, Zhan-Jiang; Cui, Yu-Ming; Xu, Li-Wen","Lewis acid catalyzed [2+2] cycloaddition of ynamides and propargyl silyl ethers: synthesis of alkylidenecyclobutenones and their reactivity in ring-opening and ring expansion.","Chemical communications (Cambridge, England)","2016","52","61","9574","9577","10.1039/c6cc04648g","","","0.71073","MoKα","","0.0996","0.0769","","","0.2243","0.243","","","","","","1.074","","","","has coordinates","234229","2020-10-21","18:00:00",""
"7124788","8.5465","0.0017","11.111","0.002","12.403","0.003","109.873","0.002","101.743","0.002","90.448","0.002","1080.7","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H22 O2 -","- C29 H22 O2 -","- C58 H44 O4 -","2","1","","Chen, Ling; Cao, Jian; Xu, Zheng; Zheng, Zhan-Jiang; Cui, Yu-Ming; Xu, Li-Wen","Lewis acid catalyzed [2+2] cycloaddition of ynamides and propargyl silyl ethers: synthesis of alkylidenecyclobutenones and their reactivity in ring-opening and ring expansion.","Chemical communications (Cambridge, England)","2016","52","61","9574","9577","10.1039/c6cc04648g","","","0.71073","MoKα","","0.0567","0.0408","","","0.101","0.1111","","","","","","1.031","","","","has coordinates","234229","2020-10-21","18:00:00",""
"7124789","8.12275","0.00008","19.6409","0.0002","11.31395","0.00011","90","","92.5884","0.001","90","","1803.16","0.03","120.01","0.1","120.01","0.1","","","","","","","","4","C 1 c 1","C -2yc","9","","Ethyl (1R*,2S*,5S*,6R*,7S*)-3-[(2,4-dimethoxyphenyl)methyl]-4-oxo-2-(prop-2-en-1-yl)-10-oxa-3-azatricyclo[5.2.1.0^1^,5]dec-8-ene-6-carboxylate","","- C21 H23 N O4 -","- C21 H23 N O4 -","- C84 H92 N4 O16 -","4","1","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","1.54184","CuKα","","0.03","0.03","","","0.0799","0.0799","","","","","","1.04","","","","has coordinates","234232","2020-10-21","18:00:00",""
"7124790","11.06181","0.00017","9.47232","0.00016","18.5215","0.0002","90","","97.9172","0.0013","90","","1922.2","0.05","120","0.1","120","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl (2R*,3S*,5aS*,9aS*,9bR*)-5-benzyl-2-ethenyl-4-oxo-2H,3H,4H,5H,5aH,6H,7H,9bH-furo[3,2-d]indole-3-carboxylate","","- C22 H25 N O4 -","- C22 H25 N O4 -","- C88 H100 N4 O16 -","4","1","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","1.54184","CuKα","","0.0479","0.0433","","","0.113","0.1192","","","","","","1.042","","","","has coordinates","234232","2020-10-21","18:00:00",""
"7124791","11.7112","0.0003","15.2229","0.0004","22.2156","0.0006","78.173","0.002","76.486","0.002","89.949","0.002","3764.55","0.18","119.99","0.18","119.99","0.18","","","","","","","","5","P -1","-P 1","2","","Methyl (1R*,2R*,5S*,8S*,9R*,10S*)-7-oxo-5-{[4-(trifluoromethyl)phenyl]methyl}-13-oxa-6-azatetracyclo[8.2.1.0^1^,8.0^2^,6]tridecane-9-carboxylate","","- C21 H22 F3 N O4 -","- C21 H22 F3 N O4 -","- C168 H176 F24 N8 O32 -","8","4","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","1.54184","CuKα","","0.0714","0.0603","","","0.1649","0.1703","","","","","","1.03","","","","has coordinates","234232","2020-10-21","18:00:00",""
"7124792","22.8332","0.0004","9.84289","0.00014","16.7747","0.0003","90","","90","","90","","3770.02","0.11","120","0.12","120","0.12","","","","","","","","4","P b c n","-P 2n 2ab","60","","Ethyl (1R*,2R*,5S*,6R*,7S*)-3-[(2,4-dimethoxyphenyl)methyl]-4-oxo-2-(prop-2-en-1-yl)-10-oxa-3-azatricyclo[5.2.1.0^1^,5]dec-8-ene-6-carboxylate","","- C21 H23 N O4 -","- C21 H23 N O4 -","- C168 H184 N8 O32 -","8","1","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","1.54184","CuKα","","0.0484","0.0419","","","0.1085","0.114","","","","","","1.025","","","","has coordinates,has disorder","234232","2020-10-21","18:00:00",""
"7124793","20.1612","0.0002","9.24516","0.00011","10.76938","0.00015","90","","96.7643","0.0012","90","","1993.37","0.04","120","0.1","120","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl (1R*,2R*,10S*,11R*,12S*)-5-benzyl-9-oxo-15-oxa-5,8-diazatetracyclo[10.2.1.0^1^,^1^°.0^2^,8]pentadecane-11-carboxylate","","- C22 H28 N2 O4 -","- C22 H28 N2 O4 -","- C88 H112 N8 O16 -","4","1","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","1.54184","CuKα","","0.0513","0.0473","","","0.1229","0.128","","","","","","1.048","","","","has coordinates","234232","2020-10-21","18:00:00",""
"7124794","9.8686","0.0009","23.9445","0.0018","33.107","0.002","90","","90.065","0.008","90","","7823.1","1","119.98","0.14","119.98","0.14","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl (1R*,2R*,5S*,6R*,7S*)-3-benzyl-2-(but-3-en-1-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0^1^,5]dec-8-ene-6-carboxylate","","- C22 H25 N O4 -","- C22 H25 N O4 -","- C352 H400 N16 O64 -","16","4","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","1.54184","CuKα","","0.0998","0.073","","","0.1594","0.1761","","","","","","1.039","","","","has coordinates","234232","2020-10-21","18:00:00",""
"7124795","9.67334","0.00014","11.20885","0.00018","18.6086","0.0002","90","","94.3265","0.0014","90","","2011.93","0.05","120","0.1","120","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","Ethyl (1R*,2S*,10S*,11R*,12S*)-5-benzyl-9-oxo-15-oxa-5,8-diazatetracyclo[10.2.1.0^1^,^1^°.0^2^,8]pentadecane-11-carboxylate","","- C22 H28 N2 O4 -","- C22 H28 N2 O4 -","- C88 H112 N8 O16 -","4","2","","Firth, James D.; Craven, Philip G. E.; Lilburn, Matthew; Pahl, Axel; Marsden, Stephen P.; Nelson, Adam","A biosynthesis-inspired approach to over twenty diverse natural product-like scaffolds.","Chemical communications (Cambridge, England)","2016","52","63","9837","9840","10.1039/c6cc04662b","","x-ray","0.71073","MoKα","","0.0466","0.0439","","","0.1117","0.1152","","","","","","1.022","","","","has coordinates","234232","2020-10-21","18:00:00",""
"7124796","9.7786","0.0005","9.9521","0.0004","21.9977","0.001","90","","90","","90","","2140.76","0.17","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H23 O6 P Si2 W -","- C14 H23 O6 P Si2 W -","- C56 H92 O24 P4 Si8 W4 -","4","1","","Kyri, A. W.; Schnakenburg, G.; Streubel, R.","A novel route to C-unsubstituted 1,2-oxaphosphetane and 1,2-oxaphospholane complexes.","Chemical communications (Cambridge, England)","2016","52","55","8593","8595","10.1039/c6cc04667c","","","0.71073","MoKα","","0.0244","0.0221","","","0.0369","0.0376","","","","","","0.886","","","","has coordinates","234236","2020-10-21","18:00:00",""
"7124797","9.179","0.003","10.433","0.004","14.066","0.005","86.293","0.01","81.81","0.01","65.584","0.009","1214","0.8","100","","100","","","","","","","","","7","P -1","-P 1","2","","AKY-424","","- C14 H24 I O6 P Si2 W -","- C14 H24 I O6 P Si2 W -","- C28 H48 I2 O12 P2 Si4 W2 -","2","1","","Kyri, A. W.; Schnakenburg, G.; Streubel, R.","A novel route to C-unsubstituted 1,2-oxaphosphetane and 1,2-oxaphospholane complexes.","Chemical communications (Cambridge, England)","2016","52","55","8593","8595","10.1039/c6cc04667c","","","0.71073","MoKα","","0.1918","0.1405","","","0.3049","0.3359","","","","","","1.231","","","","has coordinates","234236","2020-10-21","18:00:00",""
"7124798","9.2343","0.0004","10.3502","0.0004","23.1652","0.0011","90","","90","","90","","2214.06","0.17","123","","123","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","AKY-554","","- C15 H25 O6 P Si2 W -","- C15 H25 O6 P Si2 W -","- C60 H100 O24 P4 Si8 W4 -","4","1","","Kyri, A. W.; Schnakenburg, G.; Streubel, R.","A novel route to C-unsubstituted 1,2-oxaphosphetane and 1,2-oxaphospholane complexes.","Chemical communications (Cambridge, England)","2016","52","55","8593","8595","10.1039/c6cc04667c","","x-ray","0.71073","MoKα","","0.0535","0.0367","","","0.0549","0.0584","","","","","","0.999","","","","has coordinates","234236","2020-10-21","18:00:00",""
"7124799","11.9958","0.0006","12.5852","0.0007","17.0913","0.0009","104.697","0.001","102.692","0.001","91.2459","0.001","2426.6","0.2","100","2","100","2","","","","","","","n/a","7","P -1","-P 1","2","n/a","C45H63N6Br2S1Fe3","","- C49 H71 Br2 Fe3 N6 O S -","- C49 H71 Br2 Fe3 N6 O S -","- C98 H142 Br4 Fe6 N12 O2 S2 -","2","1","","Lee, Yousoon; Abboud, Khalil A.; García-Serres, Ricardo; Murray, Leslie J.","A three-coordinate Fe(ii) center within a [3Fe-(μ3-S)] cluster that provides an accessible coordination site.","Chemical communications (Cambridge, England)","2016","52","59","9295","9298","10.1039/c6cc04671a","","","0.71073","MoKα","","0.066","0.0368","","","0.084","0.0918","","","","","","0.958","","","","has coordinates,has disorder","234239","2020-10-21","18:00:00",""
"7124800","11.651","0.0003","12.6465","0.0004","17.0493","0.0005","94.401","0.001","95.909","0.001","96.266","0.001","2473.99","0.12","100","2","100","2","","","","","","","n/a","7","P -1","-P 1","2","n/a","C47H67N6O0.5Br1S1Fe3","","- C50.88 H74.76 Br1.03 Fe3 N6 O1.47 S -","- C50.88 H74.76 Br1.03 Fe3 N6 O1.47 S -","- C101.76 H149.52 Br2.06 Fe6 N12 O2.94 S2 -","2","1","","Lee, Yousoon; Abboud, Khalil A.; García-Serres, Ricardo; Murray, Leslie J.","A three-coordinate Fe(ii) center within a [3Fe-(μ3-S)] cluster that provides an accessible coordination site.","Chemical communications (Cambridge, England)","2016","52","59","9295","9298","10.1039/c6cc04671a","","","0.71073","MoKα","","0.0376","0.0294","","","0.0796","0.0843","","","","","","1.077","","","","has coordinates,has disorder","234239","2020-10-21","18:00:00",""
"7124801","12.339","0.0003","12.339","0.0007","18.0683","0.0007","90","","90","","90","","2750.9","0.2","173.15","","173.15","","","","","","","","","5","P 43","P 4cw","78","","","","- C31 H29 Br2 N O4 -","- C31 H29 Br2 N O4 -","- C124 H116 Br8 N4 O16 -","4","1","","Li, Meng; Lu, Hai-Yan; Zhang, Chao; Shi, Lin; Tang, Zhiyong; Chen, Chuan-Feng","Helical aromatic imide based enantiomers with full-color circularly polarized luminescence.","Chemical communications (Cambridge, England)","2016","52","64","9921","9924","10.1039/c6cc04674f","","","0.71073","MoKα","","0.0585","0.0534","","","0.127","0.1321","","","","","","1.056","","","","has coordinates","234242","2020-10-21","18:00:00",""
"7124802","12.347","0.003","12.347","0.003","18.073","0.004","90","","90","","90","","2755.2","1.1","173.15","","173.15","","","","","","","","","5","P 41","P 4w","76","","","","- C31 H29 Br2 N O4 -","- C31 H29 Br2 N O4 -","- C124 H116 Br8 N4 O16 -","4","1","","Li, Meng; Lu, Hai-Yan; Zhang, Chao; Shi, Lin; Tang, Zhiyong; Chen, Chuan-Feng","Helical aromatic imide based enantiomers with full-color circularly polarized luminescence.","Chemical communications (Cambridge, England)","2016","52","64","9921","9924","10.1039/c6cc04674f","","","0.71073","MoKα","","0.0707","0.0645","","","0.1466","0.151","","","","","","1.1","","","","has coordinates","234242","2020-10-21","18:00:00",""
"7124803","5.6327","0.0006","14.2928","0.0015","21.544","0.003","90","","90","","90","","1734.4","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H19 N O S -","- C23 H19 N O S -","- C92 H76 N4 O4 S4 -","4","1","","León, Thierry; Fernández, Elena","The Pauson-Khand reaction using alkynylboronic esters: solving a long-standing regioselectivity issue.","Chemical communications (Cambridge, England)","2016","52","60","9363","9366","10.1039/c6cc04717c","","","0.71073","MoKα","","0.0677","0.0478","","","0.0995","0.1104","","","","","","1.052","","","","has coordinates,has disorder","234243","2020-10-21","18:00:00",""
"7124804","9.7865","0.0005","12.5627","0.0006","16.1123","0.0007","90.4912","0.0014","102.202","0.0014","93.6195","0.0014","1931.82","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H25 B O3 -","- C22 H25 B O3 -","- C88 H100 B4 O12 -","4","2","","León, Thierry; Fernández, Elena","The Pauson-Khand reaction using alkynylboronic esters: solving a long-standing regioselectivity issue.","Chemical communications (Cambridge, England)","2016","52","60","9363","9366","10.1039/c6cc04717c","","","0.71073","MoKα","","0.063","0.0484","","","0.1235","0.1335","","","","","","1.02","","","","has coordinates,has disorder","234243","2020-10-21","18:00:00",""
"7124805","19.3909","0.001","10.1233","0.0004","20.4987","0.0007","90","","95.235","0.004","90","","4007.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 B N2 O -","- C26 H21 B N2 O -","- C208 H168 B8 N16 O8 -","8","2","","León, Thierry; Fernández, Elena","The Pauson-Khand reaction using alkynylboronic esters: solving a long-standing regioselectivity issue.","Chemical communications (Cambridge, England)","2016","52","60","9363","9366","10.1039/c6cc04717c","","","0.7107","MoKα","","0.1118","0.0729","","","0.1782","0.1958","","","","","","1.077","","","","has coordinates","234243","2020-10-21","18:00:00",""
"7124806","15.4625","0.0007","15.4625","0.0007","12.337","0.0006","90","","90","","90","","2949.6","0.2","100","2","100","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1","","- C8 H4 In O5 -","- C8 H4 In O5 -","- C64 H32 In8 O40 -","8","0.5","","Peralta, Ricardo A.; Campos-Reales-Pineda, Alberto; Pfeiffer, Heriberto; Álvarez, J Raziel; Zárate, J Antonio; Balmaseda, Jorge; González-Zamora, Eduardo; Martínez, Ana; Martínez-Otero, Diego; Jancik, Vojtech; Ibarra, Ilich A.","CO2 capture enhancement in InOF-1 via the bottleneck effect of confined ethanol.","Chemical communications (Cambridge, England)","2016","52","67","10273","10276","10.1039/c6cc04734c","","","0.71073","MoKα","","0.023","0.0211","","","0.0445","0.0451","","","","","","0.994","","","","has coordinates,has disorder","234245","2020-10-21","18:00:00",""
"7124807","15.483","0.002","15.483","0.002","12.308","0.003","90","","90","","90","","2950.5","0.9","100","2","100","2","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","InOF-1.Ethanol","","- C10 H10 In O6 -","- C10 H10 In O6 -","- C80 H80 In8 O48 -","8","0.5","","Peralta, Ricardo A.; Campos-Reales-Pineda, Alberto; Pfeiffer, Heriberto; Álvarez, J Raziel; Zárate, J Antonio; Balmaseda, Jorge; González-Zamora, Eduardo; Martínez, Ana; Martínez-Otero, Diego; Jancik, Vojtech; Ibarra, Ilich A.","CO2 capture enhancement in InOF-1 via the bottleneck effect of confined ethanol.","Chemical communications (Cambridge, England)","2016","52","67","10273","10276","10.1039/c6cc04734c","","","0.71073","MoKα","","0.0226","0.0222","","","0.0612","0.0615","","","","","","1.175","","","","has coordinates,has disorder","234245","2020-10-21","18:00:00",""
"7124808","9.8334","0.0014","21.319","0.003","12.7266","0.0018","90","","95.59","0.007","90","","2655.3","0.7","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C60 H62 Au Cl P S3 -","- C60 H62 Au Cl P S3 -","- C120 H124 Au2 Cl2 P2 S6 -","2","1","","Aillard, Paul; Dova, Davide; Magné, Valentin; Retailleau, Pascal; Cauteruccio, Silvia; Licandro, Emanuela; Voituriez, Arnaud; Marinetti, Angela","The synthesis of substituted phosphathiahelicenes via regioselective bromination of a preformed helical scaffold: a new approach to modular ligands for enantioselective gold-catalysis.","Chemical communications (Cambridge, England)","2016","52","73","10984","10987","10.1039/c6cc04765c","","","1.54187","CuKα","","0.2175","0.0837","","","0.1848","0.2576","","","","","","0.958","","","","has coordinates","234247","2020-10-21","18:00:00",""
"7124809","18.899","0.006","18.899","0.006","31.69","0.013","90","","90","","120","","9802","6","120","2","120","2","","","","","","","","7","R -3 m :H","-R 3 2""","166","","NbO-Pd-1","","- C12 H6 Cl2 Cu2 N2 O10 Pd -","- C12 H6 Cl2 Cu2 N2 O10 Pd -","- C108 H54 Cl18 Cu18 N18 O90 Pd9 -","9","0.25","","Spanopoulos, I.; Bratsos, I.; Tampaxis, C.; Vourloumis, D.; Klontzas, E.; Froudakis, G. E.; Charalambopoulou, G.; Steriotis, T. A.; Trikalitis, P. N.","Exceptional gravimetric and volumetric CO2 uptake in a palladated NbO-type MOF utilizing cooperative acidic and basic, metal-CO2 interactions.","Chemical communications (Cambridge, England)","2016","52","69","10559","10562","10.1039/c6cc04790d","","","0.6889","","","0.0899","0.0877","","","0.2933","0.2946","","","","","","2.415","","","","has coordinates","234249","2020-10-21","18:00:00",""
"7124810","13.2446","0.0002","10.2823","0.0002","17.0713","0.0003","90","","97.7952","0.0007","90","","2303.37","0.07","180","2","180","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H34 Mg N2 O2 P2 S2 -","- C16 H34 Mg N2 O2 P2 S2 -","- C64 H136 Mg4 N8 O8 P8 S8 -","4","1","","Benson, Callum G. M.; Plajer, Alex J.; García-Rodríguez, Raúl; Bond, Andrew D.; Singh, Sanjay; Gade, Lutz H.; Wright, Dominic S.","A versatile hard-soft N/S-ligand for metal coordination and cluster formation.","Chemical communications (Cambridge, England)","2016","52","62","9683","9686","10.1039/c6cc04805f","","","0.71073","MoKα","","0.0436","0.0332","","","0.0733","0.0786","","","","","","1.027","","","","has coordinates","234252","2020-10-21","18:00:00",""
"7124811","8.5948","0.0004","9.7615","0.0004","14.7996","0.0006","85.955","0.002","87.786","0.002","73.175","0.002","1185.33","0.09","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H28 N2 P2 S2 Sn -","- C20 H28 N2 P2 S2 Sn -","- C40 H56 N4 P4 S4 Sn2 -","2","1","","Benson, Callum G. M.; Plajer, Alex J.; García-Rodríguez, Raúl; Bond, Andrew D.; Singh, Sanjay; Gade, Lutz H.; Wright, Dominic S.","A versatile hard-soft N/S-ligand for metal coordination and cluster formation.","Chemical communications (Cambridge, England)","2016","52","62","9683","9686","10.1039/c6cc04805f","","","1.54178","CuKα","","0.0214","0.02","","","0.048","0.0486","","","","","","1.053","","","","has coordinates","234252","2020-10-21","18:00:00",""
"7124812","23.7918","0.0002","23.7918","0.0002","37.5449","0.0006","90","","90","","90","","21252.3","0.4","180","2","180","2","","","","","","","","7","P 4 c c","P 4 -2c","103","","","","- C96 H209 N16 Na17 O8 P16 S17 -","- C96 H209 N16 Na17 O8 P16 S17 -","- C384 H836 N64 Na68 O32 P64 S68 -","4","0.5","","Benson, Callum G. M.; Plajer, Alex J.; García-Rodríguez, Raúl; Bond, Andrew D.; Singh, Sanjay; Gade, Lutz H.; Wright, Dominic S.","A versatile hard-soft N/S-ligand for metal coordination and cluster formation.","Chemical communications (Cambridge, England)","2016","52","62","9683","9686","10.1039/c6cc04805f","","","0.71073","MoKα","","0.1068","0.0725","","","0.1916","0.2156","","","","","","1.027","","","","has coordinates","234252","2020-10-21","18:00:00",""
"7124813","5.8141","0.0014","23.591","0.005","6.8413","0.0016","90","","114.257","0.003","90","","855.5","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Phenylpyridine N-Oxide","","- C11 H9 N O -","- C11 H9 N O -","- C44 H36 N4 O4 -","4","1","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.0531","0.0493","","","0.1102","0.1128","","","","","","1.025","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124814","15.84","0.004","13.517","0.004","7.047","0.002","90","","101.395","0.005","90","","1479.1","0.7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Methylquinoline N-Oxide meta-Chlorobenzoic Acid (1:1) Complex","","- C17 H14 Cl N O3 -","- C17 H14 Cl N O3 -","- C68 H56 Cl4 N4 O12 -","4","1","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.0494","0.0462","","","0.1245","0.128","","","","","","1.076","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124815","12.648","0.015","5.914","0.007","13.125","0.017","90","","94.02","0.02","90","","979","2","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6,6'-Diisopropyl-2,2'-biquinoline","","- C24 H24 N2 -","- C24 H24 N2 -","- C48 H48 N4 -","2","0.5","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.1243","0.071","","","0.1248","0.1519","","","","","","1.022","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124816","4.8503","0.0012","17.114","0.004","6.4411","0.0015","90","","105.911","0.004","90","","514.2","0.2","98","","98","","","","","","","","","4","P 1 21 1","P 2yb","4","","6-Methoxuquinoline N-Oxide Dihydrate","","- C10 H13 N O4 -","- C10 H13 N O4 -","- C20 H26 N2 O8 -","2","1","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.0354","0.035","","","0.0898","0.0902","","","","","","1.028","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124817","6.69","0.004","8.863","0.005","9.115","0.006","107.219","0.006","111.191","0.011","92.478","0.005","474.4","0.5","98","","98","","","","","","","","","4","P -1","-P 1","2","","4-Methylquinoline N-Oxide Dihydrate","","- C10 H13 N O3 -","- C10 H13 N O3 -","- C20 H26 N2 O6 -","2","1","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.0551","0.0486","","","0.1138","0.1186","","","","","","0.991","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124818","20.26","0.012","5.434","0.003","16.088","0.009","90","","110.528","0.009","90","","1658.7","1.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,5'-Diphenyl-2,2'-bipyridine","","- C22 H16 N2 -","- C22 H16 N2 -","- C88 H64 N8 -","4","1","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.085","0.0681","","","0.1391","0.1491","","","","","","1.023","","","","has coordinates,has disorder","234256","2020-10-21","18:00:00",""
"7124819","18.301","0.011","6.133","0.003","18.738","0.011","90","","94.032","0.006","90","","2098","2","293","","293","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","6,6'-Di-tert-butyl-2,2'-biquinoline","","- C26 H28 N2 -","- C26 H28 N2 -","- C104 H112 N8 -","4","0.5","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.076","0.0634","","","0.1402","0.1458","","","","","","1.035","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124820","6.8201","0.0014","16.879","0.003","9.0566","0.0019","90","","106.25","0.003","90","","1000.9","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Methylisoquinoline N-Oxide Dihydrate","","- C10 H13 N O3 -","- C10 H13 N O3 -","- C40 H52 N4 O12 -","4","1","","Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.","Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.","Chemical communications (Cambridge, England)","2016","52","64","9945","9948","10.1039/c6cc04816a","","","0.71075","MoKα","","0.0465","0.0441","","","0.1209","0.1237","","","","","","1.05","","","","has coordinates","234256","2020-10-21","18:00:00",""
"7124821","12.3724","0.0003","16.262","0.0004","18.3411","0.0005","68.034","0.001","76.109","0.001","68.507","0.001","3161.58","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C77 H66 B4 Cl6 -","- C77 H66 B4 Cl6 -","- C154 H132 B8 Cl12 -","2","1","","Zhang, Zuolun; Wang, Zheng; Haehnel, Martin; Eichhorn, Antonius; Edkins, Robert M.; Steffen, Andreas; Krueger, Anke; Lin, Zhenyang; Marder, Todd B.","Synthesis and fluxional behaviour of novel chloroborole dimers.","Chemical communications (Cambridge, England)","2016","52","62","9707","9710","10.1039/c6cc04831e","","","0.71073","MoKα","","0.0488","0.0408","","","0.1081","0.1159","","","","","","1.173","","","","has coordinates,has disorder","234258","2020-10-21","18:00:00",""
"7124822","10.7763","0.0007","11.4318","0.0008","15.5909","0.0011","74.252","0.002","81.811","0.002","69.779","0.002","1732.1","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H28 B2 Br4 Cl2 -","- C38 H28 B2 Br4 Cl2 -","- C76 H56 B4 Br8 Cl4 -","2","1","","Zhang, Zuolun; Wang, Zheng; Haehnel, Martin; Eichhorn, Antonius; Edkins, Robert M.; Steffen, Andreas; Krueger, Anke; Lin, Zhenyang; Marder, Todd B.","Synthesis and fluxional behaviour of novel chloroborole dimers.","Chemical communications (Cambridge, England)","2016","52","62","9707","9710","10.1039/c6cc04831e","","","0.71073","MoKα","","0.0417","0.0292","","","0.0626","0.0662","","","","","","1.01","","","","has coordinates","234258","2020-10-21","18:00:00",""
"7124823","9.4885","0.0003","10.1789","0.0003","11.6397","0.0004","85.237","0.002","74.922","0.001","77.744","0.001","1060.29","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H36 Cu N6 O8 -","- C14 H36 Cu N6 O8 -","- C28 H72 Cu2 N12 O16 -","2","1","","Yu, Fengshou; Li, Fei; Hu, Jixiang; Bai, Lichen; Zhu, Yong; Sun, Licheng","Electrocatalytic water oxidation by a macrocyclic Cu(ii) complex in neutral phosphate buffer.","Chemical communications (Cambridge, England)","2016","52","68","10377","10380","10.1039/c6cc04884f","","","0.71073","MoKα","","0.04","0.0384","","","0.1001","0.1013","","","","","","1.014","","","","has coordinates","234259","2020-10-21","18:00:00",""
"7124824","12.7034","0.0007","15.8896","0.001","29.1048","0.0019","90","","94.795","0.002","90","","5854.3","0.6","100","2","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H36 F16 N2 -","- C41 H36 F16 N2 -","- C164 H144 F64 N8 -","4","1","","Kim, Youngsuk; Lee, Eunsung","Activation of C-F bonds in fluoroarenes by N-heterocyclic carbenes as an effective route to synthesize abnormal NHC complexes.","Chemical communications (Cambridge, England)","2016","52","72","10922","10925","10.1039/c6cc04896j","","","0.71073","MoKα","","0.1075","0.089","","","0.2799","0.2909","","","","","","1.058","","","","has coordinates","234261","2020-10-21","18:00:00",""
"7124825","15.0816","0.0011","14.3924","0.0011","20.4104","0.0017","90","","96.525","0.003","90","","4401.6","0.6","100","","100","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H42 Au Cl F14 N2 O -","- C45 H42 Au Cl F14 N2 O -","- C180 H168 Au4 Cl4 F56 N8 O4 -","4","1","","Kim, Youngsuk; Lee, Eunsung","Activation of C-F bonds in fluoroarenes by N-heterocyclic carbenes as an effective route to synthesize abnormal NHC complexes.","Chemical communications (Cambridge, England)","2016","52","72","10922","10925","10.1039/c6cc04896j","","","0.71073","MoKα","","0.0912","0.0527","","","0.076","0.085","","","","","","1.096","","","","has coordinates,has disorder","234261","2020-10-21","18:00:00",""
"7124826","18.227","0.007","17.04","0.006","20.143","0.008","90","","101.779","0.013","90","","6124","4","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H41 F5 N2 -","- C34 H41 F5 N2 -","- C272 H328 F40 N16 -","8","1","","Kim, Youngsuk; Lee, Eunsung","Activation of C-F bonds in fluoroarenes by N-heterocyclic carbenes as an effective route to synthesize abnormal NHC complexes.","Chemical communications (Cambridge, England)","2016","52","72","10922","10925","10.1039/c6cc04896j","","","0.71073","MoKα","","0.1191","0.0734","","","0.1592","0.1826","","","","","","1.02","","","","has coordinates","234261","2020-10-21","18:00:00",""
"7124827","11.856","0.002","7.3071","0.0012","20.186","0.004","90","","96.412","0.005","90","","1737.8","0.5","103","2","103","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C29 H16 -","- C29 H16 -","- C116 H64 -","4","1","","Rajeshkumar, Venkatachalam; Stuparu, Mihaiela C.","A photochemical approach to aromatic extension of the corannulene nucleus.","Chemical communications (Cambridge, England)","2016","52","64","9957","9960","10.1039/c6cc04910a","","","0.71073","MoKα","","0.0996","0.0526","","","0.1086","0.1308","","","","","","1.018","","","","has coordinates","234263","2020-10-21","18:00:00",""
"7124828","9.2775","0.0006","26.8593","0.0015","7.3125","0.0004","90","","90","","90","","1822.18","0.18","103","2","103","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","acenaphtho[3',2',1',8':9,10,11,12]chryseno[2,1-b]benzo[d]thiophene","","- C30 H14 S -","- C30 H14 S -","- C120 H56 S4 -","4","1","","Rajeshkumar, Venkatachalam; Stuparu, Mihaiela C.","A photochemical approach to aromatic extension of the corannulene nucleus.","Chemical communications (Cambridge, England)","2016","52","64","9957","9960","10.1039/c6cc04910a","","","0.71073","MoKα","","0.0952","0.0562","","","0.1024","0.1161","","","","","","1.024","","","","has coordinates","234263","2020-10-21","18:00:00",""
"7124829","14.111","0.005","7.318","0.003","18.169","0.007","90","","100.411","0.01","90","","1845.3","1.2","103","2","103","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","acenaphtho[3,2,1,8-stuva]picen-8-yl(methyl)sulfane","","- C29 H16 S -","- C29 H16 S -","- C116 H64 S4 -","4","1","","Rajeshkumar, Venkatachalam; Stuparu, Mihaiela C.","A photochemical approach to aromatic extension of the corannulene nucleus.","Chemical communications (Cambridge, England)","2016","52","64","9957","9960","10.1039/c6cc04910a","","","0.71073","MoKα","","0.2103","0.0748","","","0.1359","0.1865","","","","","","0.984","","","","has coordinates","234263","2020-10-21","18:00:00",""
"7124830","14.3543","0.001","7.4826","0.0004","17.7472","0.0012","90","","97.963","0.004","90","","1887.8","0.2","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N-dimethylacenaphtho[3,2,1,8-stuva]picen-8-amine","","- C30 H19 N -","- C30 H19 N -","- C120 H76 N4 -","4","1","","Rajeshkumar, Venkatachalam; Stuparu, Mihaiela C.","A photochemical approach to aromatic extension of the corannulene nucleus.","Chemical communications (Cambridge, England)","2016","52","64","9957","9960","10.1039/c6cc04910a","","","0.71073","MoKα","","0.1167","0.0553","","","0.1446","0.2127","","","","","","1.052","","","","has coordinates,has disorder","234263","2020-10-21","18:00:00",""
"7124831","24.583","0.0004","24.583","0.0004","10.8704","0.0003","90","","90","","90","","6569.2","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0647","0.0428","","","0.1297","0.148","","","","","","1.134","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124832","24.0666","0.0007","24.0666","0.0007","10.5856","0.0011","90","","90","","90","","6131.2","0.7","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0852","0.0566","","","0.1276","0.1426","","","","","","1.074","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124833","24.6108","0.0003","24.6108","0.0003","10.76785","0.00017","90","","90","","90","","6521.99","0.15","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0289","0.0235","","","0.056","0.0589","","","","","","1.033","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124834","24.029","0.0005","24.029","0.0005","10.5501","0.0003","90","","90","","90","","6091.6","0.2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C13 H12 Cd N2 O2 -","- C13 H12 Cd N2 O2 -","- C208 H192 Cd16 N32 O32 -","16","1","","Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan","A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix.","Chemical communications (Cambridge, England)","2016","52","77","11543","11546","10.1039/c6cc04912e","","","1.54184","CuKα","","0.0348","0.0281","","","0.0723","0.0763","","","","","","1.076","","","","has coordinates","234265","2020-10-21","18:00:00",""
"7124835","9.1873","0.0008","12.5692","0.0011","20.0824","0.0018","90","","90","","90","","2319.1","0.4","200","2","200","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C15 H9 Cd2 N13 O12 -","- C15 H9 Cd2 N13 O12 -","- C60 H36 Cd8 N52 O48 -","4","0.5","","Frost, Jamie M.; Kobera, Libor; Pialat, Amélie; Zhang, Yixin; Southern, Scott A.; Gabidullin, Bulat; Bryce, David L.; Murugesu, Muralee","From discrete molecule, to polymer, to MOF: mapping the coordination chemistry of Cd(II) using (113)Cd solid-state NMR.","Chemical communications (Cambridge, England)","2016","52","70","10680","10683","10.1039/c6cc04940k","","","0.71073","MoKα","","0.0361","0.0297","","","0.0692","0.0721","","","","","","1.111","","","","has coordinates","234267","2020-10-21","18:00:00",""
"7124836","30.1172","0.0007","30.1172","0.0007","30.1172","0.0007","90","","90","","90","","27317.7","1.1","200","2","200","2","","","","","","","","5","I m -3 m","-I 4 2 3","229","","","","- C10 H6 Cd N4 O4 -","- C10 H6 Cd N4 O4 -","- C480 H288 Cd48 N192 O192 -","48","0.5","","Frost, Jamie M.; Kobera, Libor; Pialat, Amélie; Zhang, Yixin; Southern, Scott A.; Gabidullin, Bulat; Bryce, David L.; Murugesu, Muralee","From discrete molecule, to polymer, to MOF: mapping the coordination chemistry of Cd(II) using (113)Cd solid-state NMR.","Chemical communications (Cambridge, England)","2016","52","70","10680","10683","10.1039/c6cc04940k","","","0.71073","MoKα","","0.0493","0.0342","","","0.077","0.0977","","","","","","1.191","","","","has coordinates","234267","2020-10-21","18:00:00",""
"7124837","15.3031","0.0006","15.9629","0.0006","20.6295","0.0008","90","","104.622","0.001","90","","4876.2","0.3","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","PF6PDIMoO","","","- C45 H51.47 F12 Mo N3 O3 P4 -","- C45 H51.47 F12 Mo N3 O3 P4 -","- C180 H205.88 F48 Mo4 N12 O12 P16 -","4","1","","Pal, Raja; Laureanti, Joseph A.; Groy, Thomas L.; Jones, Anne K.; Trovitch, Ryan J.","Hydrogen production from water using a bis(imino)pyridine molybdenum electrocatalyst.","Chemical communications (Cambridge, England)","2016","52","77","11555","11558","10.1039/c6cc04946j","","","0.71073","MoKα","","0.0519","0.0448","","","0.118","0.1233","","","","","","1.066","","","","has coordinates,has disorder","234270","2020-10-21","18:00:00",""
"7124838","11.1519","0.0011","16.9788","0.0014","18.245","0.0013","90","","105.844","0.005","90","","3323.4","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","PDIMoO","","","- C39 H41 Mo N3 O P2 -","- C39 H41 Mo N3 O P2 -","- C156 H164 Mo4 N12 O4 P8 -","4","1","","Pal, Raja; Laureanti, Joseph A.; Groy, Thomas L.; Jones, Anne K.; Trovitch, Ryan J.","Hydrogen production from water using a bis(imino)pyridine molybdenum electrocatalyst.","Chemical communications (Cambridge, England)","2016","52","77","11555","11558","10.1039/c6cc04946j","","","0.71073","Mokα","","0.1024","0.052","","","0.0934","0.111","","","","","","0.975","","","","has coordinates","234270","2020-10-21","18:00:00",""
"7124839","27.783","0.004","4.6822","0.0008","20.212","0.003","90","","118.891","0.008","90","","2302","0.6","100","2","100","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H10 O5 -","- C15 H10 O5 -","- C120 H80 O40 -","8","1","","Li, Meiqi; Zhang, Qi; Wang, Jian-Rong; Mei, Xuefeng","Mechanochromism triggered fluorescent color switching among polymorphs of a natural fluorescence pigment.","Chemical communications (Cambridge, England)","2016","52","75","11288","11291","10.1039/c6cc04958c","","","0.71073","MoKα","","0.1084","0.0562","","","0.1404","0.1748","","","","","","1.062","","","","has coordinates","234273","2020-10-21","18:00:00",""
"7124840","16.4721","0.001","3.6915","0.0002","19.4294","0.0012","90","","96.188","0.004","90","","1174.56","0.12","100","2","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 O5 -","- C15 H10 O5 -","- C60 H40 O20 -","4","1","","Li, Meiqi; Zhang, Qi; Wang, Jian-Rong; Mei, Xuefeng","Mechanochromism triggered fluorescent color switching among polymorphs of a natural fluorescence pigment.","Chemical communications (Cambridge, England)","2016","52","75","11288","11291","10.1039/c6cc04958c","","","0.71073","MoKα","","0.1845","0.0907","","","0.2232","0.306","","","","","","1.014","","","","has coordinates","234273","2020-10-21","18:00:00",""
"7124841","12.6343","0.0006","3.6437","0.0002","31.2026","0.0014","90","","95.706","0.003","90","","1429.31","0.12","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 O5 -","- C15 H10 O5 -","- C60 H40 O20 -","4","1","","Li, Meiqi; Zhang, Qi; Wang, Jian-Rong; Mei, Xuefeng","Mechanochromism triggered fluorescent color switching among polymorphs of a natural fluorescence pigment.","Chemical communications (Cambridge, England)","2016","52","75","11288","11291","10.1039/c6cc04958c","","","0.71073","MoKα","","0.1033","0.0609","","","0.1686","0.1967","","","","","","1.05","","","","has coordinates,has disorder","234273","2020-10-21","18:00:00",""
"7124842","16.6384","0.0006","3.6887","0.0002","19.406","0.0007","90","","95.544","0.003","90","","1185.45","0.09","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 O5 -","- C15 H10 O5 -","- C60 H40 O20 -","4","1","","Li, Meiqi; Zhang, Qi; Wang, Jian-Rong; Mei, Xuefeng","Mechanochromism triggered fluorescent color switching among polymorphs of a natural fluorescence pigment.","Chemical communications (Cambridge, England)","2016","52","75","11288","11291","10.1039/c6cc04958c","","","0.71073","MoKα","","0.1011","0.0682","","","0.1839","0.2158","","","","","","1.032","","","","has coordinates,has disorder","234273","2020-10-21","18:00:00",""
"7124843","12.175","0.004","12.483","0.005","18.276","0.005","75.34","0.03","78.55","0.02","71.31","0.02","2524.5","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","1,3,5-tris(3-(2,3,4,5-tetrafluorobenzyl)-imidazolium-1-methyl)-2,4,6-trimethylbenzene chloride bis(hexafluorophosphate) acetonitrilesolvate","","","- C44 H36 Cl F24 N7 P2 -","- C44 H36 Cl F24 N7 P2 -","- C88 H72 Cl2 F48 N14 P4 -","2","1","","Amendola, Valeria; Bergamaschi, Greta; Boiocchi, Massimo; Legnani, Laura; Presti, Eliana Lo; Miljkovic, Ana; Monzani, Enrico; Pancotti, Francesca","Chloride-binding in organic-water mixtures: the powerful synergy of C-H donor groups within a bowl-shaped cavity.","Chemical communications (Cambridge, England)","2016","52","72","10910","10913","10.1039/c6cc04978h","","","0.7107","MoKα","","0.1804","0.1227","","","0.2647","0.3054","","","","","","1.062","","","","has coordinates","234276","2020-10-21","18:00:00",""
"7124844","12.226","0.004","12.514","0.002","18.219","0.003","75.477","0.012","78.586","0.011","71.715","0.019","2540.5","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","1,3,5-tris(3-(2,3,4,5-tetrafluorobenzyl)-imidazolium-1-methyl)-2,4,6-trimethylbenzene bromide bis(hexafluorophosphate) acetonitrilesolvate","","","- C44 H36 Br F24 N7 P2 -","- C44 H36 Br F24 N7 P2 -","- C88 H72 Br2 F48 N14 P4 -","2","1","","Amendola, Valeria; Bergamaschi, Greta; Boiocchi, Massimo; Legnani, Laura; Presti, Eliana Lo; Miljkovic, Ana; Monzani, Enrico; Pancotti, Francesca","Chloride-binding in organic-water mixtures: the powerful synergy of C-H donor groups within a bowl-shaped cavity.","Chemical communications (Cambridge, England)","2016","52","72","10910","10913","10.1039/c6cc04978h","","","0.71073","MoKα","","0.085","0.0777","","","0.2031","0.2115","","","","","","1.062","","","","has coordinates","234276","2020-10-21","18:00:00",""
"7124845","13.725","0.003","7.0845","0.0016","20.233","0.005","90","","108.593","0.007","90","","1864.7","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 Cl2 N O4 S -","- C18 H17 Cl2 N O4 S -","- C72 H68 Cl8 N4 O16 S4 -","4","1","","Xia, Dong; Li, Yang; Miao, Tao; Li, Pinhua; Wang, Lei","Direct synthesis of sulfonated dihydroisoquinolinones from N-allylbenzamide and arylsulfinic acids via TBHP-promoted cascade radical addition and cyclization.","Chemical communications (Cambridge, England)","2016","52","77","11559","11562","10.1039/c6cc04983d","","","0.71073","MoKα","","0.0492","0.0423","","","0.1017","0.1088","","","","","","1.064","","","","has coordinates","234278","2020-10-21","18:00:00",""
"7124846","9.5936","0.0004","17.0134","0.0007","12.402","0.0005","90","","111.095","0.005","90","","1888.6","0.15","292.71","0.1","292.71","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H40 Br2 N2 O6 -","- C42 H40 Br2 N2 O6 -","- C84 H80 Br4 N4 O12 -","2","1","","Li, Jun-Long; Yang, Kai-Chuan; Li, Yi; Li, Qiang; Zhu, Hong-Ping; Han, Bo; Peng, Cheng; Zhi, Yong-Gang; Gou, Xiao-Jun","Asymmetric synthesis of bicyclic dihydropyrans via organocatalytic inverse-electron-demand oxo-Diels-Alder reactions of enolizable aliphatic aldehydes.","Chemical communications (Cambridge, England)","2016","52","70","10617","10620","10.1039/c6cc05001h","","x-ray","1.54184","CuKα","","0.0616","0.0546","","","0.136","0.1437","","","","","","1.014","","","","has coordinates","234280","2020-10-21","18:00:00",""
"7124847","9.6062","0.0002","11.1759","0.0002","25.6122","0.0004","90","","92.1354","0.0018","90","","2747.76","0.09","217.05","0.1","217.05","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H27 I N2 O2 S -","- C31 H27 I N2 O2 S -","- C124 H108 I4 N8 O8 S4 -","4","1","","Li, Honghe; Li, Xiaoxiao; Zhao, Zhigang; Ma, Ting; Sun, Chenyang; Yang, Bowen","Intermolecular iodofunctionalization of allenamides with indoles, pyrroles, and furans: synthesis of iodine-substituted Z-enamides.","Chemical communications (Cambridge, England)","2016","52","66","10167","10170","10.1039/c6cc05046h","","x-ray","1.54184","CuKα","","0.0627","0.0578","","","0.1498","0.1584","","","","","","1.048","","","","has coordinates","234282","2020-10-21","18:00:00",""
"7124848","8.421","0.0004","10","0.0005","11.8424","0.0005","100.66","0.004","103.744","0.004","90.605","0.004","950.42","0.08","293.67","0.1","293.67","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C19 H18 I N3 O2 S -","- C19 H18 I N3 O2 S -","- C38 H36 I2 N6 O4 S2 -","2","1","","Li, Honghe; Li, Xiaoxiao; Zhao, Zhigang; Ma, Ting; Sun, Chenyang; Yang, Bowen","Intermolecular iodofunctionalization of allenamides with indoles, pyrroles, and furans: synthesis of iodine-substituted Z-enamides.","Chemical communications (Cambridge, England)","2016","52","66","10167","10170","10.1039/c6cc05046h","","x-ray","1.54184","CuKα","","0.0567","0.0547","","","0.1383","0.142","","","","","","1.062","","","","has coordinates","234282","2020-10-21","18:00:00",""
"7124849","9.927","0.003","13.059","0.003","13.682","0.003","69.528","0.014","89.026","0.017","78.107","0.017","1623.1","0.7","123","","123","","","","","","","","","5","P -1","-P 1","2","triazole-10","3H-3-Benzyl-7-(4-fluorophenyl)-1,2,3-triazolo[3,4]benzo[1,2-d]thiazole","","- C20 H13 F N4 S -","- C20 H13 F N4 S -","- C80 H52 F4 N16 S4 -","4","2","","Yoshida, Suguru; Yano, Takahisa; Nishiyama, Yoshitake; Misawa, Yoshihiro; Kondo, Masakazu; Matsushita, Takeshi; Igawa, Kazunobu; Tomooka, Katsuhiko; Hosoya, Takamitsu","Thiazolobenzyne: a versatile intermediate for multisubstituted benzothiazoles.","Chemical communications (Cambridge, England)","2016","52","75","11199","11202","10.1039/c6cc05112j","","","1.54187","CuKα","","","0.0741","","","","0.1402","","","","","","1.039","","","","has coordinates","234285","2020-10-21","18:00:00",""
"7124850","10.6111","0.0003","22.4729","0.0006","14.576","0.0004","90","","92.676","0.002","90","","3472.03","0.17","99","2","99","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","PB-3-33","","","- C32 H64 B Li O8 -","- C32 H64 B Li O8 -","- C128 H256 B4 Li4 O32 -","4","1","","Basnet, Prakash; Thapa, Surendra; Dickie, Diane A.; Giri, Ramesh","The copper-catalysed Suzuki-Miyaura coupling of alkylboron reagents: disproportionation of anionic (alkyl)(alkoxy)borates to anionic dialkylborates prior to transmetalation.","Chemical communications (Cambridge, England)","2016","52","74","11072","11075","10.1039/c6cc05114f","","","0.71073","MoKα","","0.0599","0.0476","","","0.1224","0.1304","","","","","","1.044","","","","has coordinates,has disorder","234287","2020-10-21","18:00:00",""
"7124851","8.3308","0.0004","9.3831","0.0005","10.3351","0.0005","98.43","0.002","106.326","0.002","90.671","0.002","765.74","0.07","101","2","101","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H56 B2 Li2 O6 -","- C28 H56 B2 Li2 O6 -","- C28 H56 B2 Li2 O6 -","1","0.5","","Basnet, Prakash; Thapa, Surendra; Dickie, Diane A.; Giri, Ramesh","The copper-catalysed Suzuki-Miyaura coupling of alkylboron reagents: disproportionation of anionic (alkyl)(alkoxy)borates to anionic dialkylborates prior to transmetalation.","Chemical communications (Cambridge, England)","2016","52","74","11072","11075","10.1039/c6cc05114f","","","0.71073","MoKα","","0.0576","0.053","","","0.1448","0.1492","","","","","","1.032","","","","has coordinates,has disorder","234287","2020-10-21","18:00:00",""
"7124852","10.4273","0.0006","10.8211","0.0005","10.8805","0.0003","85.208","0.003","74.992","0.003","67.508","0.005","1095.45","0.1","108","2","108","2","","","","","","","","5","P -1","-P 1","2","","Zn(BMP-bdc)(DMF)","","- C19 H27 N O9 Zn -","- C19 H27 N O9 Zn -","- C38 H54 N2 O18 Zn2 -","2","1","","Foster, Jonathan A.; Henke, Sebastian; Schneemann, Andreas; Fischer, Roland A.; Cheetham, Anthony K.","Liquid exfoliation of alkyl-ether functionalised layered metal-organic frameworks to nanosheets.","Chemical communications (Cambridge, England)","2016","52","69","10474","10477","10.1039/c6cc05154e","","","0.71073","MoKα","","0.0331","0.0256","","","0.055","0.0558","","","","","","0.962","","","","has coordinates","234292","2020-10-21","18:00:00",""
"7124853","22.2207","0.0003","12.08219","0.00016","20.7776","0.0003","90","","114.995","0.0018","90","","5055.81","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 Au F5 N2 -","- C27 H24 Au F5 N2 -","- C216 H192 Au8 F40 N16 -","8","2","","Johnson, Alice; Gimeno, M Concepción","An efficient and sustainable synthesis of NHC gold complexes.","Chemical communications (Cambridge, England)","2016","52","62","9664","9667","10.1039/c6cc05190a","","","0.71073","MoKα","","0.0237","0.0196","","","0.0424","0.0439","","","","","","1.05","","","","has coordinates","234294","2020-10-21","18:00:00",""
"7124854","12.1492","0.0002","7.1342","0.0002","13.5219","0.0003","90","","97.48","0.002","90","","1162.03","0.05","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H8 Au F5 N2 -","- C11 H8 Au F5 N2 -","- C44 H32 Au4 F20 N8 -","4","1","","Johnson, Alice; Gimeno, M Concepción","An efficient and sustainable synthesis of NHC gold complexes.","Chemical communications (Cambridge, England)","2016","52","62","9664","9667","10.1039/c6cc05190a","","","0.71073","MoKα","","0.0266","0.0254","","","0.0646","0.0656","","","","","","1.1","","","","has coordinates","234294","2020-10-21","18:00:00",""
"7124855","9.2638","0.0002","9.9251","0.0003","10.7976","0.0003","104.458","0.002","104.138","0.002","114.79","0.002","801.05","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H16 Au F5 N2 -","- C15 H16 Au F5 N2 -","- C30 H32 Au2 F10 N4 -","2","1","","Johnson, Alice; Gimeno, M Concepción","An efficient and sustainable synthesis of NHC gold complexes.","Chemical communications (Cambridge, England)","2016","52","62","9664","9667","10.1039/c6cc05190a","","","0.71073","MoKα","","0.0171","0.0166","","","0.0407","0.041","","","","","","1.075","","","","has coordinates","234294","2020-10-21","18:00:00",""
"7124856","16.6316","0.0003","6.73754","0.00008","23.1802","0.0003","90","","107.797","0.0015","90","","2473.18","0.07","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 Au F5 N2 -","- C29 H32 Au F5 N2 -","- C116 H128 Au4 F20 N8 -","4","1","","Johnson, Alice; Gimeno, M Concepción","An efficient and sustainable synthesis of NHC gold complexes.","Chemical communications (Cambridge, England)","2016","52","62","9664","9667","10.1039/c6cc05190a","","","0.71073","MoKα","","0.0163","0.0145","","","0.0342","0.0349","","","","","","1.067","","","","has coordinates","234294","2020-10-21","18:00:00",""
"7124857","27.5965","0.0006","5.8463","0.0001","14.617","0.0004","90","","93.918","0.001","90","","2352.76","0.09","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","FDQPXZ","","- C32 H20 F N3 O -","- C32 H20 F N3 O -","- C128 H80 F4 N12 O4 -","4","1","","Yu, Ling; Wu, Zhongbin; Xie, Guohua; Zhong, Cheng; Zhu, Zece; Cong, Hengjiang; Ma, Dongge; Yang, Chuluo","Achieving a balance between small singlet-triplet energy splitting and high fluorescence radiative rate in a quinoxaline-based orange-red thermally activated delayed fluorescence emitter.","Chemical communications (Cambridge, England)","2016","52","73","11012","11015","10.1039/c6cc05203g","","","1.54178","CuKα","","0.0531","0.0481","","","0.1246","0.1295","","","","","","1.028","","","","has coordinates","234296","2020-10-21","18:00:00",""
"7124858","13.2466","0.0004","13.2466","0.0004","38.4491","0.0011","90","","90","","120","","5842.9","0.3","123","0.2","123","0.2","","","","","","","","10","P 31 2 1","P 31 2""","152","","","","- C55.18 H49.76 B2 Cl3.96 Cu2 F8 Mo4 N4.6 O8 P4 -","- C55.18 H49.76 B2 Cl3.96 Cu2 F8 Mo4 N4.6 O8 P4 -","- C165.54 H149.28 B6 Cl11.88 Cu6 F24 Mo12 N13.8 O24 P12 -","3","0.5","","Elsayed Moussa, M.; Attenberger, B.; Peresypkina, E. V.; Fleischmann, M.; Balázs, G; Scheer, M.","Facile synthesis of one-dimensional organometallic-organic hybrid polymers based on a diphosphorus complex and flexible bipyridyl linkers.","Chemical communications (Cambridge, England)","2016","52","65","10004","10007","10.1039/c6cc05224j","","x-ray","1.54184","CuKα","","0.0785","0.0636","","","0.1757","0.1851","","","","","","0.996","","","","has coordinates,has disorder","234298","2020-10-21","18:00:00",""
"7124859","12.15","0.0005","12.9837","0.0005","13.0995","0.0005","112.581","0.004","95.502","0.003","112.579","0.004","1688.53","0.15","123","2","123","2","","","","","","","","10","P -1","-P 1","2","","","","- C28.2 H25.9 B Cl0.4 Cu F4 Mo2 N2.5 O4 P2 -","- C28.2 H25.9 B Cl0.4 Cu F4 Mo2 N2.5 O4 P2 -","- C56.4 H51.8 B2 Cl0.8 Cu2 F8 Mo4 N5 O8 P4 -","2","1","","Elsayed Moussa, M.; Attenberger, B.; Peresypkina, E. V.; Fleischmann, M.; Balázs, G; Scheer, M.","Facile synthesis of one-dimensional organometallic-organic hybrid polymers based on a diphosphorus complex and flexible bipyridyl linkers.","Chemical communications (Cambridge, England)","2016","52","65","10004","10007","10.1039/c6cc05224j","","x-ray","1.54178","CuKα","","0.0691","0.0664","","","0.1857","0.1886","","","","","","1.08","","","","has coordinates,has disorder","234298","2020-10-21","18:00:00",""
"7124860","11.051","0.0003","12.9411","0.0003","14.5125","0.0004","107.454","0.002","109.734","0.002","92.922","0.002","1836.64","0.09","150","2","150","2","","","","","","","","10","P -1","-P 1","2","","","","- C28.1 H22.2 B Cl0.2 Cu F4 Mo2 N2 O8 P2 -","- C28.1 H22 B Cl0.2 Cu F4 Mo2 N2 O8 P2 -","- C56.2 H44 B2 Cl0.4 Cu2 F8 Mo4 N4 O16 P4 -","2","1","","Elsayed Moussa, M.; Attenberger, B.; Peresypkina, E. V.; Fleischmann, M.; Balázs, G; Scheer, M.","Facile synthesis of one-dimensional organometallic-organic hybrid polymers based on a diphosphorus complex and flexible bipyridyl linkers.","Chemical communications (Cambridge, England)","2016","52","65","10004","10007","10.1039/c6cc05224j","","","1.54178","CuKα","","0.0627","0.0554","","","0.1845","0.1932","","","","","","1.073","","","","has coordinates,has disorder","234298","2020-10-21","18:00:00",""
"7124861","23.3364","0.0011","15.9366","0.0004","20.1067","0.0007","90","","116.735","0.004","90","","6678.3","0.5","123","1","123","1","","","","","","","see text","10","C 1 2/c 1","-C 2yc","15","","","","- C57 H46 B2 Cl2 Cu2 F8 Mo4 N4 O16 P4 -","- C57 H46 B2 Cl2 Cu2 F8 Mo4 N4 O16 P4 -","- C228 H184 B8 Cl8 Cu8 F32 Mo16 N16 O64 P16 -","4","0.5","","Elsayed Moussa, M.; Attenberger, B.; Peresypkina, E. V.; Fleischmann, M.; Balázs, G; Scheer, M.","Facile synthesis of one-dimensional organometallic-organic hybrid polymers based on a diphosphorus complex and flexible bipyridyl linkers.","Chemical communications (Cambridge, England)","2016","52","65","10004","10007","10.1039/c6cc05224j","","x-ray","1.54178","CuKα","","0.05","0.041","","","0.1204","0.1256","","","","","","1.063","","","","has coordinates","234298","2020-10-21","18:00:00",""
"7124862","14.9491","0.0003","11.0572","0.0003","20.4604","0.0004","90","","102.897","0.002","90","","3296.69","0.13","99.97","0.15","99.97","0.15","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H17 B2 F20 N -","- C36 H17 B2 F20 N -","- C144 H68 B8 F80 N4 -","4","1","","Körte, Leif A; Blomeyer, Sebastian; Heidemeyer, Shari; Mix, Andreas; Neumann, Beate; Mitzel, Norbert W.","Intramolecular cooperativity in frustrated Lewis pairs.","Chemical communications (Cambridge, England)","2016","52","64","9949","9952","10.1039/c6cc05228b","","x-ray","1.54184","CuKα","","0.0478","0.0352","","","0.083","0.0902","","","","","","1.03","","","","has coordinates","234300","2020-10-21","18:00:00",""
"7124863","7.0022","0.0006","11.1149","0.001","12.7151","0.001","72.088","0.008","85.357","0.007","77.321","0.008","918.58","0.14","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C13 H22 B10 O2 -","- C13 H22 B10 O2 -","- C26 H44 B20 O4 -","2","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0728","0.0481","","","0.0989","0.1091","","","","","","1","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124864","6.9249","0.0005","11.0485","0.0012","13.4241","0.0014","70.985","0.01","82.699","0.007","79.375","0.007","951.9","0.17","173","0.1","173","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C14 H24 B10 O2 -","- C14 H24 B10 O2 -","- C28 H48 B20 O4 -","2","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0931","0.051","","","0.0933","0.1114","","","","","","1.001","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124865","7.3998","0.0003","11.4524","0.0005","12.796","0.0005","101.746","0.003","102.967","0.004","101.723","0.004","998.81","0.08","100.01","0.1","100.01","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C15 H27 B10 N O2 -","- C15 H27 B10 N O2 -","- C30 H54 B20 N2 O4 -","2","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0398","0.0384","","","0.098","0.0994","","","","","","1.001","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124866","14.2465","0.0015","6.9536","0.0007","19.296","0.003","90","","103.257","0.014","90","","1860.6","0.4","99.95","0.13","99.95","0.13","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H21 B10 Cl O2 -","- C13 H21 B10 Cl O2 -","- C52 H84 B40 Cl4 O8 -","4","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","0.71073","MoKα","","0.1786","0.0795","","","0.1376","0.1836","","","","","","1","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124867","14.3765","0.0002","6.99225","0.00009","19.7177","0.0003","90","","105.687","0.0016","90","","1908.28","0.05","173","0.1","173","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H21 B10 Br O2 -","- C13 H21 B10 Br O2 -","- C52 H84 B40 Br4 O8 -","4","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0391","0.0346","","","0.0894","0.0927","","","","","","1","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124868","15.59137","0.00016","7.11207","0.00007","20.7564","0.0002","90","","106.786","0.0011","90","","2203.55","0.04","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 B10 O2 -","- C19 H26 B10 O2 -","- C76 H104 B40 O8 -","4","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0388","0.0373","","","0.0969","0.0984","","","","","","1.001","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124869","7.5123","0.0003","11.5047","0.0005","13.1285","0.0006","109.896","0.004","91.522","0.004","105.035","0.004","1022.13","0.09","173","1","173","1","","","","","","","","4","P -1","-P 1","2","","","","- C17 H24 B10 O2 -","- C17 H24 B10 O2 -","- C34 H48 B20 O4 -","2","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0537","0.0504","","","0.1358","0.1396","","","","","","1.001","","","","has coordinates,has disorder","234304","2020-10-21","18:00:00",""
"7124870","26.4656","0.0006","8.57309","0.00014","20.8506","0.0004","90","","111.965","0.002","90","","4387.43","0.16","100.01","0.1","100.01","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 B10 O3 -","- C18 H26 B10 O3 -","- C144 H208 B80 O24 -","8","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0547","0.0453","","","0.1284","0.1359","","","","","","1.001","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124871","22.1533","0.0003","6.78019","0.00007","23.3341","0.0003","90","","100.05","0.0011","90","","3451.09","0.07","99.96","0.1","99.96","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H20 B10 O3 -","- C11 H20 B10 O3 -","- C88 H160 B80 O24 -","8","2","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0533","0.047","","","0.1247","0.1317","","","","","","1.001","","","","has coordinates,has disorder","234304","2020-10-21","18:00:00",""
"7124872","14.009","0.002","7.0087","0.0011","17.9756","0.0019","90","","100.292","0.012","90","","1736.5","0.4","99.94","0.14","99.94","0.14","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H20 B10 O2 S -","- C11 H20 B10 O2 S -","- C44 H80 B40 O8 S4 -","4","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.1209","0.0636","","","0.1079","0.133","","","","","","1.001","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124873","14.1171","0.0003","7.06182","0.00011","17.8292","0.0003","90","","100.102","0.0018","90","","1749.88","0.06","99.95","0.19","99.95","0.19","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H20 B10 O2 S -","- C11 H20 B10 O2 S -","- C44 H80 B40 O8 S4 -","4","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.0467","0.0378","","","0.0967","0.1019","","","","","","1.01","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124874","22.0219","0.0003","6.88628","0.0001","24.2999","0.0004","90","","104.579","0.0016","90","","3566.4","0.1","99.94","0.18","99.94","0.18","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H21 B10 N O2 -","- C12 H21 B10 N O2 -","- C96 H168 B80 N8 O16 -","8","1","","Zheng, Fangrui; Leung, Tsz-Fai; Chan, Ka-Wing; Sung, Herman H. Y.; Williams, Ian D.; Xie, Zuowei; Jia, Guochen","Phosphine-catalyzed cage carbon functionalization of o-carborane: facile synthesis of alkenylcarboranes.","Chemical communications (Cambridge, England)","2016","52","71","10767","10770","10.1039/c6cc05283e","","x-ray","1.54184","CuKα","","0.045","0.041","","","0.11","0.1134","","","","","","1.001","","","","has coordinates","234304","2020-10-21","18:00:00",""
"7124875","18.7517","0.0001","28.4384","0.0003","21.539","0.0002","90","","115.122","0.0003","90","","10399.6","0.16","113","2","113","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C124 Cl12 N7 O73 Si2 Sn6 W18 -","- C124 Cl12 N7 O73 Si2 Sn6 W18 -","- C248 Cl24 N14 O146 Si4 Sn12 W36 -","2","1","","Suzuki, Kosuke; Hanaya, Takumi; Sato, Rinta; Minato, Takuo; Yamaguchi, Kazuya; Mizuno, Noritaka","Hexanuclear tin(ii) and mixed valence tin(ii,iv) oxide clusters within polyoxometalates.","Chemical communications (Cambridge, England)","2016","52","70","10688","10691","10.1039/c6cc05284c","","","0.71069","MoKα","","0.0875","0.0724","","","0.1845","0.2046","","","","","","1.038","","","","has coordinates,has disorder","234306","2020-10-21","18:00:00",""
"7124876","17.6999","0.0002","18.7362","0.0002","29.8744","0.0004","82.659","0.001","88.278","0.001","74.291","0.001","9458.9","0.2","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C115 N10 O77 Si2 Sn6 W18 -","- C115 N10 O77 Si2 Sn6 W18 -","- C230 N20 O154 Si4 Sn12 W36 -","2","1","","Suzuki, Kosuke; Hanaya, Takumi; Sato, Rinta; Minato, Takuo; Yamaguchi, Kazuya; Mizuno, Noritaka","Hexanuclear tin(ii) and mixed valence tin(ii,iv) oxide clusters within polyoxometalates.","Chemical communications (Cambridge, England)","2016","52","70","10688","10691","10.1039/c6cc05284c","","","0.71069","MoKα","","0.1126","0.0767","","","0.1869","0.2039","","","","","","1.048","","","","has coordinates","234306","2020-10-21","18:00:00",""
"7124877","13.967","0.005","15.48","0.005","20.893","0.005","89.948","0.005","83.096","0.005","89.209","0.005","4484","2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H36 F4 N2 O8 Zn2 -","- C64 H36 F4 N2 O8 Zn2 -","- C128 H72 F8 N4 O16 Zn4 -","2","1","","Wang, Fangming; Liu, Wei; Teat, Simon J.; Xu, Feng; Wang, Hao; Wang, Xinlong; An, Litao; Li, Jing","Chromophore-immobilized luminescent metal-organic frameworks as potential lighting phosphors and chemical sensors.","Chemical communications (Cambridge, England)","2016","52","67","10249","10252","10.1039/c6cc05290h","","","0.7749","synchrotron","","0.102","0.0965","","","0.3234","0.3447","","","","","","1.098","","","","has coordinates,has disorder","234308","2020-10-21","18:00:00",""
"7124878","16.317","0.0006","16.8197","0.0007","20.0452","0.0008","89.982","0.002","85.952","0.002","85.919","0.002","5473.6","0.4","253","2","253","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H38 F4 N2 O8 Zn2 -","- C66 H38 F4 N2 O8 Zn2 -","- C132 H76 F8 N4 O16 Zn4 -","2","1","","Wang, Fangming; Liu, Wei; Teat, Simon J.; Xu, Feng; Wang, Hao; Wang, Xinlong; An, Litao; Li, Jing","Chromophore-immobilized luminescent metal-organic frameworks as potential lighting phosphors and chemical sensors.","Chemical communications (Cambridge, England)","2016","52","67","10249","10252","10.1039/c6cc05290h","","","0.7749","synchrotron","","0.0794","0.0588","","","0.1846","0.1996","","","","","","1.063","","","","has coordinates,has disorder","234308","2020-10-21","18:00:00",""
"7124879","10.023","0.004","7.569","0.003","13.421","0.005","90","","108.949","0.007","90","","963","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H22 S2 -","- C23 H22 S2 -","- C46 H44 S4 -","2","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.0822","0.0694","","","0.1679","0.1791","","","","","","1.031","","","","has coordinates","234311","2020-10-21","18:00:00",""
"7124880","15.567","0.002","7.3046","0.0011","12.5049","0.0018","90","","107.222","0.003","90","","1358.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 O S2 -","- C15 H16 O S2 -","- C60 H64 O4 S8 -","4","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.0569","0.0481","","","0.1325","0.1401","","","","","","1.06","","","","has coordinates","234311","2020-10-21","18:00:00",""
"7124881","10.601","0.002","19.272","0.004","11.193","0.002","90","","117.501","0.004","90","","2028.4","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C52 H40 O2 S4 -","- C52 H40 O2 S4 -","- C104 H80 O4 S8 -","2","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.1405","0.0938","","","0.1988","0.2244","","","","","","1.039","","","","has coordinates","234311","2020-10-21","18:00:00",""
"7124882","22.945","0.01","11.378","0.004","16.575","0.006","90","","111.887","0.012","90","","4015","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 O S2 -","- C26 H19 O S2 -","- C208 H152 O8 S16 -","8","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.1679","0.0942","","","0.2161","0.2571","","","","","","1.017","","","","has coordinates,has disorder","234311","2020-10-21","18:00:00",""
"7124883","12.9088","0.0008","13.5954","0.0008","18.3182","0.001","90","","93.268","0.001","90","","3209.6","0.3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C28 H38 Au F6 N O2 P Sb -","- C28 H38 Au F6 N O2 P Sb -","- C112 H152 Au4 F24 N4 O8 P4 Sb4 -","4","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.0491","0.0342","","","0.0845","0.0911","","","","","","1.036","","","","has coordinates,has disorder","234311","2020-10-21","18:00:00",""
"7124884","11.9307","0.0016","11.8029","0.0015","13.8044","0.0018","90","","98.163","0.003","90","","1924.2","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 S2 -","- C26 H20 S2 -","- C104 H80 S8 -","4","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.0726","0.0536","","","0.1388","0.1507","","","","","","1.04","","","","has coordinates,has disorder","234311","2020-10-21","18:00:00",""
"7124885","15.8061","0.0019","6.3393","0.0008","21.023","0.003","90","","95.291","0.003","90","","2097.5","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20 S2 -","- C29 H20 S2 -","- C116 H80 S8 -","4","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.0769","0.053","","","0.1362","0.1506","","","","","","1.042","","","","has coordinates","234311","2020-10-21","18:00:00",""
"7124886","9.8628","0.0016","11.701","0.0019","12.236","0.002","108.538","0.003","104.931","0.003","90.24","0.003","1287.9","0.4","273","2","273.15","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H24 O3 S2 -","- C28 H24 O3 S2 -","- C56 H48 O6 S4 -","2","1","","Xu, Wei; Chen, Ming; Sun, Ning; Liu, Yuanhong","Gold-catalyzed cyclization of 1,6-diynyl dithioacetals via 1,7-carbene transfer and aromatic C-H functionalization.","Chemical communications (Cambridge, England)","2016","52","73","11000","11003","10.1039/c6cc05302e","","","0.71073","MoKα","","0.1132","0.0483","","","0.1134","0.1295","","","","","","0.888","","","","has coordinates","234311","2020-10-21","18:00:00",""
"7124887","6.1447","0.0004","8.6445","0.0006","12.6178","0.0009","90","","101.032","0.003","90","","657.84","0.08","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H11 Cl N4 O -","- C13 H11 Cl N4 O -","- C26 H22 Cl2 N8 O2 -","2","1","","Vishwanath, Manjunatha; Sivamuthuraman, Koilpitchai; Kesavan, Venkitasamy","An efficient construction of N,N-bicyclic pyrazolidinones comprising enaminonitriles via asymmetric [3+2] cycloaddition.","Chemical communications (Cambridge, England)","2016","52","83","12314","12317","10.1039/c6cc05304a","","","0.71073","MoKα","","0.0465","0.0344","","","0.0629","0.0666","","","","","","1.134","","","","has coordinates","234313","2020-10-21","18:00:00",""
"7124888","11.225","0.002","12.338","0.002","18.269","0.003","72.433","0.003","82.638","0.004","89.18","0.004","2391.5","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H96 Br8 Dy6 N14 O32 -","- C50 H96 Br8 Dy6 N14 O32 -","- C50 H96 Br8 Dy6 N14 O32 -","1","0.5","","Li, Xiao-Lei; Wu, Jianfeng; Tang, Jinkui; Le Guennic, Boris; Shi, Wei; Cheng, Peng","A planar triangular Dy3 + Dy3 single-molecule magnet with a toroidal magnetic moment.","Chemical communications (Cambridge, England)","2016","52","61","9570","9573","10.1039/c6cc05326b","","","0.71073","MoKα","","0.1206","0.0851","","","0.226","0.2555","","","","","","1.042","","","","has coordinates","234315","2020-10-21","18:00:00",""
"7124889","6.897","0.0005","15.6685","0.0009","9.6096","0.0006","90","","102.131","0.007","90","","1015.28","0.12","100","2","100","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C16 H16 Co Dy N8 O5 -","- C16 H14 Co Dy N8 O5 -","- C32 H28 Co2 Dy2 N16 O10 -","2","0.5","","Chorazy, Szymon; Wang, Junhao; Ohkoshi, Shin-Ichi","Yellow to greenish-blue colour-tunable photoluminescence and 4f-centered slow magnetic relaxation in a cyanido-bridged Dy(III)(4-hydroxypyridine)-Co(III) layered material.","Chemical communications (Cambridge, England)","2016","52","71","10795","10798","10.1039/c6cc05337h","","x-ray","0.71075","MoKα","","0.0801","0.0624","","","0.1023","0.1119","","","","","","1.21","","","","has coordinates","234317","2020-10-21","18:00:00",""
"7124890","12.9667","0.0006","18.0916","0.0008","18.8976","0.0009","90","","95.342","0.004","90","","4413.9","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H62 Cl2 N4 O4 Zr -","- C45 H62 Cl2 N4 O4 Zr -","- C180 H248 Cl8 N16 O16 Zr4 -","4","1","","Schneider, Fabian; Zhao, Tiankun; Huhn, Thomas","Cytotoxic heteroleptic heptacoordinate salan zirconium(iv)-bis-chelates - synthesis, aqueous stability and X-ray structure analysis.","Chemical communications (Cambridge, England)","2016","52","66","10151","10154","10.1039/c6cc05359a","","","0.71073","MoKα","","0.0581","0.0468","","","0.1235","0.1306","","","","","","1.056","","","","has coordinates","234319","2020-10-21","18:00:00",""
"7124891","9.4729","0.0014","22.863","0.005","12.408","0.002","90","","93.774","0.014","90","","2681.5","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H33 N3 O6 Zr -","- C29 H33 N3 O6 Zr -","- C116 H132 N12 O24 Zr4 -","4","1","","Schneider, Fabian; Zhao, Tiankun; Huhn, Thomas","Cytotoxic heteroleptic heptacoordinate salan zirconium(iv)-bis-chelates - synthesis, aqueous stability and X-ray structure analysis.","Chemical communications (Cambridge, England)","2016","52","66","10151","10154","10.1039/c6cc05359a","","","0.71073","MoKα","","0.0285","0.023","","","0.0652","0.0665","","","","","","1.243","","","","has coordinates","234319","2020-10-21","18:00:00",""
"7124892","9.8867","0.001","10.3242","0.001","16.1713","0.0016","76.107","0.006","86.224","0.006","73.616","0.006","1537.3","0.3","150","2","149.99","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H29 B2 F10 N O2 -","- C31 H29 B2 F10 N O2 -","- C62 H58 B4 F20 N2 O4 -","2","1","","Fleige, Mirco; Möbus, Juri; Vom Stein, Thorsten; Glorius, Frank; Stephan, Douglas W.","Lewis acid catalysis: catalytic hydroboration of alkynes initiated by Piers' borane.","Chemical communications (Cambridge, England)","2016","52","72","10830","10833","10.1039/c6cc05360b","","","0.71073","MoKα","","0.1429","0.0552","","","0.1213","0.1566","","","","","","1.0147","","","","has coordinates","234321","2020-10-21","18:00:00",""
"7124893","21","0.0018","7.6152","0.0006","23.7899","0.0019","90","","112.403","0.002","90","","3517.3","0.5","179","2","179","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 Br N2 O2 -","- C20 H16 Br N2 O2 -","- C160 H128 Br8 N16 O16 -","8","2","","Das, Tapas; Kayet, Anirban; Mishra, Ruchika; Singh, Vinod K.","Highly fluorescent 1,2-dihydropyrimido[1,6-α]indole: an efficient metal free synthesis and photophysical study.","Chemical communications (Cambridge, England)","2016","52","75","11231","11234","10.1039/c6cc05378e","","","0.71073","MoKα","","0.0917","0.0495","","","0.094","0.1062","","","","","","1.031","","","","has coordinates","234323","2020-10-21","18:00:00",""
"7124894","26.6592","0.0009","23.6211","0.0007","19.6982","0.0007","90","","90","","90","","12404.3","0.7","120","","120","","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C120 H101 B Cl6 N12 O5 -","- C120 H101 B Cl6 N12 O5 -","- C480 H404 B4 Cl24 N48 O20 -","4","0.5","","Zhang, Yuehong; Oh, Juwon; Wang, Kang; Shin, Dongju; Zhan, Xiaopeng; Zheng, Yingting; Kim, Dongho; Jiang, Jianzhuang","The first porphyrin-subphthalocyaninatoboron(iii)-fused hybrid with unique conformation and intramolecular charge transfer behavior.","Chemical communications (Cambridge, England)","2016","52","69","10517","10520","10.1039/c6cc05383a","","","1.54184","CuKα","","0.0948","0.0831","","","0.2429","0.2563","","","","","","1.065","","","","has coordinates","234325","2020-10-21","18:00:00",""
"7124895","7.0903","0.0005","10.2299","0.001","11.0836","0.001","67.824","0.009","77.107","0.007","79.532","0.007","721.45","0.12","180.01","0.1","180.01","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C19 H16 O3 -","- C19 H16 O3 -","- C38 H32 O6 -","2","1","","Jiang, Chongguo; Xiong, Zhiling; Jin, Shengfei; Gao, Peng; Tang, Yingzhan; Wang, Yanshi; Du, Chuan; Wang, Xiaoyu; Liu, Yang; Lin, Bin; Liu, Yongxiang; Cheng, Maosheng","A Au(i)-catalyzed hydrogen bond-directed tandem strategy to synthesize indeno-chromen-4-one and indeno-quinolin-4-one derivatives.","Chemical communications (Cambridge, England)","2016","52","77","11516","11519","10.1039/c6cc05391b","","","0.71073","MoKα","","0.0736","0.0538","","","0.1363","0.1531","","","","","","1.1","","","","has coordinates","234327","2020-10-21","18:00:00",""
"7124896","20.898","0.003","20.898","0.003","20.898","0.003","90","","90","","90","","9127","2","296","2","296","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C78 H66 Eu N7 O18 -","- C78 H66 Eu N7 O18 -","- C312 H264 Eu4 N28 O72 -","4","0.333333","","Sun, Yan-Qiong; Wan, Fang; Li, Xin-Xiong; Lin, Jian; Wu, Tao; Zheng, Shou-Tian; Bu, Xianhui","A lanthanide complex for metal encapsulations and anion exchanges.","Chemical communications (Cambridge, England)","2016","52","66","10125","10128","10.1039/c6cc05404h","","","0.71073","MoKα","","0.0643","0.0559","","","0.1544","0.1595","","","","","","1.041","","","","has coordinates","234329","2020-10-21","18:00:00",""
"7124897","20.509","0.0001","20.509","0.0001","20.509","0.0001","90","","90","","90","","8626.48","0.07","296","2","296","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C78 H60 Cd Eu N7.5 O26 -","- C78 H60 Cd0.99 Eu N7.5 O25.97 -","- C312 H240 Cd3.96 Eu4 N30 O103.88 -","4","0.333333","","Sun, Yan-Qiong; Wan, Fang; Li, Xin-Xiong; Lin, Jian; Wu, Tao; Zheng, Shou-Tian; Bu, Xianhui","A lanthanide complex for metal encapsulations and anion exchanges.","Chemical communications (Cambridge, England)","2016","52","66","10125","10128","10.1039/c6cc05404h","","","1.54178","CuKα","","0.0733","0.0711","","","0.1996","0.2039","","","","","","1.057","","","","has coordinates","234329","2020-10-21","18:00:00",""
"7124898","20.25","0.003","12.1502","0.0017","13.984","0.004","90","","123.951","0.002","90","","2854.1","1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 Cl4 Hg2 N2 O5 -","- C26 H20 Cl4 Hg2 N2 O5 -","- C104 H80 Cl16 Hg8 N8 O20 -","4","0.5","","Sun, Yan-Qiong; Wan, Fang; Li, Xin-Xiong; Lin, Jian; Wu, Tao; Zheng, Shou-Tian; Bu, Xianhui","A lanthanide complex for metal encapsulations and anion exchanges.","Chemical communications (Cambridge, England)","2016","52","66","10125","10128","10.1039/c6cc05404h","","","0.71073","MoKα","","0.0419","0.0331","","","0.0999","0.1152","","","","","","1.132","","","","has coordinates","234329","2020-10-21","18:00:00",""
"7124899","16.777","0.003","12.3446","0.0019","13.27","0.002","90","","96.886","0.002","90","","2728.5","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H48 N8 O25 Pb2 -","- C53 H40 N8 O24 Pb2 -","- C106 H80 N16 O48 Pb4 -","2","0.5","","Sun, Yan-Qiong; Wan, Fang; Li, Xin-Xiong; Lin, Jian; Wu, Tao; Zheng, Shou-Tian; Bu, Xianhui","A lanthanide complex for metal encapsulations and anion exchanges.","Chemical communications (Cambridge, England)","2016","52","66","10125","10128","10.1039/c6cc05404h","","","0.71073","MoKα","","0.0415","0.0323","","","0.1002","0.1174","","","","","","1.181","","","","has coordinates","234329","2020-10-21","18:00:00",""
"7124900","18.222","0.009","5.648","0.003","20.014","0.009","90","","97.925","0.011","90","","2040.1","1.7","293","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 -","- C14 H12 -","- C112 H96 -","8","2","","Chen, Gen-Qiang; Fang, Wei; Wei, Yin; Tang, Xiang-Ying; Shi, Min","Gold(i)-catalyzed dehydrogenative cycloisomerization of 1,5-enynes.","Chemical communications (Cambridge, England)","2016","52","71","10799","10802","10.1039/c6cc05423d","","","0.71073","MoKα","","0.1948","0.1149","","","0.2699","0.3205","","","","","","1.036","","","","has coordinates","234332","2020-10-21","18:00:00",""
"7124901","9.821","0.003","12.383","0.003","15.111","0.004","79.156","0.003","84.922","0.004","73.193","0.003","1726.7","0.8","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H30 B Cl3 N4 O2 -","- C41 H30 B Cl3 N4 O2 -","- C82 H60 B2 Cl6 N8 O4 -","2","1","","Saikawa, Makoto; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of figure-of-eight helical bisBODIPY macrocycles and their chiroptical properties.","Chemical communications (Cambridge, England)","2016","52","71","10727","10730","10.1039/c6cc05439k","","","0.71073","MoKα","","0.0737","0.0648","","","0.2141","0.2214","","","","","","1.746","","","","has coordinates","234335","2020-10-21","18:00:00",""
"7124902","13.411","0.003","20.416","0.005","21.32","0.005","75.181","0.003","83.052","0.004","88.03","0.003","5602","2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C61.5 H46.5 B Cl4.5 N4 O6 -","- C61.5 H46.5 B Cl4.5 N4 O6 -","- C246 H186 B4 Cl18 N16 O24 -","4","2","","Saikawa, Makoto; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of figure-of-eight helical bisBODIPY macrocycles and their chiroptical properties.","Chemical communications (Cambridge, England)","2016","52","71","10727","10730","10.1039/c6cc05439k","","","0.71073","MoKα","","0.1712","0.0912","","","0.2259","0.2635","","","","","","0.998","","","","has coordinates","234335","2020-10-21","18:00:00",""
"7124903","9.887","0.003","11.839","0.004","15.495","0.005","77.762","0.003","80.071","0.003","66.473","0.003","1617.3","0.9","120","2","120","2","","","","","","","","6","P 1","P 1","1","","","","- C40.5 H30 B Cl N4 O2 -","- C40.5 H30 B Cl N4 O2 -","- C81 H60 B2 Cl2 N8 O4 -","2","2","","Saikawa, Makoto; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of figure-of-eight helical bisBODIPY macrocycles and their chiroptical properties.","Chemical communications (Cambridge, England)","2016","52","71","10727","10730","10.1039/c6cc05439k","","","0.71073","MoKα","","0.1166","0.0789","","","0.1516","0.1712","","","","","","1.185","","","","has coordinates,has disorder","234335","2020-10-21","18:00:00",""
"7124904","11.4322","0.0004","16.3704","0.0005","12.5755","0.0004","90","","100.994","0.002","90","","2310.31","0.13","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C60 H42 B2 N4 O6 -","- C60 H42 B2 N4 O6 -","- C120 H84 B4 N8 O12 -","2","1","","Saikawa, Makoto; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of figure-of-eight helical bisBODIPY macrocycles and their chiroptical properties.","Chemical communications (Cambridge, England)","2016","52","71","10727","10730","10.1039/c6cc05439k","","","0.71073","MoKα","","0.0619","0.0443","","","0.1254","0.1431","","","","","","1.045","","","","has coordinates","234335","2020-10-21","18:00:00",""
"7124905","27.3653","0.0013","13.783","0.0007","31.7984","0.0014","90","","114.516","0.003","90","","10912.3","0.9","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H44 B2 Cl6 N4 O6 -","- C62 H44 B2 Cl6 N4 O6 -","- C496 H352 B16 Cl48 N32 O48 -","8","2","","Saikawa, Makoto; Nakamura, Takashi; Uchida, Junji; Yamamura, Masaki; Nabeshima, Tatsuya","Synthesis of figure-of-eight helical bisBODIPY macrocycles and their chiroptical properties.","Chemical communications (Cambridge, England)","2016","52","71","10727","10730","10.1039/c6cc05439k","","","0.71073","MoKα","","0.1407","0.0847","","","0.2289","0.2564","","","","","","1.522","","","","has coordinates,has disorder","234335","2020-10-21","18:00:00",""
"7124906","11.5483","0.0008","15.6266","0.0011","19.1969","0.0012","90","","90","","90","","3464.3","0.4","123","2","123","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C33 H53 B K N3 O Si -","- C33 H53 B K N3 O Si -","- C132 H212 B4 K4 N12 O4 Si4 -","4","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.1004","0.0739","","","0.2044","0.2236","","","","","","1.092","","","","has coordinates","234338","2020-10-21","18:00:00",""
"7124907","21.1923","0.0012","21.1923","0.0012","18.9615","0.0015","90","","90","","90","","8515.9","1","123","2","123","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C47 H59 N O3 Si Zn -","- C47 H59 N O3 Si Zn -","- C376 H472 N8 O24 Si8 Zn8 -","8","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.0908","0.0543","","","0.1238","0.1477","","","","","","1.027","","","","has coordinates","234338","2020-10-21","18:00:00",""
"7124908","15.203","0.003","11.974","0.002","19.965","0.004","90","","100.3","0.03","90","","3575.9","1.2","123","2","123","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C33 H53 B Br N3 O Si Zn -","- C33 H53 B Br N3 O Si Zn -","- C132 H212 B4 Br4 N12 O4 Si4 Zn4 -","4","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.0516","0.0327","","","0.0676","0.0739","","","","","","1.009","","","","has coordinates","234338","2020-10-21","18:00:00",""
"7124909","13.39","0.003","14.317","0.003","20.067","0.004","80.79","0.03","79.66","0.03","71.54","0.03","3567.7","1.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H98 N2 O2 Si2 Zn2 -","- C84 H98 N2 O2 Si2 Zn2 -","- C168 H196 N4 O4 Si4 Zn4 -","2","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.7109","Synchrotron","","0.0426","0.0385","","","0.0998","0.1023","","","","","","1.047","","","","has coordinates","234338","2020-10-21","18:00:00",""
"7124910","14.0869","0.0004","15.8901","0.0005","17.1769","0.0005","72.101","0.001","81.448","0.001","81.036","0.001","3593.29","0.19","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H48.98 Br0.02 N Si Zn -","- C42 H48.9793 Br0.02065 N Si Zn -","- C168 H195.917 Br0.0826 N4 Si4 Zn4 -","4","2","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.046","0.0395","","","0.11","0.114","","","","","","1.05","","","","has coordinates,has disorder","234338","2020-10-21","18:00:00",""
"7124911","20.9835","0.001","20.9835","0.001","37.613","0.003","90","","90","","90","","16561.3","1.7","123","2","123","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C45 H54 Br N O3 Si Zn -","- C45 H54 Br N O3 Si Zn -","- C720 H864 Br16 N16 O48 Si16 Zn16 -","16","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.112","0.0597","","","0.1136","0.1364","","","","","","1.023","","","","has coordinates","234338","2020-10-21","18:00:00",""
"7124912","27.289","0.006","12.855","0.003","28.084","0.006","90","","90","","90","","9852","4","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C55.75 H62 N O2 Si Zn -","- C55.75 H62 N O2 Si Zn -","- C446 H496 N8 O16 Si8 Zn8 -","8","2","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.7109","Synchrotron","","0.0785","0.0543","","","0.125","0.1377","","","","","","1.034","","","","has coordinates,has disorder","234338","2020-10-21","18:00:00",""
"7124913","18.699","0.004","10.648","0.002","37.755","0.008","90","","90","","90","","7517","3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C44 H53 N Si Zn -","- C44 H53 N Si Zn -","- C352 H424 N8 Si8 Zn8 -","8","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.7109","Synchrotron","","0.102","0.0711","","","0.1865","0.2061","","","","","","1.06","","","","has coordinates,has disorder","234338","2020-10-21","18:00:00",""
"7124914","9.9787","0.0014","11.6997","0.0014","14.992","0.002","88.8","0.003","85.337","0.004","72.292","0.003","1661.8","0.4","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H41 N Si Zn -","- C38 H41 N Si Zn -","- C76 H82 N2 Si2 Zn2 -","2","1","","Dawkins, Michael J. C.; Middleton, Ewart; Kefalidis, Christos E.; Dange, Deepak; Juckel, Martin M.; Maron, Laurent; Jones, Cameron","Two-coordinate terminal zinc hydride complexes: synthesis, structure and preliminary reactivity studies.","Chemical communications (Cambridge, England)","2016","52","69","10490","10492","10.1039/c6cc05445e","","","0.71073","MoKα","","0.1237","0.065","","","0.1462","0.1691","","","","","","1.034","","","","has coordinates,has disorder","234338","2020-10-21","18:00:00",""
"7124915","8.1067","0.0003","15.997","0.0007","18.8373","0.0007","90","","99.636","0.004","90","","2408.41","0.17","293","2","293.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H23 Br N2 O2 -","- C28 H23 Br N2 O2 -","- C112 H92 Br4 N8 O8 -","4","1","","Zhou, Xiaorong; Peng, Zhixing; Zhao, Hongyang; Zhang, Zhiyin; Lu, Ping; Wang, Yanguang","Rh-Catalyzed annulations of N-methoxybenzamides with ketenimines: synthesis of 3-aminoisoindolinones and 3-diarylmethyleneisoindolinones with strong aggregation induced emission properties.","Chemical communications (Cambridge, England)","2016","52","70","10676","10679","10.1039/c6cc05456k","","","1.54184","CuKα","","0.1332","0.1289","","","0.394","0.3992","","","","","","1.839","","","","has coordinates","234341","2020-10-21","18:00:00",""
"7124916","13.2048","0.0006","9.7962","0.0004","36.3","0.002","90","","90.681","0.005","90","","4695.3","0.4","170.2","","170.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H23 N O -","- C32 H23 N O -","- C256 H184 N8 O8 -","8","2","","Zhou, Xiaorong; Peng, Zhixing; Zhao, Hongyang; Zhang, Zhiyin; Lu, Ping; Wang, Yanguang","Rh-Catalyzed annulations of N-methoxybenzamides with ketenimines: synthesis of 3-aminoisoindolinones and 3-diarylmethyleneisoindolinones with strong aggregation induced emission properties.","Chemical communications (Cambridge, England)","2016","52","70","10676","10679","10.1039/c6cc05456k","","","0.71073","MoKα","","0.0724","0.0467","","","0.1016","0.1186","","","","","","1.033","","","","has coordinates","234341","2020-10-21","18:00:00",""
"7124917","9.7155","0.0005","11.1424","0.0006","33.67","0.002","90","","94.871","0.006","90","","3631.7","0.3","293","2","293.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C44 H31 N O -","- C44 H31 N O -","- C176 H124 N4 O4 -","4","1","","Zhou, Xiaorong; Peng, Zhixing; Zhao, Hongyang; Zhang, Zhiyin; Lu, Ping; Wang, Yanguang","Rh-Catalyzed annulations of N-methoxybenzamides with ketenimines: synthesis of 3-aminoisoindolinones and 3-diarylmethyleneisoindolinones with strong aggregation induced emission properties.","Chemical communications (Cambridge, England)","2016","52","70","10676","10679","10.1039/c6cc05456k","","","0.71073","MoKα","","0.1051","0.0676","","","0.1744","0.195","","","","","","1.048","","","","has coordinates","234341","2020-10-21","18:00:00",""
"7124918","10.4031","0.0006","11.9265","0.0007","11.9819","0.0007","64.8219","0.0016","75.0617","0.0017","82.2082","0.0017","1299.34","0.13","50","2","50","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H90 Cl4 N6 O2 Re -","- C42 H90 Cl4 N6 O2 Re -","- C42 H90 Cl4 N6 O2 Re -","1","0.5","","Feng, Xiaowen; Liu, Jun-Liang; Pedersen, Kasper S.; Nehrkorn, Joscha; Schnegg, Alexander; Holldack, Karsten; Bendix, Jesper; Sigrist, Marc; Mutka, Hannu; Samohvalov, Dumitru; Aguilà, David; Tong, Ming-Liang; Long, Jeffrey R.; Clérac, Rodolphe","Multifaceted magnetization dynamics in the mononuclear complex [Re<sup>IV</sup>Cl<sub>4</sub>(CN)<sub>2</sub>]<sup>2</sup>.","Chemical communications (Cambridge, England)","2016","52","87","12905","12908","10.1039/c6cc05473k","","","0.71073","MoKα","","0.0824","0.0624","","","0.1584","0.1708","","","","","","1.033","","","","has coordinates","234343","2020-10-21","18:00:00",""
"7124919","5.617","0.0011","7.3899","0.0016","14.156","0.003","75.267","0.013","80.383","0.012","88.88","0.013","560.1","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H9 F3 N2 O -","- C13 H9 F3 N2 O -","- C26 H18 F6 N4 O2 -","2","1","","Ragupathi, Ayyakkannu; Sagadevan, Arunachalam; Lin, Chun-Cheng; Hwu, Jih-Ru; Hwang, Kuo Chu","Copper(i)-catalysed oxidative C-N coupling of 2-aminopyridine with terminal alkynes featuring a C[triple bond, length as m-dash]C bond cleavage promoted by visible light.","Chemical communications (Cambridge, England)","2016","52","79","11756","11759","10.1039/c6cc05506k","","","0.71073","MoKα","","0.1601","0.123","","","0.3629","0.4026","","","","","","1.378","","","","has coordinates","234345","2020-10-21","18:00:00",""
"7124920","7.662","0.005","13.433","0.009","13.883","0.01","90","","90","","90","","1428.9","1.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C5 H16 Cl5 N2 Sb -","- C5 H16 Cl5 N2 Sb -","- C20 H64 Cl20 N8 Sb4 -","4","1","","Mei, Guang-Quan; Zhang, Han-Yue; Liao, Wei-Qiang","A symmetry breaking phase transition-triggered high-temperature solid-state quadratic nonlinear optical switch coupled with a switchable dielectric constant in an organic-inorganic hybrid compound.","Chemical communications (Cambridge, England)","2016","52","74","11135","11138","10.1039/c6cc05512e","","","0.71073","MoKα","","0.0332","0.0295","","","0.0507","0.0516","","","","","","1.003","","","","has coordinates","234347","2020-10-21","18:00:00",""
"7124921","13.514","0.01","7.818","0.012","13.8","0.02","90","","90","","90","","1458","3","393","2","393","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C5 H16 Cl5 N2 Sb -","- C5 H16 Cl5 N2 Sb -","- C20 H64 Cl20 N8 Sb4 -","4","0.5","","Mei, Guang-Quan; Zhang, Han-Yue; Liao, Wei-Qiang","A symmetry breaking phase transition-triggered high-temperature solid-state quadratic nonlinear optical switch coupled with a switchable dielectric constant in an organic-inorganic hybrid compound.","Chemical communications (Cambridge, England)","2016","52","74","11135","11138","10.1039/c6cc05512e","","","0.71073","MoKα","","0.0859","0.0637","","","0.1308","0.1439","","","","","","1.037","","","","has coordinates","234347","2020-10-21","18:00:00",""
"7124922","11.09321","0.00015","22.0757","0.0003","28.1078","0.0004","90","","92.8099","0.0013","90","","6875.05","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ti2-H","","- C70 H78 N2 O2 Ti2 -","- C70 H78 N2 O2 Ti2 -","- C280 H312 N8 O8 Ti8 -","4","1","","Liu, Cham-Chuen; Chan, Michael C. W.; Lo, Po-Kam; Lau, Kai-Chung; Yiu, Shek-Man","Multifaceted chelating μ-(η(3):η(3)-antifacial)-(cis-C4R2H2) coordination motif in binuclear complexes.","Chemical communications (Cambridge, England)","2016","52","74","11056","11059","10.1039/c6cc05535d","","","1.54178","CuKα","","0.0522","0.0461","","","0.1301","0.136","","","","","","1.055","","","","has coordinates,has disorder","234349","2020-10-21","18:00:00",""
"7124923","11.3506","0.0003","15.5365","0.0005","19.1544","0.0006","79.469","0.002","79.993","0.002","81.353","0.002","3245.81","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Zr2-H","","- C72 H83 N2 O2.5 Zr2 -","- C72 H83 N2 O2.5 Zr2 -","- C144 H166 N4 O5 Zr4 -","2","1","","Liu, Cham-Chuen; Chan, Michael C. W.; Lo, Po-Kam; Lau, Kai-Chung; Yiu, Shek-Man","Multifaceted chelating μ-(η(3):η(3)-antifacial)-(cis-C4R2H2) coordination motif in binuclear complexes.","Chemical communications (Cambridge, England)","2016","52","74","11056","11059","10.1039/c6cc05535d","","","1.5418","CuKα","","0.0399","0.0377","","","0.1129","0.1149","","","","","","1.067","","","","has coordinates,has disorder","234349","2020-10-21","18:00:00",""
"7124924","14.6909","0.0003","16.2174","0.0003","27.5623","0.0006","90","","103.614","0.002","90","","6382.2","0.2","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hf2-Me","","- C73.5 H85.5 Hf2 N2 O2 -","- C73.5 H85.5 Hf2 N2 O2 -","- C294 H342 Hf8 N8 O8 -","4","1","","Liu, Cham-Chuen; Chan, Michael C. W.; Lo, Po-Kam; Lau, Kai-Chung; Yiu, Shek-Man","Multifaceted chelating μ-(η(3):η(3)-antifacial)-(cis-C4R2H2) coordination motif in binuclear complexes.","Chemical communications (Cambridge, England)","2016","52","74","11056","11059","10.1039/c6cc05535d","","","1.54178","CuKα","","0.0272","0.0264","","","0.069","0.0694","","","","","","1.18","","","","has coordinates,has disorder","234349","2020-10-21","18:00:00",""
"7124925","15.1344","0.0009","20.6079","0.0013","21.8351","0.0012","90","","90.019","0.006","90","","6810.1","0.7","95","2","95","2","","","","","","","no","7","P 1 21/c 1","-P 2ybc","14","no","salt of triscandiumnitride endofullerene C80 with sodium cryptand cation","","- C211 H82 Cl5 N6 Na2 O12 Sc6 -","- C211 H82 Cl5 N6 Na2 O12 Sc6 -","- C422 H164 Cl10 N12 Na4 O24 Sc12 -","2","0.5","","Konarev, Dmitri V.; Zorina, Leokadiya V.; Khasanov, Salavat S.; Popov, Alexey A.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","A crystalline anionic complex of scandium nitride endometallofullerene: experimental observation of single-bonded (Sc3N@Ih-C80(-))2 dimers.","Chemical communications (Cambridge, England)","2016","52","71","10763","10766","10.1039/c6cc05550h","","","0.71073","MoKα","","0.2389","0.1401","","","0.3451","0.3943","","","","","","1.319","","","","has coordinates,has disorder","234351","2020-10-21","18:00:00",""
"7124926","13.8362","0.0007","15.0709","0.0008","20.3113","0.001","89.161","0.004","79.646","0.004","73.544","0.004","3992.8","0.4","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C67.5 H108 O13 S6 Zn4 -","- C67.5 H108 O13 S6 Zn4 -","- C135 H216 O26 S12 Zn8 -","2","1","","Kelly, Rory P.; Kazeminejad, Neda; Lamsfus, Carlos A.; Maron, Laurent; Roesky, Peter W.","Activation of SO<sub>2</sub> by [Zn(Cp*)<sub>2</sub>] and [(Cp*)Zn<sup>I</sup>-Zn<sup>I</sup>(Cp*)].","Chemical communications (Cambridge, England)","2016","52","89","13090","13093","10.1039/c6cc05638e","","","0.71073","MoKα","","0.1389","0.0903","","","0.217","0.2452","","","","","","0.958","","","","has coordinates,has disorder","234353","2020-10-21","18:00:00",""
"7124927","12.903","0.0008","15.8305","0.0008","13.4913","0.0009","90","","103.699","0.005","90","","2677.4","0.3","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 N4 O8 S3 Zn2 -","- C16 H40 N4 O8 S3 Zn2 -","- C64 H160 N16 O32 S12 Zn8 -","4","1","","Kelly, Rory P.; Kazeminejad, Neda; Lamsfus, Carlos A.; Maron, Laurent; Roesky, Peter W.","Activation of SO<sub>2</sub> by [Zn(Cp*)<sub>2</sub>] and [(Cp*)Zn<sup>I</sup>-Zn<sup>I</sup>(Cp*)].","Chemical communications (Cambridge, England)","2016","52","89","13090","13093","10.1039/c6cc05638e","","","0.71073","MoKα","","0.0529","0.0323","","","0.0547","0.0582","","","","","","0.836","","","","has coordinates,has disorder","234353","2020-10-21","18:00:00",""
"7124928","8.6037","0.0008","9.6242","0.0009","13.0214","0.0012","79.03","0.002","81.504","0.002","74.717","0.002","1015.65","0.16","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C29 H20 O2 -","- C29 H20 O2 -","- C58 H40 O4 -","2","1","","Chen, Ling; Cui, Yu-Ming; Xu, Zheng; Cao, Jian; Zheng, Zhan-Jiang; Xu, Li-Wen","An efficient approach toward formation of polycyclic coumarin derivatives via carbocation-initiated [4+2] cycloaddition and atom-economical photo-irradiated cyclization.","Chemical communications (Cambridge, England)","2016","52","74","11131","11134","10.1039/c6cc05698a","","","0.71073","MoKα","","0.0619","0.0433","","","0.1124","0.125","","","","","","1.023","","","","has coordinates","234355","2020-10-21","18:00:00",""
"7124929","8.1218","0.0005","27.7422","0.0016","12.2315","0.0007","90","","95.062","0.002","90","","2745.2","0.3","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 O4 -","- C17 H14 O4 -","- C136 H112 O32 -","8","2","","Ji, Wei; Liu, Guofeng; Wang, Fang; Zhu, Zhu; Feng, Chuanliang","Galactose-decorated light-responsive hydrogelator precursors for selectively killing cancer cells.","Chemical communications (Cambridge, England)","2016","52","85","12574","12577","10.1039/c6cc05707a","","","1.54178","CuKα","","0.0409","0.037","","","0.1032","0.1066","","","","","","1.015","","","","has coordinates","234356","2020-10-21","18:00:00",""
"7124930","9.6437","0.0004","11.6855","0.0005","12.1217","0.0006","87.115","0.002","71.784","0.002","82.973","0.002","1287.7","0.1","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H33 N3 O2 -","- C29 H33 N3 O2 -","- C58 H66 N6 O4 -","2","1","","Quinodoz, P.; Wright, K.; Drouillat, B.; David, O.; Marrot, J.; Couty, F.","Synthesis of homopropargylamines from 2-cyanoazetidines.","Chemical communications (Cambridge, England)","2016","52","65","10072","10075","10.1039/c6cc05713f","","","0.71073","MoKα","","0.0791","0.0511","","","0.1632","0.196","","","","","","1.106","","","","has coordinates","234358","2020-10-21","18:00:00",""
"7124931","20.325","0.004","11.622","0.002","8.52","0.0017","90","","90","","90","","2012.6","0.7","173","2","173","2","","","","","","","","2","P c a 21","P 2c -2ac","29","","","","- C28 H26 -","- C28 H26 -","- C112 H104 -","4","1","","Wang, Guohua; Chen, Chao; Peng, Jing","Copper-catalyzed intramolecular aryl-bicyclization of diynes with diaryliodonium salts via vinyl cations.","Chemical communications (Cambridge, England)","2016","52","67","10277","10280","10.1039/c6cc05735g","","","0.71073","MoKα","","","0.0547","","","0.1565","0.1625","","","","","","1.03","","","","has coordinates","234360","2020-10-21","18:00:00",""
"7124932","23.432","0.002","23.432","0.002","23.432","0.002","90","","90","","90","","12865.5","1.9","173","2","173","2","","","","","","","","6","I 2 3","I 2 2 3","197","","","","- C192 H240 Cl4 N36 Ni4 O16 -","- C192 H240 Cl4 N36 Ni4 O16 -","- C384 H480 Cl8 N72 Ni8 O32 -","2","0.0833333","","Xi, Sai-Fei; Bao, Ling-Yu; Lin, Jian-Guo; Liu, Qing-Zhu; Qiu, Ling; Zhang, Feng-Li; Wang, Yu-Xia; Ding, Zheng-Dong; Li, Ke; Gu, Zhi-Guo","Enantiomers of tetrahedral metal-organic cages: a new class of highly efficient G-quadruplex ligands with potential anticancer activities.","Chemical communications (Cambridge, England)","2016","52","67","10261","10264","10.1039/c6cc05743h","","","0.71073","MoKα","","0.1989","0.1512","","","0.3731","0.3992","","","","","","1.343","","","","has coordinates","234362","2020-10-21","18:00:00",""
"7124933","23.4359","0.0005","23.4359","0.0005","23.4359","0.0005","90","","90","","90","","12872","0.5","173","2","173","2","","","","","","","","6","I 2 3","I 2 2 3","197","","","","- C192 H240 Cl4 N36 Ni4 O16 -","- C192 H240 Cl4 N36 Ni1.32 O16 -","- C384 H480 Cl8 N72 Ni2.64 O32 -","2","0.0833333","","Xi, Sai-Fei; Bao, Ling-Yu; Lin, Jian-Guo; Liu, Qing-Zhu; Qiu, Ling; Zhang, Feng-Li; Wang, Yu-Xia; Ding, Zheng-Dong; Li, Ke; Gu, Zhi-Guo","Enantiomers of tetrahedral metal-organic cages: a new class of highly efficient G-quadruplex ligands with potential anticancer activities.","Chemical communications (Cambridge, England)","2016","52","67","10261","10264","10.1039/c6cc05743h","","","0.71073","MoKα","","0.1623","0.112","","","0.2942","0.3282","","","","","","1.131","","","","has coordinates,has disorder","234362","2020-10-21","18:00:00",""
"7124934","18.9274","0.0016","19.8289","0.0016","22.328","0.002","110.839","0.002","102.662","0.002","108.564","0.002","6881.7","1","173","2","173","2","","","","","","","","7","P 1","P 1","1","","","","- C204 H264 B6 F24 N36 Ni4 O12 -","- C204 H264 B6 F24 N36 Ni4 O12 -","- C204 H264 B6 F24 N36 Ni4 O12 -","1","1","","Xi, Sai-Fei; Bao, Ling-Yu; Lin, Jian-Guo; Liu, Qing-Zhu; Qiu, Ling; Zhang, Feng-Li; Wang, Yu-Xia; Ding, Zheng-Dong; Li, Ke; Gu, Zhi-Guo","Enantiomers of tetrahedral metal-organic cages: a new class of highly efficient G-quadruplex ligands with potential anticancer activities.","Chemical communications (Cambridge, England)","2016","52","67","10261","10264","10.1039/c6cc05743h","","","0.71073","MoKα","","0.1874","0.0932","","","0.1948","0.2168","","","","","","1.038","","","","has coordinates,has disorder","234362","2020-10-21","18:00:00",""
"7124935","39.2624","0.001","39.2624","0.001","39.2624","0.001","90","","90","","90","","60524","3","173","2","173","2","","","","","","","","6","F 41 3 2","F 4d 2 3","210","","","","- C240 H276 Cl4 N36 Ni4 O6 -","- C240 H276 Cl4 N36 Ni1.32 O6 -","- C1920 H2208 Cl32 N288 Ni10.56 O48 -","8","0.0833333","","Xi, Sai-Fei; Bao, Ling-Yu; Lin, Jian-Guo; Liu, Qing-Zhu; Qiu, Ling; Zhang, Feng-Li; Wang, Yu-Xia; Ding, Zheng-Dong; Li, Ke; Gu, Zhi-Guo","Enantiomers of tetrahedral metal-organic cages: a new class of highly efficient G-quadruplex ligands with potential anticancer activities.","Chemical communications (Cambridge, England)","2016","52","67","10261","10264","10.1039/c6cc05743h","","","0.71073","MoKα","","0.1229","0.0774","","","0.1898","0.2048","","","","","","1.126","","","","has coordinates,has disorder","234362","2020-10-21","18:00:00",""
"7124936","19.222","0.003","20.854","0.003","22.254","0.003","106.518","0.003","103.878","0.004","112.172","0.003","7289.5","1.9","173","2","173","2","","","","","","","","7","P 1","P 1","1","","","","- C241 H264 F3 N36 Ni4 O3 S -","- C241 H264 F3 N36 Ni4 O3 S -","- C241 H264 F3 N36 Ni4 O3 S -","1","1","","Xi, Sai-Fei; Bao, Ling-Yu; Lin, Jian-Guo; Liu, Qing-Zhu; Qiu, Ling; Zhang, Feng-Li; Wang, Yu-Xia; Ding, Zheng-Dong; Li, Ke; Gu, Zhi-Guo","Enantiomers of tetrahedral metal-organic cages: a new class of highly efficient G-quadruplex ligands with potential anticancer activities.","Chemical communications (Cambridge, England)","2016","52","67","10261","10264","10.1039/c6cc05743h","","","0.71073","MoKα","","0.182","0.101","","","0.2209","0.2438","","","","","","1.054","","","","has coordinates,has disorder","234362","2020-10-21","18:00:00",""
"7124937","12.4966","0.0006","9.7777","0.0004","22.6334","0.0012","90","","100.263","0.004","90","","2721.3","0.2","290.83","0.1","290.83","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 F4 N2 O5 -","- C29 H28 F4 N2 O5 -","- C116 H112 F16 N8 O20 -","4","1","","Hua, Hui-Liang; Zhang, Bo-Sheng; He, Yu-Tao; Qiu, Yi-Feng; Hu, Jing-Yuan; Yang, Yu-Chen; Liang, Yong-Min","Copper-catalyzed difluoromethylation of propargylamide-substituted indoles: synthesis of mono- and bis-difluoromethylated indoloazepinone derivatives.","Chemical communications (Cambridge, England)","2016","52","68","10396","10399","10.1039/c6cc05745d","","x-ray","0.71073","MoKα","","0.105","0.0573","","","0.1308","0.1605","","","","","","1.027","","","","has coordinates","234365","2020-10-21","18:00:00",""
"7124938","12.2175","0.0002","15.8782","0.0003","22.0697","0.0004","90","","90","","90","","4281.34","0.13","291.48","0.1","291.48","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H22 F2 N2 O3 -","- C24 H22 F2 N2 O3 -","- C192 H176 F16 N16 O24 -","8","1","","Hua, Hui-Liang; Zhang, Bo-Sheng; He, Yu-Tao; Qiu, Yi-Feng; Hu, Jing-Yuan; Yang, Yu-Chen; Liang, Yong-Min","Copper-catalyzed difluoromethylation of propargylamide-substituted indoles: synthesis of mono- and bis-difluoromethylated indoloazepinone derivatives.","Chemical communications (Cambridge, England)","2016","52","68","10396","10399","10.1039/c6cc05745d","","x-ray","1.54184","CuKα","","0.0618","0.0485","","","0.1263","0.1408","","","","","","1.026","","","","has coordinates","234365","2020-10-21","18:00:00",""
"7124939","12.8985","0.0011","14.8772","0.0011","27.961","0.003","90","","97.992","0.008","90","","5313.4","0.8","293.26","0.1","293.26","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 Cl F4 N2 O5 -","- C28 H25 Cl F4 N2 O5 -","- C224 H200 Cl8 F32 N16 O40 -","8","2","","Hua, Hui-Liang; Zhang, Bo-Sheng; He, Yu-Tao; Qiu, Yi-Feng; Hu, Jing-Yuan; Yang, Yu-Chen; Liang, Yong-Min","Copper-catalyzed difluoromethylation of propargylamide-substituted indoles: synthesis of mono- and bis-difluoromethylated indoloazepinone derivatives.","Chemical communications (Cambridge, England)","2016","52","68","10396","10399","10.1039/c6cc05745d","","x-ray","0.71073","MoKα","","0.1698","0.0888","","","0.2027","0.2627","","","","","","1.041","","","","has coordinates","234365","2020-10-21","18:00:00",""
"7124940","8.118","0.007","16.336","0.013","8.515","0.006","90","","91.597","0.014","90","","1128.8","1.5","173","","173","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H28 N2 O -","- C29 H28 N2 O -","- C58 H56 N4 O2 -","2","1","","Wilkie, Ross P.; Neal, Andrew R.; Johnston, Craig A.; Voute, Nicholas; Lancefield, Christopher S.; Stell, Matthew D.; Medda, Federico; Makiyi, Edward F.; Turner, Emma M.; Stephen Ojo, O.; Slawin, Alexandra M. Z.; Lebl, Tomas; Mullen, Peter; Harrison, David J.; Ireland, Chris M.; Westwood, Nicholas J.","Total synthesis of dehaloperophoramidine using a highly diastereoselective Hosomi-Sakurai reaction.","Chemical communications (Cambridge, England)","2016","52","71","10747","10750","10.1039/c6cc05747k","","","1.54187","CuKα","","0.0882","0.0637","","","0.1492","0.1777","","","","","","1.063","","","","has coordinates","234367","2020-10-21","18:00:00",""
"7124941","24.722","0.004","24.722","0.004","13.524","0.002","90","","90","","120","","7158","2","93","","93","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C41 H38 N4 O2 -","- C41 H38 N4 O2 -","- C369 H342 N36 O18 -","9","0.5","","Wilkie, Ross P.; Neal, Andrew R.; Johnston, Craig A.; Voute, Nicholas; Lancefield, Christopher S.; Stell, Matthew D.; Medda, Federico; Makiyi, Edward F.; Turner, Emma M.; Stephen Ojo, O.; Slawin, Alexandra M. Z.; Lebl, Tomas; Mullen, Peter; Harrison, David J.; Ireland, Chris M.; Westwood, Nicholas J.","Total synthesis of dehaloperophoramidine using a highly diastereoselective Hosomi-Sakurai reaction.","Chemical communications (Cambridge, England)","2016","52","71","10747","10750","10.1039/c6cc05747k","","","0.71069","MoKα","","0.0735","0.0636","","","0.1746","0.1846","","","","","","1.051","","","","has coordinates","234367","2020-10-21","18:00:00",""
"7124942","6.691","0.005","29.96","0.02","12.952","0.012","90","","104.2","0.02","90","","2517","3","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H27 B F4 N4 -","- C28 H27 B F4 N4 -","- C112 H108 B4 F16 N16 -","4","1","","Wilkie, Ross P.; Neal, Andrew R.; Johnston, Craig A.; Voute, Nicholas; Lancefield, Christopher S.; Stell, Matthew D.; Medda, Federico; Makiyi, Edward F.; Turner, Emma M.; Stephen Ojo, O.; Slawin, Alexandra M. Z.; Lebl, Tomas; Mullen, Peter; Harrison, David J.; Ireland, Chris M.; Westwood, Nicholas J.","Total synthesis of dehaloperophoramidine using a highly diastereoselective Hosomi-Sakurai reaction.","Chemical communications (Cambridge, England)","2016","52","71","10747","10750","10.1039/c6cc05747k","","","1.54187","CuKα","","0.2607","0.1742","","","0.4114","0.4607","","","","","","1.382","","","","has coordinates","234367","2020-10-21","18:00:00",""
"7124943","13.438","0.003","14.165","0.002","13.5796","0.0019","90","","93.657","0.003","90","","2579.6","0.8","125","","125","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H31 N3 O S -","- C29 H31 N3 O S -","- C116 H124 N12 O4 S4 -","4","2","","Wilkie, Ross P.; Neal, Andrew R.; Johnston, Craig A.; Voute, Nicholas; Lancefield, Christopher S.; Stell, Matthew D.; Medda, Federico; Makiyi, Edward F.; Turner, Emma M.; Stephen Ojo, O.; Slawin, Alexandra M. Z.; Lebl, Tomas; Mullen, Peter; Harrison, David J.; Ireland, Chris M.; Westwood, Nicholas J.","Total synthesis of dehaloperophoramidine using a highly diastereoselective Hosomi-Sakurai reaction.","Chemical communications (Cambridge, England)","2016","52","71","10747","10750","10.1039/c6cc05747k","","","1.54187","CuKα","","0.0607","0.0594","","","0.1505","0.1522","","","","","","1.035","","","","has coordinates","234367","2020-10-21","18:00:00",""
"7124944","18.372","0.006","10.659","0.002","28.255","0.005","90","","100.193","0.01","90","","5446","2","100","2","100","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C56 H82 N4 Na4 O6 -","- C56 H82 N4 Na4 O6 -","- C224 H328 N16 Na16 O24 -","4","1","","Lichtenberg, C.; Krummenacher, I.","Aminotroponiminates as tunable, redox-active ligands: reversible single electron transfer and reductive dimerisation.","Chemical communications (Cambridge, England)","2016","52","65","10044","10047","10.1039/c6cc05762d","","","0.71073","MoKα","","0.1371","0.0706","","","0.1264","0.1462","","","","","","1.026","","","","has coordinates,has disorder","234370","2020-10-21","18:00:00",""
"7124945","14.5396","0.0011","9.6307","0.0006","20.8295","0.0015","90","","109.316","0.008","90","","2752.5","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H39 Co N6 O4 -","- C25 H39 Co N6 O4 -","- C100 H156 Co4 N24 O16 -","4","1","","Das, Debasree; Pattanayak, Santanu; Singh, Kundan K.; Garai, Bikash; Sen Gupta, Sayam","Electrocatalytic water oxidation by a molecular cobalt complex through a high valent cobalt oxo intermediate.","Chemical communications (Cambridge, England)","2016","52","79","11787","11790","10.1039/c6cc05773j","","","0.71073","MoKα","","0.1221","0.0773","","","0.2107","0.2855","","","","","","1.047","","","","has coordinates","234372","2020-10-21","18:00:00",""
"7124946","29.9091","0.0005","11.0908","0.0002","25.9834","0.0004","90","","108.075","0.002","90","","8193.8","0.3","150","2","150","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C167 H278 Al4 N8 O12 -","- C167 H278 Al4 N8 O12 -","- C334 H556 Al8 N16 O24 -","2","0.25","","McKeown, Paul; Davidson, Matthew G.; Kociok-Köhn, Gabriele; Jones, Matthew D.","Aluminium salalens vs. salans: ""Initiator Design"" for the isoselective polymerisation of rac-lactide.","Chemical communications (Cambridge, England)","2016","52","68","10431","10434","10.1039/c6cc05795k","","x-ray","1.54184","CuKα","","0.0399","0.0368","","","0.0989","0.1017","","","","","","1.021","","","","has coordinates,has disorder","234374","2020-10-21","18:00:00",""
"7124947","12.1388","0.0003","19.0837","0.0002","14.1406","0.0002","90","","102.663","0.002","90","","3196.04","0.1","150","2","150.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H51 Al N2 O3 -","- C33 H51 Al N2 O3 -","- C132 H204 Al4 N8 O12 -","4","1","","McKeown, Paul; Davidson, Matthew G.; Kociok-Köhn, Gabriele; Jones, Matthew D.","Aluminium salalens vs. salans: ""Initiator Design"" for the isoselective polymerisation of rac-lactide.","Chemical communications (Cambridge, England)","2016","52","68","10431","10434","10.1039/c6cc05795k","","x-ray","1.54184","CuKα","","0.0367","0.0336","","","0.0865","0.0886","","","","","","1.039","","","","has coordinates","234374","2020-10-21","18:00:00",""
"7124948","13.8779","0.0012","13.002","0.0001","20.8532","0.0016","90","","98.2288","0.0008","90","","3724","0.4","150","2","150.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H61 Al N2 O2 -","- C38 H61 Al N2 O2 -","- C152 H244 Al4 N8 O8 -","4","1","","McKeown, Paul; Davidson, Matthew G.; Kociok-Köhn, Gabriele; Jones, Matthew D.","Aluminium salalens vs. salans: ""Initiator Design"" for the isoselective polymerisation of rac-lactide.","Chemical communications (Cambridge, England)","2016","52","68","10431","10434","10.1039/c6cc05795k","","x-ray","1.54184","CuKα","","0.0431","0.0392","","","0.1036","0.107","","","","","","1.034","","","","has coordinates,has disorder","234374","2020-10-21","18:00:00",""
"7124949","10.9794","0.0003","14.2923","0.0004","15.1168","0.0005","115.692","0.003","100.605","0.003","102.864","0.002","1974.85","0.13","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H61 Al N2 O3 -","- C43 H61 Al N2 O3 -","- C86 H122 Al2 N4 O6 -","2","1","","McKeown, Paul; Davidson, Matthew G.; Kociok-Köhn, Gabriele; Jones, Matthew D.","Aluminium salalens vs. salans: ""Initiator Design"" for the isoselective polymerisation of rac-lactide.","Chemical communications (Cambridge, England)","2016","52","68","10431","10434","10.1039/c6cc05795k","","x-ray","1.54184","CuKα","","0.0427","0.0395","","","0.1024","0.1051","","","","","","1.02","","","","has coordinates","234374","2020-10-21","18:00:00",""
"7124950","22.001","0.001","13.607","0.001","17.541","0.001","90","","126.91","0.01","90","","4198.8","0.7","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bromido-hapto5-cyclopentadienyltriphenylphosphinenitrosyl technetium(I)","","- C23 H20 Br N O P Tc -","- C23 H20 Br N O P Tc -","- C184 H160 Br8 N8 O8 P8 Tc8 -","8","1","","Ackermann, J.; Hagenbach, A.; Abram, U.","{Tc(NO)(Cp)(PPh3)}(+) - a novel technetium(i) core.","Chemical communications (Cambridge, England)","2016","52","67","10285","10288","10.1039/c6cc05811f","","","0.71073","MoKα","","0.0481","0.0413","","","0.0954","0.0978","","","","","","1.217","","","","has coordinates","234377","2020-10-21","18:00:00",""
"7124951","9.27","0.001","17.374","0.001","14.27","0.001","90","","100.29","0.01","90","","2261.3","0.3","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[Tc(NO)(CO)(PPh3)]BF4","hapto5-cyclopentadienylcarbonyl triphenylphosphinenitrosyl technetium(I)","","- C24 H20 B F4 N O2 P Tc -","- C24 H20 B F4 N O2 P Tc -","- C96 H80 B4 F16 N4 O8 P4 Tc4 -","4","1","","Ackermann, J.; Hagenbach, A.; Abram, U.","{Tc(NO)(Cp)(PPh3)}(+) - a novel technetium(i) core.","Chemical communications (Cambridge, England)","2016","52","67","10285","10288","10.1039/c6cc05811f","","","0.71073","MoKα","","0.0362","0.0268","","","0.0622","0.0667","","","","","","1.044","","","","has coordinates","234377","2020-10-21","18:00:00",""
"7124952","9.179","0.001","13.937","0.001","10.048","0.007","90","","112.89","0.02","90","","1184.2","0.9","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","[Tc(NO)(Cp)(Ph)(PPh3)]","hapto5-cyclopentadienylphenyl triphenylphosphinenitrosyl technetium(I)","","- C29 H25 N O P Tc -","- C29 H25 N O P Tc -","- C58 H50 N2 O2 P2 Tc2 -","2","1","","Ackermann, J.; Hagenbach, A.; Abram, U.","{Tc(NO)(Cp)(PPh3)}(+) - a novel technetium(i) core.","Chemical communications (Cambridge, England)","2016","52","67","10285","10288","10.1039/c6cc05811f","","","0.71073","MoKα","","0.0144","0.0141","","","0.0358","0.0361","","","","","","0.714","","","","has coordinates","234377","2020-10-21","18:00:00",""
"7124953","12.551","0.001","14.394","0.001","44.488","0.004","90","","97.55","0.01","90","","7967.5","1.1","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[Tc(NO)Br3(OPPh3)2]","Tribromidobistriphenylphosphine oxid nitrosyl technetium(II)","","- C36.5 H31 Br3 Cl N O3 P2 Tc -","- C36.5 H31 Br3 Cl N O3 P2 Tc -","- C292 H248 Br24 Cl8 N8 O24 P16 Tc8 -","8","2","","Ackermann, J.; Hagenbach, A.; Abram, U.","{Tc(NO)(Cp)(PPh3)}(+) - a novel technetium(i) core.","Chemical communications (Cambridge, England)","2016","52","67","10285","10288","10.1039/c6cc05811f","","","0.71073","MoKα","","0.177","0.0673","","","0.1388","0.1782","","","","","","0.867","","","","has coordinates,has disorder","234377","2020-10-21","18:00:00",""
"7124954","8.782","0.0001","10.8274","0.0002","26.0299","0.0004","90","","90","","90","","2475.08","0.07","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H28 N2 O4 S -","- C25 H28 N2 O4 S -","- C100 H112 N8 O16 S4 -","4","1","","Rainoldi, G.; Faltracco, M.; Lo Presti, L.; Silvani, A.; Lesma, G.","Highly diastereoselective entry into chiral spirooxindole-based 4-methyleneazetidines via formal [2+2] annulation reaction.","Chemical communications (Cambridge, England)","2016","52","77","11575","11578","10.1039/c6cc05838h","","","0.71073","MoKα","","0.0457","0.035","","","0.0946","0.1013","","","","","","1.056","","","","has coordinates,has disorder","234379","2020-10-21","18:00:00",""
"7124955","18.5185","0.0005","18.5185","0.0005","19.1215","0.0011","90","","90","","120","","5678.9","0.4","173","2","173","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- C18 H12 Cu2 N0 O10 Si -","- C18 H12 Cu2 O10 Si -","- C108 H72 Cu12 O60 Si6 -","6","0.25","","Gao, Chao-Ying; Tian, Hong-Rui; Ai, Jing; Li, Lei-Jiao; Dang, Song; Lan, Ya-Qian; Sun, Zhong-Ming","A microporous Cu-MOF with optimized open metal sites and pore spaces for high gas storage and active chemical fixation of CO2.","Chemical communications (Cambridge, England)","2016","52","74","11147","11150","10.1039/c6cc05845k","","","0.71073","MoKα","","0.0561","0.0419","","","0.1199","0.1278","","","","","","0.996","","","","has coordinates","234381","2020-10-21","18:00:00",""
"7124956","9.7325","0.0002","9.7325","0.0002","8.2154","0.0001","90","","90","","90","","778.18","0.02","100","2","100","2","","","","","","","","7","P 4/n b m :2","-P 4a 2b","125","","","","- C8 H16 Cu F6 N4 O4 V -","- C8 H16 Cu F6 N4 O4 V -","- C16 H32 Cu2 F12 N8 O8 V2 -","2","0.125","","Manson, Jamie L.; Schlueter, John A.; Garrett, Kerry E.; Goddard, Paul A.; Lancaster, Tom; Möller, Johannes S; Blundell, Stephen J.; Steele, Andrew J.; Franke, Isabel; Pratt, Francis L.; Singleton, John; Bendix, Jesper; Lapidus, Saul H.; Uhlarz, Marc; Ayala-Valenzuela, Oscar; McDonald, Ross D.; Gurak, Mary; Baines, Christopher","Bimetallic MOFs (H<sub>3</sub>O)<sub>x</sub>[Cu(MF<sub>6</sub>)(pyrazine)<sub>2</sub>]·(4 - x)H<sub>2</sub>O (M = V<sup>4+</sup>, x = 0; M = Ga<sup>3+</sup>, x = 1): co-existence of ordered and disordered quantum spins in the V<sup>4+</sup> system.","Chemical communications (Cambridge, England)","2016","52","85","12653","12656","10.1039/c6cc05873f","","x-ray","0.71073","MoKα","","0.0256","0.022","","","0.066","0.0724","","","","","","0.816","","","","has coordinates","234384","2020-10-21","18:00:00",""
"7124957","9.7134","0.0002","9.7134","0.0002","8.2415","0.0001","90","","90","","90","","777.59","0.02","100","2","100","2","","","","","","","","7","P 4/n b m :2","-P 4a 2b","125","","","","- C8 H17 Cu F6 Ga N4 O4 -","- C8 H16 Cu F6 Ga N4 O4 -","- C16 H32 Cu2 F12 Ga2 N8 O8 -","2","0.125","","Manson, Jamie L.; Schlueter, John A.; Garrett, Kerry E.; Goddard, Paul A.; Lancaster, Tom; Möller, Johannes S; Blundell, Stephen J.; Steele, Andrew J.; Franke, Isabel; Pratt, Francis L.; Singleton, John; Bendix, Jesper; Lapidus, Saul H.; Uhlarz, Marc; Ayala-Valenzuela, Oscar; McDonald, Ross D.; Gurak, Mary; Baines, Christopher","Bimetallic MOFs (H<sub>3</sub>O)<sub>x</sub>[Cu(MF<sub>6</sub>)(pyrazine)<sub>2</sub>]·(4 - x)H<sub>2</sub>O (M = V<sup>4+</sup>, x = 0; M = Ga<sup>3+</sup>, x = 1): co-existence of ordered and disordered quantum spins in the V<sup>4+</sup> system.","Chemical communications (Cambridge, England)","2016","52","85","12653","12656","10.1039/c6cc05873f","","x-ray","0.71073","MoKα","","0.023","0.0203","","","0.0558","0.0575","","","","","","1.135","","","","has coordinates","234384","2020-10-21","18:00:00",""
"7124958","10.3006","0.0008","17.4826","0.0016","10.8631","0.0007","90","","92.484","0.006","90","","1954.4","0.3","294.59","0.1","294.59","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-benzyl-3-(2-methyl-1H-indol-3-yl)-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-one","","- C24 H20 N2 O2 -","- C24 H20 N2 O2 -","- C96 H80 N8 O8 -","4","1","","Huo, Congde; Dong, Jie; Su, Yingpeng; Tang, Jing; Chen, Fengjuan","Iron-catalyzed oxidative sp<sup>3</sup> carbon-hydrogen bond functionalization of 3,4-dihydro-1,4-benzoxazin-2-ones.","Chemical communications (Cambridge, England)","2016","52","91","13341","13344","10.1039/c6cc05885j","","x-ray","0.71073","MoKα","","0.1924","0.0741","","","0.1469","0.2135","","","","","","1.01","","","","has coordinates","234386","2020-10-21","18:00:00",""
"7124959","9.5967","0.001","9.265","0.0008","10.1709","0.001","90","","102.244","0.003","90","","883.76","0.15","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H22 N2 O2 S -","- C19 H22 N2 O2 S -","- C38 H44 N4 O4 S2 -","2","1","","Zhao, Quan-Qing; Hu, Xiao-Qiang; Yang, Meng-Nan; Chen, Jia-Rong; Xiao, Wen-Jing","A visible-light photocatalytic N-radical cascade of hydrazones for the synthesis of dihydropyrazole-fused benzosultams.","Chemical communications (Cambridge, England)","2016","52","86","12749","12752","10.1039/c6cc05897c","","","0.71073","MoKα","","0.076","0.0438","","","0.0767","0.0863","","","","","","1.026","","","","has coordinates","234388","2020-10-21","18:00:00",""
"7124960","9.31","0.0009","13.2449","0.0013","14.8906","0.0015","69.506","0.001","77.927","0.001","89.163","0.001","1678.5","0.3","100.15","","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 N2 O2 S -","- C19 H20 N2 O2 S -","- C76 H80 N8 O8 S4 -","4","2","","Zhao, Quan-Qing; Hu, Xiao-Qiang; Yang, Meng-Nan; Chen, Jia-Rong; Xiao, Wen-Jing","A visible-light photocatalytic N-radical cascade of hydrazones for the synthesis of dihydropyrazole-fused benzosultams.","Chemical communications (Cambridge, England)","2016","52","86","12749","12752","10.1039/c6cc05897c","","","0.71073","MoKα","","0.0485","0.0413","","","0.112","0.1181","","","","","","1.036","","","","has coordinates,has disorder","234388","2020-10-21","18:00:00",""
"7124961","10.9254","0.0012","13.4449","0.0014","15.8457","0.0017","95.9","0.004","100.524","0.004","95.947","0.004","2258.4","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C104 H92 Br8 Cl2 N4 O -","- C104 H92 Br8 Cl2 N4 O -","- C104 H92 Br8 Cl2 N4 O -","1","0.5","","Krzeszewski, Maciej; Swider, Paweł; Dobrzycki, Łukasz; Cyrański, Michał K; Danikiewicz, Witold; Gryko, Daniel T.","The role of steric hindrance in the intramolecular oxidative aromatic coupling of pyrrolo[3,2-b]pyrroles.","Chemical communications (Cambridge, England)","2016","52","77","11539","11542","10.1039/c6cc05904j","","","1.54178","CuKα","","0.0719","0.0538","","","0.1334","0.1469","","","","","","1.045","","","","has coordinates,has disorder","234389","2020-10-21","18:00:00",""
"7124962","13.91699","0.00011","19.62321","0.00016","14.94628","0.00011","90","","94.7717","0.0007","90","","4067.62","0.06","100.01","0.1","100.01","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H51 Ge N2 O P -","- C46 H51 Ge N2 O P -","- C184 H204 Ge4 N8 O4 P4 -","4","1","","Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg","N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.","Chemical communications (Cambridge, England)","2016","52","76","11343","11346","10.1039/c6cc05916c","","","1.54184","CuKα","","0.0269","0.0251","","","0.0664","0.0678","","","","","","1.04","","","","has coordinates","234391","2020-10-21","18:00:00",""
"7124963","9.4352","0.0003","12.6209","0.0007","17.8147","0.0008","85.36","0.004","78.369","0.003","76.089","0.003","2015.71","0.16","150.01","0.1","150.01","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C46 H51 N2 O P Si -","- C46 H51 N2 O P Si -","- C92 H102 N4 O2 P2 Si2 -","2","1","","Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg","N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.","Chemical communications (Cambridge, England)","2016","52","76","11343","11346","10.1039/c6cc05916c","","","1.54184","CuKα","","0.0534","0.051","","","0.1406","0.1445","","","","","","1.027","","","","has coordinates","234391","2020-10-21","18:00:00",""
"7124964","14.0166","0.0003","19.8309","0.0006","14.945","0.0004","90","","94.185","0.002","90","","4143.06","0.19","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H51 N2 O P Sn -","- C46 H51 N2 O P Sn -","- C184 H204 N8 O4 P4 Sn4 -","4","1","","Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg","N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.","Chemical communications (Cambridge, England)","2016","52","76","11343","11346","10.1039/c6cc05916c","","","0.71073","MoKα","","0.0595","0.0442","","","0.0796","0.0851","","","","","","1.086","","","","has coordinates","234391","2020-10-21","18:00:00",""
"7124965","10.64809","0.00019","11.6076","0.0002","19.4163","0.0003","91.4216","0.0014","92.8956","0.0014","110.289","0.0017","2245.77","0.07","292.34","0.1","292.34","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C49 H61 N2 O P Sn -","- C49 H61 N2 O P Sn -","- C98 H122 N4 O2 P2 Sn2 -","2","1","","Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg","N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.","Chemical communications (Cambridge, England)","2016","52","76","11343","11346","10.1039/c6cc05916c","","","1.54184","CuKα","","0.0352","0.0341","","","0.094","0.0952","","","","","","1.034","","","","has coordinates,has disorder","234391","2020-10-21","18:00:00",""
"7124966","24.0628","0.0002","12.8152","0.00009","25.4632","0.0002","90","","94.7933","0.0007","90","","7824.62","0.11","150.01","0.1","150.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H51 Ge N2 P -","- C45 H51 Ge N2 P -","- C360 H408 Ge8 N16 P8 -","8","2","","Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg","N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.","Chemical communications (Cambridge, England)","2016","52","76","11343","11346","10.1039/c6cc05916c","","","1.54184","CuKα","","0.0328","0.0275","","","0.0729","0.077","","","","","","1.008","","","","has coordinates","234391","2020-10-21","18:00:00",""
"7124967","13.0114","0.0003","17.0048","0.0005","18.7117","0.0005","111.389","0.003","94.838","0.002","110.638","0.003","3498.2","0.2","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C160 H164 N8 O1.5 P4 Sn4 -","- C160 H166 N8 O P4 Sn4 -","- C160 H166 N8 O P4 Sn4 -","1","0.5","","Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg","N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.","Chemical communications (Cambridge, England)","2016","52","76","11343","11346","10.1039/c6cc05916c","","","0.71073","MoKα","","0.0425","0.0326","","","0.0704","0.0761","","","","","","1.15","","","","has coordinates,has disorder","234391","2020-10-21","18:00:00",""
"7124968","11.998","0.006","14.423","0.006","21.871","0.009","90","","92.101","0.016","90","","3782","3","180","","180","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H41 N7 O2 -","- C51 H41 N7 O2 -","- C204 H164 N28 O8 -","4","1","","Mosca, Lorenzo; Čejka, Jan; Dolenský, Bohumil; Havlík, Martin; Jakubek, Milan; Kaplánek, Robert; Král, Vladimír; Anzenbacher, Pavel","Bowl-shaped Tröger's bases and their recognition properties.","Chemical communications (Cambridge, England)","2016","52","70","10664","10667","10.1039/c6cc05923f","","","0.71073","MoKα","","0.1721","0.1093","","0.3448","0.2715","0.3448","","","","","","1.0686","","","","has coordinates","234394","2020-10-21","18:00:00",""
"7124969","21.3761","0.0008","12.4047","0.0004","21.2424","0.0007","90","","113.697","0.002","90","","5157.8","0.3","180","","180","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C69 H52 N8 O4 -","- C69 H52 N8 O4 -","- C276 H208 N32 O16 -","4","1","","Mosca, Lorenzo; Čejka, Jan; Dolenský, Bohumil; Havlík, Martin; Jakubek, Milan; Kaplánek, Robert; Král, Vladimír; Anzenbacher, Pavel","Bowl-shaped Tröger's bases and their recognition properties.","Chemical communications (Cambridge, England)","2016","52","70","10664","10667","10.1039/c6cc05923f","","","1.5418","CuKα","","0.1467","0.0931","","0.2669","0.2275","0.2669","","","","","","1.0109","","","","has coordinates","234394","2020-10-21","18:00:00",""
"7124970","17.9422","0.0014","18.3629","0.0016","20.9128","0.0013","107.088","0.007","100.483","0.006","116.305","0.008","5498.3","1","190","","190","","","","","","","","","4","P -1","-P 1","2","","","","- C46 H38 Cl2 N6 -","- C46 H38 Cl2 N6 -","- C276 H228 Cl12 N36 -","6","3","","Mosca, Lorenzo; Čejka, Jan; Dolenský, Bohumil; Havlík, Martin; Jakubek, Milan; Kaplánek, Robert; Král, Vladimír; Anzenbacher, Pavel","Bowl-shaped Tröger's bases and their recognition properties.","Chemical communications (Cambridge, England)","2016","52","70","10664","10667","10.1039/c6cc05923f","","","1.5418","CuKα","","0.1479","0.0951","","0.2544","0.1854","0.2526","","","","","","1.0114","","","","has coordinates,has disorder","234394","2020-10-21","18:00:00",""
"7124971","31.37","0.003","31.37","0.003","7.8467","0.0013","90","","90","","90","","7721.8","1.7","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H14 Ag N7 O4 -","- C17 H14 Ag N7 O4 -","- C272 H224 Ag16 N112 O64 -","16","1","","Li, Cheng-Peng; Wang, Si; Guo, Wei; Yan, Yan; Du, Miao","Dual structure evolution of a Ag(i) supramolecular framework triggered by anion-exchange: replacement of terminal ligand and switching of network interpenetration degree.","Chemical communications (Cambridge, England)","2016","52","74","11060","11063","10.1039/c6cc05938d","","","0.71073","MoKα","","0.0476","0.0379","","","0.1165","0.131","","","","","","1.094","","","","has coordinates","234397","2020-10-21","18:00:00",""
"7124972","31.065","0.003","31.065","0.003","8.0003","0.0014","90","","90","","90","","7720.6","1.7","296","2","296","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H15 Ag N7 O3.5 -","- C17 H15 Ag N7 O3.5 -","- C272 H240 Ag16 N112 O56 -","16","1","","Li, Cheng-Peng; Wang, Si; Guo, Wei; Yan, Yan; Du, Miao","Dual structure evolution of a Ag(i) supramolecular framework triggered by anion-exchange: replacement of terminal ligand and switching of network interpenetration degree.","Chemical communications (Cambridge, England)","2016","52","74","11060","11063","10.1039/c6cc05938d","","","0.71073","MoKα","","0.0423","0.0309","","","0.0853","0.0917","","","","","","1.051","","","","has coordinates","234397","2020-10-21","18:00:00",""
"7124973","22.8131","0.0006","22.8131","0.0006","7.7879","0.0004","90","","90","","90","","4053.1","0.3","296","2","296","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C19 H14 Ag F3 N6 O3 -","- C19 H14 Ag F3 N6 O3 -","- C152 H112 Ag8 F24 N48 O24 -","8","1","","Li, Cheng-Peng; Wang, Si; Guo, Wei; Yan, Yan; Du, Miao","Dual structure evolution of a Ag(i) supramolecular framework triggered by anion-exchange: replacement of terminal ligand and switching of network interpenetration degree.","Chemical communications (Cambridge, England)","2016","52","74","11060","11063","10.1039/c6cc05938d","","","0.71073","MoKα","","0.0798","0.04","","","0.0876","0.111","","","","","","1.026","","","","has coordinates","234397","2020-10-21","18:00:00",""
"7124974","21.0286","0.0015","8.7204","0.0007","17.6555","0.0012","90","","99.237","0.005","90","","3195.6","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 F6 Fe N4 O2 P -","- C29 H41 F6 Fe N4 O2 P -","- C116 H164 F24 Fe4 N16 O8 P4 -","4","1","","Kwon, Yubin M.; Delgado, Mayra; Zakharov, Lev N.; Seda, Takele; Gilbertson, John D.","Nitrite reduction by a pyridinediimine complex with a proton-responsive secondary coordination sphere.","Chemical communications (Cambridge, England)","2016","52","73","11016","11019","10.1039/c6cc05962g","","","1.54178","CuKα","","0.1132","0.0647","","","0.1394","0.1614","","","","","","1.008","","","","has coordinates","234400","2020-10-21","18:00:00",""
"7124975","9.6385","0.0009","13.7609","0.0013","23.41","0.002","90","","92.164","0.002","90","","3102.8","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29.5 H41 Cl Fe N4 O2 -","- C29 H40 Fe N4 O2 -","- C116 H160 Fe4 N16 O8 -","4","1","","Kwon, Yubin M.; Delgado, Mayra; Zakharov, Lev N.; Seda, Takele; Gilbertson, John D.","Nitrite reduction by a pyridinediimine complex with a proton-responsive secondary coordination sphere.","Chemical communications (Cambridge, England)","2016","52","73","11016","11019","10.1039/c6cc05962g","","","0.71073","MoKα","","0.0662","0.0437","","","0.1051","0.1119","","","","","","1.071","","","","has coordinates","234400","2020-10-21","18:00:00",""
"7124976","10.0331","0.0009","13.3181","0.0012","14.1","0.0013","64.813","0.003","81.091","0.002","81.046","0.002","1675.9","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H44 Br3 Fe N5 -","- C29 H44 Br3 Fe N5 -","- C58 H88 Br6 Fe2 N10 -","2","1","","Kwon, Yubin M.; Delgado, Mayra; Zakharov, Lev N.; Seda, Takele; Gilbertson, John D.","Nitrite reduction by a pyridinediimine complex with a proton-responsive secondary coordination sphere.","Chemical communications (Cambridge, England)","2016","52","73","11016","11019","10.1039/c6cc05962g","","","0.71073","MoKα","","0.0893","0.0403","","","0.0591","0.0696","","","","","","1.007","","","","has coordinates","234400","2020-10-21","18:00:00",""
"7124977","8.4876","0.0005","12.8367","0.0007","16.0181","0.0009","112.855","0.004","90.553","0.004","99.918","0.004","1578.52","0.16","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H40 F6 Fe N6 O2 P -","- C27 H40 F6 Fe N6 O2 P -","- C54 H80 F12 Fe2 N12 O4 P2 -","2","1","","Kwon, Yubin M.; Delgado, Mayra; Zakharov, Lev N.; Seda, Takele; Gilbertson, John D.","Nitrite reduction by a pyridinediimine complex with a proton-responsive secondary coordination sphere.","Chemical communications (Cambridge, England)","2016","52","73","11016","11019","10.1039/c6cc05962g","","","1.54178","CuKα","","0.0799","0.061","","","0.173","0.1852","","","","","","1.01","","","","has coordinates","234400","2020-10-21","18:00:00",""
"7124978","9.4629","0.0002","11.35","0.0002","12.3473","0.0003","103.843","0.001","109.616","0.001","99.745","0.001","1166.87","0.04","296","2","296.15","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H25 Cl Hg N2 O3 -","- C25 H25 Cl Hg N2 O3 -","- C50 H50 Cl2 Hg2 N4 O6 -","2","1","","Hong, Jung-Ho; Kurapati, Sathish; Jo, Yunhee; Shin, June-Ho; Cho, Dong-Gyu","Accelerated hydration reaction of an unsymmetrical tolan evidenced by a Hg(ii)-trapped macrocycle and its application as a Hg(ii)-selective indicator.","Chemical communications (Cambridge, England)","2016","52","71","10759","10762","10.1039/c6cc06012a","","","0.71073","MoKα","","0.0259","0.025","","","0.0589","0.0593","","","","","","1.065","","","","has coordinates","234402","2020-10-21","18:00:00",""
"7124979","40.623","0.002","41.321","0.002","51.868","0.003","90","","90","","90","","87065","8","116","2","116.15","","","","","","","","","7","F 2 2 2","F 2 2","22","","","","- C127 H139 Cd2 Cr4 N8 Na5 O42 -","- C127 H139 Cd2 Cr4 N8 Na5 O42 -","- C2032 H2224 Cd32 Cr64 N128 Na80 O672 -","16","1","","Xia, Qingchun; Liu, Yan; Li, Zijian; Gong, Wei; Cui, Yong","A Cr(salen)-based metal-organic framework as a versatile catalyst for efficient asymmetric transformations.","Chemical communications (Cambridge, England)","2016","52","89","13167","13170","10.1039/c6cc06019f","","","1.54178","CuKα","","0.1186","0.065","","","0.1767","0.2161","","","","","","1.01","","","","has coordinates,has disorder","234405","2020-10-21","18:00:00",""
"7124980","4.7242","0.0012","12.369","0.003","13.831","0.003","90","","82.466","0.008","90","","801.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N2 O4 -","- C8 H8 N2 O4 -","- C32 H32 N8 O16 -","4","1","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.71073","MoKα","","0.1789","0.1138","","","0.1711","0.1931","","","","","","1.146","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124981","22.309","0.0019","19.1478","0.0016","9.01","0.0008","90","","91.398","0.003","90","","3847.6","0.6","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N2 O5 -","- C12 H16 N2 O5 -","- C144 H192 N24 O60 -","12","3","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.71073","MoKα","","0.11","0.0605","","","0.1375","0.1622","","","","","","0.989","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124982","13.3689","0.0018","15.143","0.002","18.786","0.003","77.079","0.003","74.563","0.004","63.839","0.003","3265.5","0.8","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H11 N3 O4 -","- C10 H11 N3 O4 -","- C120 H132 N36 O48 -","12","6","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.71073","MoKα","","0.1328","0.0892","","","0.2027","0.2243","","","","","","1.034","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124983","14.6759","0.0009","31.285","0.0019","15.9269","0.001","90","","99.324","0.002","90","","7216","0.8","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H14 N2 O5 -","- C11 H14 N2 O5 -","- C264 H336 N48 O120 -","24","6","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.71073","MoKα","","0.1293","0.079","","","0.1799","0.211","","","","","","1.055","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124984","17.707","0.003","17.707","0.003","7.3732","0.001","90","","90","","90","","2311.8","0.6","296","2","296","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","","","- C12.2 H11.5 N2.7 O5.4 -","- C8 H8 N2 O4 -","- C64 H64 N16 O32 -","8","1","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.6889","Synchrotron","","0.079","0.0749","","","0.1999","0.2027","","","","","","1.03","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124985","4.5668","0.0004","20.531","0.0016","20.9009","0.0016","76.149","0.002","88.228","0.003","88.156","0.003","1901.2","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H22 N4 O4 -","- C20 H22 N4 O4 -","- C80 H88 N16 O16 -","4","2","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.71073","MoKα","","0.11","0.0653","","","0.1367","0.1557","","","","","","0.996","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124986","4.5426","0.0019","10.729","0.005","18.692","0.008","90","","90","","90","","911","0.7","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H10 N2 O5 -","- C8 H10 N2 O5 -","- C32 H40 N8 O20 -","4","1","","Kennedy, Stuart R.; Miquelot, Adeline; Aguilar, Juan A.; Steed, Jonathan W.","Trimeric cyclamers: solution aggregation and high Z' crystals based on guest structure and basicity.","Chemical communications (Cambridge, England)","2016","52","79","11846","11849","10.1039/c6cc06054d","","","0.71073","MoKα","","0.0948","0.0555","","","0.1122","0.1259","","","","","","1.042","","","","has coordinates","234408","2020-10-21","18:00:00",""
"7124987","13.9426","0.0001","18.5793","0.0001","18.8456","0.0002","90","","146.18","","90","","2717.16","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 N4 O4 Pd2 -","- C28 H24 N4 O4 Pd2 -","- C112 H96 N16 O16 Pd8 -","4","1","","Monas, Andrea; Užarević, Krunoslav; Halasz, Ivan; Kulcsár, Marina Juribašić; Ćurić, Manda","Vapour-induced solid-state C-H bond activation for the clean synthesis of an organopalladium biothiol sensor.","Chemical communications (Cambridge, England)","2016","52","88","12960","12963","10.1039/c6cc06062e","","","1.54184","CuKα","","","0.0319","","","","0.0883","","","","","","1.04","","","","has coordinates","234410","2020-10-21","18:00:00",""
"7124988","15.7028","0.0003","12.1884","0.0003","27.7307","0.0009","90","","90","","90","","5307.4","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H24 N4 O4 Pd2 -","- C28 H24 N4 O4 Pd2 -","- C224 H192 N32 O32 Pd16 -","8","1","","Monas, Andrea; Užarević, Krunoslav; Halasz, Ivan; Kulcsár, Marina Juribašić; Ćurić, Manda","Vapour-induced solid-state C-H bond activation for the clean synthesis of an organopalladium biothiol sensor.","Chemical communications (Cambridge, England)","2016","52","88","12960","12963","10.1039/c6cc06062e","","","0.71073","MoKα","","","0.0375","","","","0.0887","","","","","","1.018","","","","has coordinates","234410","2020-10-21","18:00:00",""
"7124989","26.14","0.004","8.4019","0.0012","18.4972","0.0013","90","","117.658","0.007","90","","3598.3","0.8","120","2","120","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H36 B2 Br4 Fe N6 O6 -","- C30 H36 B2 Br4 Fe N6 O6 -","- C120 H144 B8 Br16 Fe4 N24 O24 -","4","0.5","","Cecot, Giacomo; Alameddine, Bassam; Prior, Stéphanie; Zorzi, Rita De; Geremia, Silvano; Scopelliti, Rosario; Fadaei, Farzaneh T.; Solari, Euro; Severin, Kay","Large heterometallic coordination cages with gyrobifastigium-like geometry.","Chemical communications (Cambridge, England)","2016","52","75","11243","11246","10.1039/c6cc06066h","","","0.71073","MoKα","","0.07","0.0442","","","0.0834","0.0931","","","","","","1.119","","","","has coordinates","234412","2020-10-21","18:00:00",""
"7124990","8.84673","0.00005","38.91135","0.00019","14.15673","0.00007","90","","105.312","0.0005","90","","4700.3","0.04","100.01","0.1","100.01","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H52 B2 Fe N10 O6 -","- C50 H52 B2 Fe N10 O6 -","- C200 H208 B8 Fe4 N40 O24 -","4","1","","Cecot, Giacomo; Alameddine, Bassam; Prior, Stéphanie; Zorzi, Rita De; Geremia, Silvano; Scopelliti, Rosario; Fadaei, Farzaneh T.; Solari, Euro; Severin, Kay","Large heterometallic coordination cages with gyrobifastigium-like geometry.","Chemical communications (Cambridge, England)","2016","52","75","11243","11246","10.1039/c6cc06066h","","x-ray","1.54184","CuKα","","0.031","0.0299","","","0.0785","0.0794","","","","","","1.049","","","","has coordinates","234412","2020-10-21","18:00:00",""
"7124991","28.3614","0.0016","28.8276","0.0011","41.0379","0.0016","101.861","0.004","92.914","0.004","104.12","0.004","31663","3","139.99","0.14","139.99","0.14","","","","","","","","10","P -1","-P 1","2","","gc2_222","","- C408 H368 B8 F48 Fe4 N40 O72 P16 Pt8 S16 -","- C408 H368 B8 F48 Fe4 N40 O72 P16 Pt8 S16 -","- C816 H736 B16 F96 Fe8 N80 O144 P32 Pt16 S32 -","2","1","","Cecot, Giacomo; Alameddine, Bassam; Prior, Stéphanie; Zorzi, Rita De; Geremia, Silvano; Scopelliti, Rosario; Fadaei, Farzaneh T.; Solari, Euro; Severin, Kay","Large heterometallic coordination cages with gyrobifastigium-like geometry.","Chemical communications (Cambridge, England)","2016","52","75","11243","11246","10.1039/c6cc06066h","","","1.54178","CuKα","","0.2662","0.1667","","","0.359","0.4339","","","","","","1.022","","","","has coordinates","288248","2023-12-12","12:55:28",""
"7124992","14.7088","0.0004","12.8848","0.0003","18.6454","0.0006","90","","102.859","0.003","90","","3445.05","0.17","140","2","140","","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","gc_ba1508","","- C24 H24 B2 Br4 Fe N6 O6 -","- C24 H24 B2 Br4 Fe N6 O6 -","- C96 H96 B8 Br16 Fe4 N24 O24 -","4","0.5","","Cecot, Giacomo; Alameddine, Bassam; Prior, Stéphanie; Zorzi, Rita De; Geremia, Silvano; Scopelliti, Rosario; Fadaei, Farzaneh T.; Solari, Euro; Severin, Kay","Large heterometallic coordination cages with gyrobifastigium-like geometry.","Chemical communications (Cambridge, England)","2016","52","75","11243","11246","10.1039/c6cc06066h","","","1.54178","CuKα","","0.0439","0.0429","","","0.1005","0.1011","","","","","","1.043","","","","has coordinates","234412","2020-10-21","18:00:00",""
"7124993","9.4866","0.0004","10.6979","0.0003","47.959","0.002","90","","94.425","0.005","90","","4852.7","0.3","140","0.1","140","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","gc2_203","","- C44 H40 B2 Fe N10 O6 -","- C44 H40 B2 Fe N10 O6 -","- C176 H160 B8 Fe4 N40 O24 -","4","1","","Cecot, Giacomo; Alameddine, Bassam; Prior, Stéphanie; Zorzi, Rita De; Geremia, Silvano; Scopelliti, Rosario; Fadaei, Farzaneh T.; Solari, Euro; Severin, Kay","Large heterometallic coordination cages with gyrobifastigium-like geometry.","Chemical communications (Cambridge, England)","2016","52","75","11243","11246","10.1039/c6cc06066h","","x-ray","1.54184","CuKα","","0.0869","0.0807","","","0.1791","0.1824","","","","","","1.082","","","","has coordinates,has disorder","234412","2020-10-21","18:00:00",""
"7124994","10.8278","0.0004","30.7175","0.0014","16.9665","0.0007","90","","102.171","0.002","90","","5516.3","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","70DPM6","","","- C95 H34 O2 -","- C95 H34 O2 -","- C380 H136 O8 -","4","1","","Vidal, Sara; Izquierdo, Marta; Law, Wai Kit; Jiang, Kui; Filippone, Salvatore; Perles, Josefina; Yan, He; Martín, Nazario","Photochemical site-selective synthesis of [70]methanofullerenes.","Chemical communications (Cambridge, England)","2016","52","86","12733","12736","10.1039/c6cc06072b","","","0.71073","MoKα","","0.3909","0.2609","","","0.6744","0.7616","","","","","","1.128","","","","has coordinates","234414","2020-10-21","18:00:00",""
"7124995","13.3928","0.0013","15.4263","0.0015","15.9182","0.0015","72.759","0.001","71.007","0.001","66.158","0.001","2792.2","0.5","140","","140","","","","","","","","","4","P -1","-P 1","2","","","","- C140 H136 K4 O11 -","- C140 H136 K4 O11 -","- C140 H136 K4 O11 -","1","0.5","","Sumy, Daniel P.; Finke, Aaron D.; Whalley, Adam C.","The reductive aromatization of tridecacyclene.","Chemical communications (Cambridge, England)","2016","52","83","12368","12371","10.1039/c6cc06078a","","x-ray","0.71073","MoKα","","0.0784","0.0524","","","0.1275","0.1424","","","","","","1.033","","","","has coordinates,has disorder","234415","2020-10-21","18:00:00",""
"7124996","16.6756","0.0014","37.752","0.003","12.3496","0.0011","90","","93.136","0.005","90","","7762.9","1.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C93 H128.56 O3 U -","- C93 H128.56 O3 U -","- C372 H514.24 O12 U4 -","4","1","","Hoerger, Christopher J.; La Pierre, Henry S.; Maron, Laurent; Scheurer, Andreas; Heinemann, Frank W.; Meyer, Karsten","Reductive disproportionation of nitric oxide mediated by low-valent uranium.","Chemical communications (Cambridge, England)","2016","52","72","10854","10857","10.1039/c6cc06095a","","","0.71073","MoKα","","0.0719","0.0433","","","0.0983","0.1085","","","","","","1.036","","","","has coordinates,has disorder","234417","2020-10-21","18:00:00",""
"7124997","21.4453","0.0013","13.7404","0.0011","25.313","0.002","90","","119.622","0.006","90","","6484.1","0.9","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C81 H105 O4 U -","- C81 H105 O4 U -","- C324 H420 O16 U4 -","4","1","","Hoerger, Christopher J.; La Pierre, Henry S.; Maron, Laurent; Scheurer, Andreas; Heinemann, Frank W.; Meyer, Karsten","Reductive disproportionation of nitric oxide mediated by low-valent uranium.","Chemical communications (Cambridge, England)","2016","52","72","10854","10857","10.1039/c6cc06095a","","","0.71073","MoKα","","0.0519","0.0288","","","0.0498","0.056","","","","","","1.119","","","","has coordinates","234417","2020-10-21","18:00:00",""
"7124998","10.1195","0.0006","29.385","0.002","7.4892","0.0004","90","","90","","90","","2227","0.2","100","","100","","","","","","","","","5","I b a 2","I 2 -2c","45","","gb_ER719","","- C9 H20 B N O2 -","- C9 H20 B N O2 -","- C72 H160 B8 N8 O16 -","8","1","","Romero, Erik A.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy","Catalyst-free dehydrocoupling of amines, alcohols, and thiols with pinacol borane and 9-borabicyclononane (9-BBN).","Chemical communications (Cambridge, England)","2016","52","69","10563","10565","10.1039/c6cc06096j","","x-ray","0.71073","MoKα","","0.0893","0.0495","","","0.0905","0.1063","","","","","","1.005","","","","has coordinates","234420","2020-10-21","18:00:00",""
"7124999","10.9091","0.0003","8.4128","0.0002","20.1396","0.0005","90","","94.569","0.001","90","","1842.46","0.08","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 Br P -","- C24 H18 Br P -","- C96 H72 Br4 P4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0671","0.0438","","","0.101","0.1135","","","","","","1.028","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125000","10.8919","0.0003","8.4344","0.0002","20.3175","0.0006","90","","94.242","0.001","90","","1861.39","0.09","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 As Br -","- C24 H18 As Br -","- C96 H72 As4 Br4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.042","0.0307","","","0.0759","0.0796","","","","","","1.057","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125001","10.9265","0.0003","8.5022","0.0002","20.5734","0.0006","90","","93.534","0.001","90","","1907.62","0.09","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 Br Sb -","- C24 H18 Br Sb -","- C96 H72 Br4 Sb4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0384","0.0254","","","0.0503","0.0539","","","","","","1.058","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125002","12.0462","0.0004","8.7352","0.0002","25.0693","0.0007","90","","98.504","0.001","90","","2608.94","0.13","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H29 As Te -","- C33 H29 As Te -","- C132 H116 As4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0302","0.0222","","","0.0452","0.0475","","","","","","1.039","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125003","8.7261","0.0002","11.7875","0.0003","14.189","0.0003","79.576","0.001","74.286","0.001","75.358","0.001","1349.35","0.05","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C33 H29 Sb Te -","- C33 H29 Sb Te -","- C66 H58 Sb2 Te2 -","2","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0594","0.0307","","","0.0503","0.057","","","","","","1.025","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125004","8.7067","0.0003","12.5095","0.0005","22.0558","0.0008","90","","94.318","0.001","90","","2395.42","0.15","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 Cl O P Te -","- C28 H26 Cl O P Te -","- C112 H104 Cl4 O4 P4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0628","0.0496","","","0.1059","0.1098","","","","","","1.217","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125005","8.5366","0.0017","11.678","0.002","12.597","0.003","89.5","0.03","87.76","0.03","85.74","0.03","1251.4","0.4","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H20 Cl3 P Te -","- C25 H20 Cl3 P Te -","- C50 H40 Cl6 P2 Te2 -","2","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0512","0.0452","","","0.1284","0.1333","","","","","","1.083","","","","has coordinates,has disorder","234423","2020-10-21","18:00:00",""
"7125006","11.7394","0.0003","12.5066","0.0003","14.3469","0.0003","91.146","0.001","101.003","0.001","117.065","0.001","1827.45","0.08","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C48 H36 P2 Te -","- C48 H36 P2 Te -","- C96 H72 P4 Te2 -","2","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.045","0.0309","","","0.0671","0.0718","","","","","","1.05","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125007","14.502","0.004","8.33","0.002","14.464","0.004","90","","91.826","0.005","90","","1746.4","0.8","93","","93","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 Cl P Te -","- C18 H22 Cl P Te -","- C72 H88 Cl4 P4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71075","MoKα","","","0.0871","","","","0.2343","","","","","","1.013","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125008","7.786","0.0008","13.9267","0.0014","16.4054","0.0018","90","","97.078","0.007","90","","1765.3","0.3","125","","125","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 Br P Te -","- C18 H22 Br P Te -","- C72 H88 Br4 P4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71075","MoKα","","","0.023","","","","0.0536","","","","","","1.037","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125009","7.9634","0.0012","14.047","0.002","16.871","0.003","90","","99.976","0.003","90","","1858.7","0.5","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 I P Te -","- C18 H22 I P Te -","- C72 H88 I4 P4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71075","MoKα","","","0.0341","","","","0.1156","","","","","","1.013","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125010","22.509","0.004","11.4213","0.0018","22.101","0.004","90","","110.786","0.002","90","","5312","1.6","93","","93","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H48 Cl4 I6 P2 Te3 -","- C38 H48 Cl4 I6 P2 Te3 -","- C152 H192 Cl16 I24 P8 Te12 -","4","0.5","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71075","MoKα","","","0.0381","","","","0.1345","","","","","","1.099","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125011","9.8954","0.0008","15.5322","0.0015","14.5588","0.0014","90","","93.366","0.002","90","","2233.8","0.4","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 I3 P Te -","- C18 H22 I3 P Te -","- C72 H88 I12 P4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71075","MoKα","","0.0174","0.0158","","","0.0407","0.0412","","","","","","1.033","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125012","8.5859","0.0003","13.5523","0.0004","20.3142","0.0006","90","","99.133","0.001","90","","2333.77","0.13","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 F3 O3 P S Te -","- C25 H18 F3 O3 P S Te -","- C100 H72 F12 O12 P4 S4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0505","0.03","","","0.0552","0.0604","","","","","","1.031","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125013","8.6484","0.0003","13.5162","0.0004","20.5103","0.0006","90","","99.069","0.001","90","","2367.55","0.13","100","","100","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 As F3 O3 S Te -","- C25 H18 As F3 O3 S Te -","- C100 H72 As4 F12 O12 S4 Te4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0335","0.0237","","","0.0463","0.0496","","","","","","1.087","","","","has coordinates","234423","2020-10-21","18:00:00",""
"7125014","22.9864","0.0009","12.573","0.0005","20.1946","0.0008","90","","115.397","0.001","90","","5272.4","0.4","100","","100","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H24 F3 O3 S Sb Te -","- C28 H24 F3 O3 S Sb Te -","- C224 H192 F24 O24 S8 Sb8 Te8 -","8","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0464","0.0313","","","0.0609","0.067","","","","","","1.07","","","","has coordinates,has disorder","234423","2020-10-21","18:00:00",""
"7125015","10.0891","0.0006","18.9802","0.0011","20.8742","0.0012","90","","93.041","0.002","90","","3991.6","0.4","100","","100","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H26 B F15 Na O7 P -","- C40 H26 B F15 Na O7 P -","- C160 H104 B4 F60 Na4 O28 P4 -","4","1","","Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens","Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.","Chemical communications (Cambridge, England)","2016","52","73","10992","10995","10.1039/c6cc06102h","","","0.71073","MoKα","","0.0638","0.0437","","","0.1022","0.1145","","","","","","1.058","","","","has coordinates,has disorder","234423","2020-10-21","18:00:00",""
"7125016","45.325","0.002","28.1243","0.0014","88.076","0.004","90","","91.544","0.002","90","","112233","9","173","2","173.02","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C440 H572 Au92 S44 -","- C430 H515 Au92 S44 -","- C3440 H4120 Au736 S352 -","8","1","","Liao, Lingwen; Chen, Jishi; Wang, Chengming; Zhuang, Shengli; Yan, Nan; Yao, Chuanhao; Xia, Nan; Li, Lingling; Bao, Xiaoli; Wu, Zhikun","Transition-sized Au<sub>92</sub> nanoparticle bridging non-fcc-structured gold nanoclusters and fcc-structured gold nanocrystals.","Chemical communications (Cambridge, England)","2016","52","81","12036","12039","10.1039/c6cc06108g","","","1.54178","CuKα","","0.2566","0.1859","","","0.4516","0.4904","","","","","","1.492","","","","has coordinates","234426","2020-10-21","18:00:00",""
"7125017","6.2192","0.0002","9.1506","0.0002","13.4968","0.0003","98.63","0.002","96.96","0.003","92.679","0.003","752.15","0.03","123.01","0.1","123.01","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C15 H20 N2 O2 S -","- C15 H20 N2 O2 S -","- C30 H40 N4 O4 S2 -","2","1","","Meyer, Andreas Uwe; Berger, Anna Lucia; König, Burkhard","Metal-free C-H sulfonamidation of pyrroles by visible light photoredox catalysis.","Chemical communications (Cambridge, England)","2016","52","72","10918","10921","10.1039/c6cc06111g","","x-ray","1.54184","CuKα","","0.0307","0.0299","","","0.0757","0.0764","","","","","","1.052","","","","has coordinates","234429","2020-10-21","18:00:00",""
"7125018","10.79743","0.00016","13.38129","0.0002","11.85342","0.00017","90","","96.5156","0.0012","90","","1701.56","0.04","123.02","0.1","123.02","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 N2 O2 S -","- C18 H24 N2 O2 S -","- C72 H96 N8 O8 S4 -","4","1","","Meyer, Andreas Uwe; Berger, Anna Lucia; König, Burkhard","Metal-free C-H sulfonamidation of pyrroles by visible light photoredox catalysis.","Chemical communications (Cambridge, England)","2016","52","72","10918","10921","10.1039/c6cc06111g","","x-ray","1.54184","CuKα","","0.0352","0.0329","","","0.0869","0.0894","","","","","","1.034","","","","has coordinates","234429","2020-10-21","18:00:00",""
"7125019","15.7933","0.0003","8.92836","0.00018","12.9799","0.0003","90","","110.209","0.003","90","","1717.6","0.07","123","0.1","123","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 N2 O2 S -","- C19 H20 N2 O2 S -","- C76 H80 N8 O8 S4 -","4","1","","Meyer, Andreas Uwe; Berger, Anna Lucia; König, Burkhard","Metal-free C-H sulfonamidation of pyrroles by visible light photoredox catalysis.","Chemical communications (Cambridge, England)","2016","52","72","10918","10921","10.1039/c6cc06111g","","x-ray","1.54184","CuKα","","0.0366","0.0341","","","0.0911","0.0932","","","","","","1.057","","","","has coordinates","234429","2020-10-21","18:00:00",""
"7125020","18.0343","0.0003","7.581","0.0001","23.5816","0.0003","90","","109.174","0.002","90","","3045.18","0.08","123.01","0.1","123.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 N4 O4 S2 -","- C30 H40 N4 O4 S2 -","- C120 H160 N16 O16 S8 -","4","1","","Meyer, Andreas Uwe; Berger, Anna Lucia; König, Burkhard","Metal-free C-H sulfonamidation of pyrroles by visible light photoredox catalysis.","Chemical communications (Cambridge, England)","2016","52","72","10918","10921","10.1039/c6cc06111g","","x-ray","1.54184","CuKα","","0.0412","0.0379","","","0.1059","0.1086","","","","","","1.072","","","","has coordinates","234429","2020-10-21","18:00:00",""
"7125021","14.6626","0.0005","5.3944","0.00016","18.2386","0.0006","90","","113.435","0.004","90","","1323.6","0.08","123.01","0.1","123.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N2 O2 S2 -","- C12 H16 N2 O2 S2 -","- C48 H64 N8 O8 S8 -","4","1","","Meyer, Andreas Uwe; Berger, Anna Lucia; König, Burkhard","Metal-free C-H sulfonamidation of pyrroles by visible light photoredox catalysis.","Chemical communications (Cambridge, England)","2016","52","72","10918","10921","10.1039/c6cc06111g","","x-ray","1.54184","CuKα","","0.0348","0.032","","","0.0836","0.086","","","","","","1.052","","","","has coordinates,has disorder","234429","2020-10-21","18:00:00",""
"7125022","7.08473","0.00014","16.7619","0.0004","22.085","0.0006","90","","90","","90","","2622.67","0.11","292.4","0.3","292.4","0.3","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 Br N2 O4 -","- C29 H21 Br N2 O4 -","- C116 H84 Br4 N8 O16 -","4","1","","Wang, Kai-Kai; Wang, Pan; Ouyang, Qin; Du, Wei; Chen, Ying-Chun","Substrate-controlled switchable asymmetric annulations to access polyheterocyclic skeletons.","Chemical communications (Cambridge, England)","2016","52","74","11104","11107","10.1039/c6cc06148f","","x-ray","1.54184","CuKα","","0.0825","0.0783","","","0.2136","0.2211","","","","","","1.038","","","","has coordinates","234432","2020-10-21","18:00:00",""
"7125023","10.06732","0.00018","10.59058","0.00014","22.9703","0.0004","90","","90","","90","","2449.06","0.07","292.6","0.5","292.6","0.5","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H17 N3 O2 -","- C23 H17 N3 O2 -","- C92 H68 N12 O8 -","4","1","","Wang, Kai-Kai; Wang, Pan; Ouyang, Qin; Du, Wei; Chen, Ying-Chun","Substrate-controlled switchable asymmetric annulations to access polyheterocyclic skeletons.","Chemical communications (Cambridge, England)","2016","52","74","11104","11107","10.1039/c6cc06148f","","x-ray","1.54184","CuKα","","0.0463","0.0439","","","0.1225","0.1268","","","","","","1.032","","","","has coordinates","234432","2020-10-21","18:00:00",""
"7125024","9.6481","0.0006","11.3861","0.0007","13.3598","0.0008","67.617","0.005","78.339","0.005","87.41","0.005","1328.23","0.15","123","2","123","2","","","","","","","","8","P -1","-P 1","2","[CrIII2TbIII2(OMe)2-x(OH)x(2-Cl-4,5-F-benz)4(mdea)2(NO3)2]?xMeOH","","","- C40 H38.4 Cl4 Cr2 F8 N4 O21.2 Tb2 -","- C40 H37.198 Cl4 Cr2 F8 N4 O21.198 Tb2 -","- C40 H37.198 Cl4 Cr2 F8 N4 O21.198 Tb2 -","1","0.5","","Langley, Stuart K.; Wielechowski, Daniel P.; Moubaraki, Boujemaa; Murray, Keith S.","Enhancing the magnetic blocking temperature and magnetic coercivity of {CrLn} single-molecule magnets via bridging ligand modification.","Chemical communications (Cambridge, England)","2016","52","73","10976","10979","10.1039/c6cc06152d","","","0.71073","MoKα","","0.0379","0.0284","","","0.0583","0.0645","","","","","","1.091","","","","has coordinates,has disorder","234435","2020-10-21","18:00:00",""
"7125025","9.543","0.0019","11.414","0.002","13.306","0.003","67.56","0.03","77.95","0.03","87.25","0.03","1309.3","0.6","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C40 H37.2 Cl4 Cr2 Dy2 F8 N4 O20.6 -","- C40 H36.6 Cl4 Cr2 Dy2 F8 N4 O20.598 -","- C40 H36.6 Cl4 Cr2 Dy2 F8 N4 O20.598 -","1","0.5","","Langley, Stuart K.; Wielechowski, Daniel P.; Moubaraki, Boujemaa; Murray, Keith S.","Enhancing the magnetic blocking temperature and magnetic coercivity of {CrLn} single-molecule magnets via bridging ligand modification.","Chemical communications (Cambridge, England)","2016","52","73","10976","10979","10.1039/c6cc06152d","","","0.71079","synchrotron","","0.0321","0.031","","","0.0818","0.0826","","","","","","1.068","","","","has coordinates,has disorder","234435","2020-10-21","18:00:00",""
"7125026","9.667","0.0019","11.331","0.002","13.316","0.003","67.54","0.03","78.27","0.03","87.69","0.03","1318.7","0.6","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C40 H37.67 Cl4 Cr2 F8 Ho2 N4 O20.83 -","- C40 H36.828 Cl4 Cr2 F8 Ho2 N4 O20.828 -","- C40 H36.828 Cl4 Cr2 F8 Ho2 N4 O20.828 -","1","0.5","","Langley, Stuart K.; Wielechowski, Daniel P.; Moubaraki, Boujemaa; Murray, Keith S.","Enhancing the magnetic blocking temperature and magnetic coercivity of {CrLn} single-molecule magnets via bridging ligand modification.","Chemical communications (Cambridge, England)","2016","52","73","10976","10979","10.1039/c6cc06152d","","","0.71079","synchrotron","","0.0327","0.0315","","","0.0804","0.0819","","","","","","1.059","","","","has coordinates,has disorder","234435","2020-10-21","18:00:00",""
"7125027","11.164","0.002","11.907","0.002","16.534","0.003","70.77","0.03","73.76","0.03","82.43","0.03","1990.5","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H114 Cr2 Dy2 N4 O23 -","- C70 H113 Cr2 Dy2 N4 O23 -","- C70 H113 Cr2 Dy2 N4 O23 -","1","0.5","","Langley, Stuart K.; Wielechowski, Daniel P.; Moubaraki, Boujemaa; Murray, Keith S.","Enhancing the magnetic blocking temperature and magnetic coercivity of {CrLn} single-molecule magnets via bridging ligand modification.","Chemical communications (Cambridge, England)","2016","52","73","10976","10979","10.1039/c6cc06152d","","","0.71079","synchrotron","","0.0443","0.0432","","","0.1168","0.1177","","","","","","1.059","","","","has coordinates,has disorder","234435","2020-10-21","18:00:00",""
"7125028","11.7899","0.0006","13.5842","0.0004","13.728","0.0007","90","","104.058","0.005","90","","2132.78","0.17","294.96","0.1","294.96","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 B10 O8 -","- C12 H24 B10 O8 -","- C48 H96 B40 O32 -","4","1","","Cao, Ke; Xu, Tao-Tao; Wu, Ji; Jiang, Linhai; Yang, Junxiao","Palladium catalyzed/silver tuned selective mono-/tetra-acetoxylation of o-carboranes via B-H activation.","Chemical communications (Cambridge, England)","2016","52","76","11446","11449","10.1039/c6cc06200h","","x-ray","0.71073","MoKα","","0.1371","0.0772","","","0.1995","0.2483","","","","","","1.047","","","","has coordinates,has disorder","234438","2020-10-21","18:00:00",""
"7125029","12.7205","0.0009","13.3454","0.0008","16.395","0.0011","98.928","0.005","92.479","0.005","90.262","0.005","2746.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H32 B10 O8 -","- C20 H32 B10 O8 -","- C80 H128 B40 O32 -","4","2","","Cao, Ke; Xu, Tao-Tao; Wu, Ji; Jiang, Linhai; Yang, Junxiao","Palladium catalyzed/silver tuned selective mono-/tetra-acetoxylation of o-carboranes via B-H activation.","Chemical communications (Cambridge, England)","2016","52","76","11446","11449","10.1039/c6cc06200h","","x-ray","0.71","MoKα","","0.2397","0.1084","","","0.2601","0.3649","","","","","","1.031","","","","has coordinates,has disorder","234438","2020-10-21","18:00:00",""
"7125030","7.3484","0.0012","7.6219","0.001","12.005","0.003","83.262","0.014","88.589","0.016","88.161","0.012","667.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H18 B10 O2 -","- C6 H18 B10 O2 -","- C12 H36 B20 O4 -","2","1","","Cao, Ke; Xu, Tao-Tao; Wu, Ji; Jiang, Linhai; Yang, Junxiao","Palladium catalyzed/silver tuned selective mono-/tetra-acetoxylation of o-carboranes via B-H activation.","Chemical communications (Cambridge, England)","2016","52","76","11446","11449","10.1039/c6cc06200h","","","0.71073","MoKα","","0.142","0.078","","","0.1828","0.2415","","","","","","1.057","","","","has coordinates","234438","2020-10-21","18:00:00",""
"7125031","7.7915","0.0004","21.7","0.0013","8.0127","0.0004","90","","94.885","0.006","90","","1349.83","0.13","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H18 B10 O2 -","- C6 H18 B10 O2 -","- C24 H72 B40 O8 -","4","1","","Cao, Ke; Xu, Tao-Tao; Wu, Ji; Jiang, Linhai; Yang, Junxiao","Palladium catalyzed/silver tuned selective mono-/tetra-acetoxylation of o-carboranes via B-H activation.","Chemical communications (Cambridge, England)","2016","52","76","11446","11449","10.1039/c6cc06200h","","","0.71073","MoKα","","0.1019","0.0695","","","0.1743","0.2008","","","","","","1.041","","","","has coordinates,has disorder","234438","2020-10-21","18:00:00",""
"7125032","30.6243","0.0005","19.9078","0.0003","11.5863","0.00018","90","","102.813","0.0016","90","","6887.83","0.19","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C25 H28 F6 N4 O2 P Ru -","- C25 H28 F6 N4 O2 P Ru -","- C200 H224 F48 N32 O16 P8 Ru8 -","8","1","","Xie, Jianhui; Lo, Po-Kam; Lam, William W. Y.; Man, Wai-Lun; Ma, Li; Yiu, Shek-Man; Lau, Kai-Chung; Lau, Tai-Chu","Oxidation of hydroquinones by a (salen)ruthenium(vi) nitrido complex.","Chemical communications (Cambridge, England)","2016","52","76","11430","11433","10.1039/c6cc06231h","","","1.54178","CuKα","","0.0452","0.0407","","","0.1083","0.112","","","","","","1.046","","","","has coordinates","234440","2020-10-21","18:00:00",""
"7125033","8.048","0.003","9.69","0.003","25.348","0.008","90","","90","","90","","1976.8","1.1","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(S)-4-benzyl-3-(4-bromophenyl)-4-chloro-4,5-dihydro-1H-pyrazol-5-one","","- C22 H16 Br Cl N2 O -","- C22 H16 Br Cl N2 O -","- C88 H64 Br4 Cl4 N8 O4 -","4","1","","Bao, Xiaoze; Wei, Shiqiang; Zou, Liwei; He, Yuli; Xue, Fuzhao; Qu, Jingping; Wang, Baomin","Asymmetric chlorination of 4-substituted pyrazolones catalyzed by natural cinchona alkaloid.","Chemical communications (Cambridge, England)","2016","52","76","11426","11429","10.1039/c6cc06236a","","","0.71073","MoKα","","0.0427","0.034","","","0.0822","0.0859","","","","","","1","","","","has coordinates","234442","2020-10-21","18:00:00",""
"7125034","16.155","0.003","6.7318","0.0013","19.587","0.004","90","","109.09","0.03","90","","2013","0.8","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C5.5 H12 F6 N2 O0.5 P -","- C5.5 H12 F6 N2 O0.5 P -","- C44 H96 F48 N16 O4 P8 -","8","1","","Regnier, Vianney; Molton, Florian; Philouze, Christian; Martin, David","An air-persistent oxyallyl radical cation with simple di(methyl)amino substituents.","Chemical communications (Cambridge, England)","2016","52","76","11422","11425","10.1039/c6cc06260a","","x-ray","0.71073","MoKα","","0.061","0.0556","","","0.1491","0.1557","","","","","","1.036","","","","has coordinates,has disorder","234444","2020-10-21","18:00:00",""
"7125035","15.3015","0.0018","12.1976","0.001","9.6252","0.0008","90","","90","","90","","1796.5","0.3","293","2","293.15","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C24 H17 N O -","- C24 H17 N O -","- C96 H68 N4 O4 -","4","1","","Liu, Ren-Rong; Xu, Teng-Fei; Wang, Yong-Gang; Xiang, Bin; Gao, Jian-Rong; Jia, Yi-Xia","Palladium-catalyzed dearomative arylalkynylation of indoles.","Chemical communications (Cambridge, England)","2016","52","94","13664","13667","10.1039/c6cc06262h","","","0.71073","MoKα","","0.0568","0.0376","","","0.0747","0.0824","","","","","","1.048","","","","has coordinates","234446","2020-10-21","18:00:00",""
"7125036","10.63","0.004","12.402","0.005","14.118","0.005","77.336","0.014","74.113","0.01","79.124","0.01","1730.1","1.1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H30 Cl3 F6 N6 O P Ru -","- C31 H30 Cl3 F6 N6 O P Ru -","- C62 H60 Cl6 F12 N12 O2 P2 Ru2 -","2","1","","Ng, Chee Koon; Wu, Jie; Hor, T. S. Andy; Luo, He-Kuan","A binary catalyst system of a cationic Ru-CNC pincer complex with an alkali metal salt for selective hydroboration of carbon dioxide.","Chemical communications (Cambridge, England)","2016","52","79","11842","11845","10.1039/c6cc06278d","","","0.71073","MoKα","","0.0539","0.0413","","","0.0949","0.0994","","","","","","1.036","","","","has coordinates","234450","2020-10-21","18:00:00",""
"7125037","16.6675","0.0005","11.1422","0.0003","38.2172","0.0012","90","","90","","90","","7097.4","0.4","100","2","100","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C31 H30 Cl4 F6 N5 O2 P Ru -","- C31 H30 Cl4 F6 N5 O2 P Ru -","- C248 H240 Cl32 F48 N40 O16 P8 Ru8 -","8","1","","Ng, Chee Koon; Wu, Jie; Hor, T. S. Andy; Luo, He-Kuan","A binary catalyst system of a cationic Ru-CNC pincer complex with an alkali metal salt for selective hydroboration of carbon dioxide.","Chemical communications (Cambridge, England)","2016","52","79","11842","11845","10.1039/c6cc06278d","","","0.71073","MoKα","","0.0973","0.063","","","0.1284","0.1407","","","","","","1.096","","","","has coordinates,has disorder","234450","2020-10-21","18:00:00",""
"7125038","13.4851","0.0005","8.5343","0.0004","25.6709","0.0012","90","","103.401","0.003","90","","2873.9","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H32 Br N3 O6 S -","- C27 H32 Br N3 O6 S -","- C108 H128 Br4 N12 O24 S4 -","4","1","","Fuentes de Arriba, Ángel L; Simón, Luis; Rubio, Omayra H.; Monleón, Laura M; Alcázar, Victoria; Sanz, Francisca; Raposo, César A; Morán, Joaquín R","A bio-inspired enantioselective small-molecule artificial receptor for β adrenergic agonists and antagonists and its application for enantioselective extraction.","Chemical communications (Cambridge, England)","2016","52","85","12582","12585","10.1039/c6cc06281d","","","1.54178","CuKα","","0.0718","0.0572","","","0.1517","0.1635","","","","","","1.034","","","","has coordinates","234452","2020-10-21","18:00:00",""
"7125039","8.3467","0.0002","25.1787","0.001","22.297","0.0008","90","","92.223","0.003","90","","4682.4","0.3","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C92 H108 Br2 N10 O15 S2 -","- C92 H108 Br2 N10 O15 S2 -","- C184 H216 Br4 N20 O30 S4 -","2","1","","Fuentes de Arriba, Ángel L; Simón, Luis; Rubio, Omayra H.; Monleón, Laura M; Alcázar, Victoria; Sanz, Francisca; Raposo, César A; Morán, Joaquín R","A bio-inspired enantioselective small-molecule artificial receptor for β adrenergic agonists and antagonists and its application for enantioselective extraction.","Chemical communications (Cambridge, England)","2016","52","85","12582","12585","10.1039/c6cc06281d","","","1.54178","CuKα","","0.1013","0.0696","","","0.1723","0.1966","","","","","","1.029","","","","has coordinates","234452","2020-10-21","18:00:00",""
"7125040","21.28954","0.00073","14.55846","0.00052","8.10658","0.00033","90","","84.173","0.003","90","","2499.59","0.16","","","298","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","CAU-22","CAU-22","- C44.16 N8 O76 Zr12 -","- C44.156 N8 O75.996 Zr12 -","- C44.156 N8 O75.996 Zr12 -","1","0.125","","Waitschat, S.; Reinsch, H.; Stock, N.","Water-based synthesis and characterisation of a new Zr-MOF with a unique inorganic building unit.","Chemical communications (Cambridge, England)","2016","52","86","12698","12701","10.1039/c6cc06287c","","","1.5406","","","","","","","","","","","","","","","","","","has coordinates","234454","2020-10-21","18:00:00",""
"7125041","7.336","0.0007","11.8041","0.0009","13.6969","0.0011","104.265","0.002","98.881","0.001","96.225","0.001","1122.36","0.16","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H21 Br O3 -","- C28 H21 Br O3 -","- C56 H42 Br2 O6 -","2","1","","Wu, Ya-Nan; Xu, Ting; Fu, Rong; Wang, Nan-Nan; Hao, Wen-Juan; Wang, Shu-Liang; Li, Guigen; Tu, Shu-Jiang; Jiang, Bo","Dual rhodium/copper catalysis: synthesis of benzo[b]fluorenes and 2-naphthalenylmethanones via de-diazotized cycloadditions.","Chemical communications (Cambridge, England)","2016","52","80","11943","11946","10.1039/c6cc06320a","","","0.71073","MoKα","","0.0982","0.0445","","","0.0834","0.0898","","","","","","1.054","","","","has coordinates","234456","2020-10-21","18:00:00",""
"7125042","12.567","0.0005","13.2195","0.0005","14.1831","0.001","114.172","0.008","93.299","0.007","97.933","0.007","2112","0.2","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H42 B F2 Fe2 N3 O4 -","- C52 H42 B F2 Fe2 N3 O4 -","- C104 H84 B2 F4 Fe4 N6 O8 -","2","1","","Didukh, Natalia O.; Zatsikha, Yuriy V.; Rohde, Gregory T.; Blesener, Tanner S.; Yakubovskyi, Viktor P.; Kovtun, Yuriy P.; Nemykin, Victor N.","NIR absorbing diferrocene-containing meso-cyano-BODIPY with a UV-Vis-NIR spectrum remarkably close to that of magnesium tetracyanotetraferrocenyltetraazaporphyrin.","Chemical communications (Cambridge, England)","2016","52","77","11563","11566","10.1039/c6cc06344f","","","0.71075","MoKα","","0.0857","0.0491","","","0.1137","0.1608","","","","","","1.163","","","","has coordinates","234457","2020-10-21","18:00:00",""
"7125043","12.0262","0.0012","13.8263","0.0014","17.009","0.0017","90","","90","","90","","2828.2","0.5","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 Br Cl3 F3 N2 O3 -","- C29 H21 Br Cl3 F3 N2 O3 -","- C116 H84 Br4 Cl12 F12 N8 O12 -","4","1","","Wang, Zhen-Hua; Wu, Zhi-Jun; Yue, Deng-Feng; Hu, Wen-Fei; Zhang, Xiao-Mei; Xu, Xiao-Ying; Yuan, Wei-Cheng","Organocatalytic asymmetric [3+2] cycloaddition of N-2,2,2-trifluoroethylisatin ketimines with 3-alkenyl-5-arylfuran-2(3H)-ones.","Chemical communications (Cambridge, England)","2016","52","78","11708","11711","10.1039/c6cc06367e","","","0.71073","MoKα","","0.0478","0.0359","","","0.0866","0.0902","","","","","","1.065","","","","has coordinates,has disorder","234459","2020-10-21","18:00:00",""
"7125044","9.6023","0.0005","12.8674","0.0007","15.9332","0.0009","96.095","0.003","105.256","0.003","104.605","0.003","1806.25","0.18","100","2","99.97","","","","","","","","","8","P -1","-P 1","2","","","","- C31 H30 Bi F6 Mn N3 O12 S2 -","- C31 H30 Bi F6 Mn N3 O12 S2 -","- C62 H60 Bi2 F12 Mn2 N6 O24 S4 -","2","1","","Pearson, Tyler J.; Fataftah, Majed S.; Freedman, Danna E.","Enhancement of magnetic anisotropy in a Mn-Bi heterobimetallic complex.","Chemical communications (Cambridge, England)","2016","52","76","11394","11397","10.1039/c6cc06369a","","","0.71073","MoKα","","0.0433","0.0335","","","0.0733","0.0759","","","","","","1.034","","","","has coordinates,has disorder","234461","2020-10-21","18:00:00",""
"7125045","22.7174","0.0012","6.5055","0.0003","25.667","0.0015","90","","94.802","0.005","90","","3780","0.3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C23 H31 Br -","- C23 H31 Br -","- C184 H248 Br8 -","8","1","","Christopher Braddock, D.; Mahtey, Areeb; Rzepa, Henry S.; White, Andrew J. P.","Stable bromoallene oxides.","Chemical communications (Cambridge, England)","2016","52","75","11219","11222","10.1039/c6cc06395k","","","0.71073","MoKα","","0.0707","0.0484","","","0.0976","0.1055","","","","","","1.098","","","","has coordinates,has disorder","234463","2020-10-21","18:00:00",""
"7125046","10.8427","0.0007","6.8117","0.0004","21.255","0.0017","90","","94.932","0.006","90","","1564.02","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H25 Br O -","- C17 H25 Br O -","- C68 H100 Br4 O4 -","4","1","","Christopher Braddock, D.; Mahtey, Areeb; Rzepa, Henry S.; White, Andrew J. P.","Stable bromoallene oxides.","Chemical communications (Cambridge, England)","2016","52","75","11219","11222","10.1039/c6cc06395k","","","0.71073","MoKα","","0.1118","0.0663","","","0.148","0.1709","","","","","","1.065","","","","has coordinates","234463","2020-10-21","18:00:00",""
"7125047","12.59","0.002","8.3056","0.0013","17.163","0.003","90","","97.211","0.004","90","","1780.5","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1","","- C19 H24 N2 O5 -","- C19 H24 N2 O5 -","- C76 H96 N8 O20 -","4","1","","Cheng, Jian; Xu, Pan; Li, Weipeng; Cheng, Yixiang; Zhu, Chengjian","The functionalization of a cascade of C(sp(2))-H/C(sp(3))-H bonds: synthesis of fused dihydropyrazoles via visible-light photoredox catalysis.","Chemical communications (Cambridge, England)","2016","52","80","11901","11904","10.1039/c6cc06410h","","","","","","0.177","","","","","","","","","","","","","","","has coordinates","234465","2020-10-21","18:00:00",""
"7125048","6.4277","0.0003","10.233","0.0004","18.9139","0.0007","90","","94.954","0.004","90","","1239.41","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H64 B4 N4 O8 -","- C48 H64 B4 N4 O8 -","- C48 H64 B4 N4 O8 -","1","0.25","","Barbero, Héctor; Ferrero, Sergio; Álvarez-Miguel, Lucía; Gómez-Iglesias, Patricia; Miguel, Daniel; Álvarez, Celedonio M","Affinity modulation of photoresponsive hosts for fullerenes: light-gated corannulene tweezers.","Chemical communications (Cambridge, England)","2016","52","88","12964","12967","10.1039/c6cc06445k","","x-ray","1.54184","CuKα","","0.0894","0.0647","","","0.1682","0.1883","","","","","","1.032","","","","has coordinates","234468","2020-10-21","18:00:00",""
"7125049","3.9995","0.0003","9.9251","0.0009","17.4542","0.0014","106.27","0.007","91.672","0.006","92.388","0.007","663.92","0.1","296","","296","","","","","","","","","3","P -1","-P 1","2","","","","- C40 H26 N2 -","- C40 H26 N2 -","- C40 H26 N2 -","1","0.5","","Barbero, Héctor; Ferrero, Sergio; Álvarez-Miguel, Lucía; Gómez-Iglesias, Patricia; Miguel, Daniel; Álvarez, Celedonio M","Affinity modulation of photoresponsive hosts for fullerenes: light-gated corannulene tweezers.","Chemical communications (Cambridge, England)","2016","52","88","12964","12967","10.1039/c6cc06445k","","x-ray","0.71073","MoKα","","0.1363","0.0569","","","0.0989","0.1387","","","","","","0.977","","","","has coordinates","234468","2020-10-21","18:00:00",""
"7125050","11.0512","0.0007","14.4682","0.0012","8.5519","0.0009","90","","91.007","0.007","90","","1367.2","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H26 N2 -","- C40 H26 N2 -","- C80 H52 N4 -","2","0.5","","Barbero, Héctor; Ferrero, Sergio; Álvarez-Miguel, Lucía; Gómez-Iglesias, Patricia; Miguel, Daniel; Álvarez, Celedonio M","Affinity modulation of photoresponsive hosts for fullerenes: light-gated corannulene tweezers.","Chemical communications (Cambridge, England)","2016","52","88","12964","12967","10.1039/c6cc06445k","","x-ray","0.71073","MoKα","","0.2398","0.0681","","","0.1234","0.1838","","","","","","0.982","","","","has coordinates","234468","2020-10-21","18:00:00",""
"7125051","9.1494","0.0011","8.9306","0.0013","20.285","0.003","90","","92.501","0.011","90","","1655.9","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C52 H26 N2 -","- C52 H26 N2 -","- C104 H52 N4 -","2","0.5","","Barbero, Héctor; Ferrero, Sergio; Álvarez-Miguel, Lucía; Gómez-Iglesias, Patricia; Miguel, Daniel; Álvarez, Celedonio M","Affinity modulation of photoresponsive hosts for fullerenes: light-gated corannulene tweezers.","Chemical communications (Cambridge, England)","2016","52","88","12964","12967","10.1039/c6cc06445k","","x-ray","0.71073","MoKα","","0.3113","0.0828","","","0.1367","0.2137","","","","","","0.789","","","","has coordinates","234468","2020-10-21","18:00:00",""
"7125052","8.7409","0.0004","12.0555","0.0004","16.4217","0.0006","90","","90","","90","","1730.45","0.12","292.56","0.1","292.56","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,3-diene","","- C18 H19 Br O3 -","- C18 H19 Br O3 -","- C72 H76 Br4 O12 -","4","1","","Liu, Yangbin; Hu, Haipeng; Lin, Lili; Hao, Xiaoyu; Liu, Xiaohua; Feng, Xiaoming","Enantioselective construction of branched 1,3-dienyl substituted quaternary carbon stereocenters by asymmetric allenyl Claisen rearrangement.","Chemical communications (Cambridge, England)","2016","52","80","11963","11966","10.1039/c6cc06481g","","x-ray","1.54184","CuKα","","0.0568","0.0549","","","0.1414","0.1445","","","","","","1.079","","","","has coordinates","234470","2020-10-21","18:00:00",""
"7125053","7.5432","0.0002","12.7924","0.0003","17.2791","0.0005","90","","90","","90","","1667.36","0.08","293.1","0.2","293.1","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","lactone","","- C16 H13 Br I O3 -","- C16 H13 Br I O3 -","- C64 H52 Br4 I4 O12 -","4","1","","Liu, Yangbin; Hu, Haipeng; Lin, Lili; Hao, Xiaoyu; Liu, Xiaohua; Feng, Xiaoming","Enantioselective construction of branched 1,3-dienyl substituted quaternary carbon stereocenters by asymmetric allenyl Claisen rearrangement.","Chemical communications (Cambridge, England)","2016","52","80","11963","11966","10.1039/c6cc06481g","","x-ray","1.54184","CuKα","","0.0658","0.0651","","","0.1829","0.1841","","","","","","1.07","","","","has coordinates","234470","2020-10-21","18:00:00",""
"7125054","43.611","0.009","8.549","0.0017","34.589","0.003","90","","103.59","0.03","90","","12535","4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H29.41 Ba3.99 Br0 N2 O20 P6 -","- C46 H29.414 Ba3.987 N2 O20 P6 -","- C368 H235.312 Ba31.896 N16 O160 P48 -","8","1","","Fard, Z. H.; Kalinovskyy, Y.; Spasyuk, D. M.; Blight, B. A.; Shimizu, G. K. H.","Alkaline-earth phosphonate MOFs with reversible hydration-dependent fluorescence.","Chemical communications (Cambridge, England)","2016","52","87","12865","12868","10.1039/c6cc06490f","","","0.68879","synchrotron","","0.0976","0.0873","","","0.2307","0.237","","","","","","1.053","","","","has coordinates,has disorder","234471","2020-10-21","18:00:00",""
"7125055","27.2441","0.0017","12.2005","0.0008","23.5008","0.0016","90","","103.574","0.002","90","","7593.3","0.9","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C52 H41 N3 -","- C52 H41 N3 -","- C416 H328 N24 -","8","1","","Norouzi-Arasi, Hassan; Pal, Amlan K.; Nag, Samik; Chartrand, Daniel; Hanan, Garry S.","Synthesis and photophysical properties of C<sub>3</sub>-symmetric tris(pyridyl)truxene scaffolds of Ru(ii) and Re(i).","Chemical communications (Cambridge, England)","2016","52","82","12159","12162","10.1039/c6cc06496e","","","1.54178","CuKα","","0.1272","0.0835","","","0.2104","0.2356","","","","","","0.968","","","","has coordinates","234473","2020-10-21","18:00:00",""
"7125056","13.4468","0.0003","13.4468","0.0003","53.0891","0.0012","90","","90","","120","","8313.3","0.3","150","2","150","2","","","","","","","synthesized chemically by authors","8","R -3 :H","-R 3","148","","[syn,syn,syn-5,10,15-tris(3-pyridyl)-10,15-dihydro-5H-diindeno[1,2-a;1',2'-c]fluorene]rhenium(I)tricarbonyl hexafluorophosphate","","- C68 H53 Cl60 F6 N3 O3 P Re -","- C48 H33 F6 N3 O3 P Re -","- C288 H198 F36 N18 O18 P6 Re6 -","6","0.333333","","Norouzi-Arasi, Hassan; Pal, Amlan K.; Nag, Samik; Chartrand, Daniel; Hanan, Garry S.","Synthesis and photophysical properties of C<sub>3</sub>-symmetric tris(pyridyl)truxene scaffolds of Ru(ii) and Re(i).","Chemical communications (Cambridge, England)","2016","52","82","12159","12162","10.1039/c6cc06496e","","","1.54178","CuKα","","0.0585","0.0531","","","0.1444","0.1479","","","","","","1.087","","","","has coordinates","234473","2020-10-21","18:00:00",""
"7125057","25.125","0.007","25.841","0.009","36.446","0.009","71.625","0.003","74.386","0.003","67.204","0.003","20408","10","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","M20L8 octahedral capsule","","- C176 H532 N135 O209 Pd20 -","- C176 H248 N135 O209 Pd20 -","- C352 H496 N270 O418 Pd40 -","2","1","","Wang, Shitao; Sawada, Tomohisa; Fujita, Makoto","Capsule-bowl conversion triggered by a guest reaction.","Chemical communications (Cambridge, England)","2016","52","78","11653","11656","10.1039/c6cc06551a","","","0.71073","MoKα","","0.1861","0.1457","","","0.3654","0.3887","","","","","","1.147","","","","has coordinates,has disorder","234477","2020-10-21","18:00:00",""
"7125058","48.457","0.008","27.761","0.004","37.941","0.006","90","","108.713","0.005","90","","48341","13","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(M20L8 octahedral capsule) - calix[4]arene complex","","- C204 H351 N130 O191 Pd20 -","- C204 H272 N130 O191 Pd20 -","- C816 H1088 N520 O764 Pd80 -","4","0.5","","Wang, Shitao; Sawada, Tomohisa; Fujita, Makoto","Capsule-bowl conversion triggered by a guest reaction.","Chemical communications (Cambridge, England)","2016","52","78","11653","11656","10.1039/c6cc06551a","","","0.71073","MoKα","","0.2464","0.18","","","0.4395","0.4958","","","","","","1.809","","","","has coordinates,has disorder","234477","2020-10-21","18:00:00",""
"7125059","46.603","0.006","25.734","0.003","37.303","0.005","90","","113.398","0.003","90","","41058","9","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(M20L8 octahedral capsule) - (1-naphtylsilanetriol) complex","","- C196 H357 N118.5 O119.5 Pd20 Si3 -","- C196 H262 N118.5 O119.5 Pd20 Si3 -","- C784 H1048 N474 O478 Pd80 Si12 -","4","1","","Wang, Shitao; Sawada, Tomohisa; Fujita, Makoto","Capsule-bowl conversion triggered by a guest reaction.","Chemical communications (Cambridge, England)","2016","52","78","11653","11656","10.1039/c6cc06551a","","","0.71073","MoKα","","0.3022","0.2071","","","0.4916","0.5805","","","","","","1.836","","","","has coordinates,has disorder","234477","2020-10-21","18:00:00",""
"7125060","24.8071","0.0015","18.2127","0.0012","40.556","0.003","90","","96.472","0.002","90","","18207","2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(M8L4 bowl) - (cyclic tetrasiloxane) complex","","- C108 H166 N55 O59.5 Pd8 Si4 -","- C108 H132 N55 O59.5 Pd8 Si4 -","- C432 H528 N220 O238 Pd32 Si16 -","4","1","","Wang, Shitao; Sawada, Tomohisa; Fujita, Makoto","Capsule-bowl conversion triggered by a guest reaction.","Chemical communications (Cambridge, England)","2016","52","78","11653","11656","10.1039/c6cc06551a","","","0.71073","MoKα","","0.2592","0.1562","","","0.4073","0.4493","","","","","","1.952","","","","has coordinates,has disorder","234477","2020-10-21","18:00:00",""
"7125061","5.502","0.002","8.865","0.003","10.409","0.005","107.757","0.005","97.878","0.005","93.199","0.005","476.4","0.3","190","2","190.15","","","","","","","","","5","P -1","-P 1","2","5-fluorouracil, 2,2'-bpe","5-fluoro-1H,3H-pyrimidine-2,4-dione, 1,2-bis(2-pyridyl)ethylene","","- C20 H16 F2 N6 O4 -","- C20 H16 F2 N6 O4 -","- C20 H16 F2 N6 O4 -","1","0.5","","Duncan, Andrew J. E.; Dudovitz, Roxanne L.; Dudovitz, Shawna J.; Stojaković, Jelena; Mariappan, S. V. Santhana; MacGillivray, Leonard R.","Quantitative and regiocontrolled cross-photocycloaddition of the anticancer drug 5-fluorouracil achieved in a cocrystal.","Chemical communications (Cambridge, England)","2016","52","89","13109","13111","10.1039/c6cc06570h","","","0.71073","MoKα","","0.0708","0.0441","","","0.0982","0.1109","","","","","","1.015","","","","has coordinates","234480","2020-10-21","18:00:00",""
"7125062","7.8358","0.0008","12.4452","0.0012","15.629","0.0015","98.513","0.005","102.02","0.005","101.749","0.005","1430.3","0.2","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","5-fluoro-5,6-(bis(2-pyridyl)cyclobuta)uracil (fbpcu)","6-fluoro-7,8-bis(2-pyridyl)-2,4-diazabicyclo[4.2.0]octa-3,5-dione","","- C16 H13 F N4 O2 -","- C16 H13 F N4 O2 -","- C64 H52 F4 N16 O8 -","4","2","","Duncan, Andrew J. E.; Dudovitz, Roxanne L.; Dudovitz, Shawna J.; Stojaković, Jelena; Mariappan, S. V. Santhana; MacGillivray, Leonard R.","Quantitative and regiocontrolled cross-photocycloaddition of the anticancer drug 5-fluorouracil achieved in a cocrystal.","Chemical communications (Cambridge, England)","2016","52","89","13109","13111","10.1039/c6cc06570h","","","0.71073","MoKα","","0.0945","0.0486","","","0.0991","0.1175","","","","","","1.017","","","","has coordinates","234480","2020-10-21","18:00:00",""
"7125063","13.802","0.0017","20.7715","0.0013","18.8547","0.0011","90","","100.48","0.002","90","","5315.3","0.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C102 H88 Cl0 Cu4 F12 N2 P10 -","- C102 H88 Cu4 F12 N2 P10 -","- C204 H176 Cu8 F24 N4 P20 -","2","0.5","","El Sayed Moussa, M.; Evariste, S.; Wong, H.-L.; Le Bras, L.; Roiland, C.; Le Polles, L.; Le Guennic, B.; Costuas, K.; Yam, V. W.-W.; Lescop, C.","A solid state highly emissive Cu(i) metallacycle: promotion of cuprophilic interactions at the excited states.","Chemical communications (Cambridge, England)","2016","52","76","11370","11373","10.1039/c6cc06613e","","","0.71073","MoKα","","0.0671","0.0566","","","0.1677","0.1753","","","","","","1.113","","","","has coordinates,has disorder","234482","2020-10-21","18:00:00",""
"7125064","13.869","0.004","20.739","0.007","18.963","0.006","90","","100.223","0.002","90","","5368","3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C102 H88 Cl0 Cu4 F12 N2 P10 -","- C102 H88 Cu4 F12 N2 P10 -","- C204 H176 Cu8 F24 N4 P20 -","2","0.5","","El Sayed Moussa, M.; Evariste, S.; Wong, H.-L.; Le Bras, L.; Roiland, C.; Le Polles, L.; Le Guennic, B.; Costuas, K.; Yam, V. W.-W.; Lescop, C.","A solid state highly emissive Cu(i) metallacycle: promotion of cuprophilic interactions at the excited states.","Chemical communications (Cambridge, England)","2016","52","76","11370","11373","10.1039/c6cc06613e","","","0.71073","MoKα","","0.0738","0.0589","","","0.1689","0.1777","","","","","","1.15","","","","has coordinates,has disorder","234482","2020-10-21","18:00:00",""
"7125065","13.935","0.003","20.745","0.005","19.086","0.004","90","","100.55","0.005","90","","5424","2","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C102 H88 Cl0 Cu4 F12 N2 P10 -","- C102 H88 Cu4 F12 N2 P10 -","- C204 H176 Cu8 F24 N4 P20 -","2","0.5","","El Sayed Moussa, M.; Evariste, S.; Wong, H.-L.; Le Bras, L.; Roiland, C.; Le Polles, L.; Le Guennic, B.; Costuas, K.; Yam, V. W.-W.; Lescop, C.","A solid state highly emissive Cu(i) metallacycle: promotion of cuprophilic interactions at the excited states.","Chemical communications (Cambridge, England)","2016","52","76","11370","11373","10.1039/c6cc06613e","","","0.71073","MoKα","","0.0755","0.0561","","","0.1587","0.1701","","","","","","1.042","","","","has coordinates,has disorder","234482","2020-10-21","18:00:00",""
"7125066","14.023","0.003","20.778","0.005","19.191","0.004","90","","100.733","0.009","90","","5494","2","250","2","250","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C102 H88 Cl0 Cu4 F12 N2 P10 -","- C102 H88 Cu4 F12 N2 P10 -","- C204 H176 Cu8 F24 N4 P20 -","2","0.5","","El Sayed Moussa, M.; Evariste, S.; Wong, H.-L.; Le Bras, L.; Roiland, C.; Le Polles, L.; Le Guennic, B.; Costuas, K.; Yam, V. W.-W.; Lescop, C.","A solid state highly emissive Cu(i) metallacycle: promotion of cuprophilic interactions at the excited states.","Chemical communications (Cambridge, England)","2016","52","76","11370","11373","10.1039/c6cc06613e","","","0.71073","MoKα","","0.0834","0.0561","","","0.1514","0.1646","","","","","","0.977","","","","has coordinates,has disorder","234482","2020-10-21","18:00:00",""
"7125067","8.533","0.001","13.0141","0.001","9.6918","0.0012","90","","92.131","0.001","90","","1075.5","0.2","293","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H4 N2 O2.5 S0.5 -","- C4 H4 N2 O2.5 S0.5 -","- C32 H32 N16 O20 S4 -","8","2","","Shemchuk, O.; Braga, D.; Grepioni, F.","Alloying barbituric and thiobarbituric acids: from solid solutions to a highly stable keto co-crystal form.","Chemical communications (Cambridge, England)","2016","52","79","11815","11818","10.1039/c6cc06615a","","x-ray","0.71073","MoKα","","0.1644","0.0856","","","0.1302","0.1552","","","","","","1.167","","","","has coordinates,has disorder","234484","2020-10-21","18:00:00",""
"7125068","8.4569","0.0009","12.94","0.001","9.5593","0.0009","90","","92.626","0.01","90","","1045","0.17","293","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N4 O5.4 S0.6 -","- C8 H8 N4 O5.4 S0.6 -","- C32 H32 N16 O21.6 S2.4 -","4","1","","Shemchuk, O.; Braga, D.; Grepioni, F.","Alloying barbituric and thiobarbituric acids: from solid solutions to a highly stable keto co-crystal form.","Chemical communications (Cambridge, England)","2016","52","79","11815","11818","10.1039/c6cc06615a","","x-ray","0.71073","MoKα","","0.208","0.0743","","","0.1139","0.1604","","","","","","0.985","","","","has coordinates,has disorder","234484","2020-10-21","18:00:00",""
"7125069","8.4662","0.0013","12.9681","0.0012","9.6819","0.0011","90","","92.49","0.014","90","","1062","0.2","293","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N4 O5.2 S0.8 -","- C8 H8 N4 O5.2 S0.8 -","- C32 H32 N16 O20.8 S3.2 -","4","1","","Shemchuk, O.; Braga, D.; Grepioni, F.","Alloying barbituric and thiobarbituric acids: from solid solutions to a highly stable keto co-crystal form.","Chemical communications (Cambridge, England)","2016","52","79","11815","11818","10.1039/c6cc06615a","","x-ray","0.71073","MoKα","","0.2337","0.1059","","","0.2172","0.2839","","","","","","1.021","","","","has coordinates,has disorder","234484","2020-10-21","18:00:00",""
"7125070","18.159","0.005","7.4484","0.0019","6.3101","0.0015","90","","90","","90","","853.5","0.4","115.05","","115.05","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C5 H12 O P2 -","- C5 H12 O P2 -","- C20 H48 O4 P8 -","4","0.5","","Jost, Maximilian; Finger, Lars H.; Sundermeyer, Jörg; von Hänisch, Carsten","Simple access to ionic liquids and organic salts containing the phosphaethynolate (PCO(-)) and Zintl (Sb11(3-)) anions.","Chemical communications (Cambridge, England)","2016","52","78","11646","11648","10.1039/c6cc06620h","","x-ray","0.71073","MoKα","","0.0857","0.046","","","0.0756","0.09","","","","","","1.009","","","","has coordinates,has disorder","234486","2020-10-21","18:00:00",""
"7125071","11.8762","0.0006","15.7545","0.0008","13.6079","0.0006","90","","94.012","0.002","90","","2539.8","0.2","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H39 N7 O2 P2 -","- C18 H39 N7 O2 P2 -","- C72 H156 N28 O8 P8 -","4","1","","Jost, Maximilian; Finger, Lars H.; Sundermeyer, Jörg; von Hänisch, Carsten","Simple access to ionic liquids and organic salts containing the phosphaethynolate (PCO(-)) and Zintl (Sb11(3-)) anions.","Chemical communications (Cambridge, England)","2016","52","78","11646","11648","10.1039/c6cc06620h","","x-ray","0.71073","MoKα","","0.045","0.0317","","","0.0683","0.0741","","","","","","1.052","","","","has coordinates,has disorder","234486","2020-10-21","18:00:00",""
"7125072","5.941","0.0005","7.4092","0.0006","8.8324","0.0008","90","","99.184","0.004","90","","383.8","0.06","100","","100","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C5 H12 N O P -","- C5 H12 N O P -","- C10 H24 N2 O2 P2 -","2","0.5","","Jost, Maximilian; Finger, Lars H.; Sundermeyer, Jörg; von Hänisch, Carsten","Simple access to ionic liquids and organic salts containing the phosphaethynolate (PCO(-)) and Zintl (Sb11(3-)) anions.","Chemical communications (Cambridge, England)","2016","52","78","11646","11648","10.1039/c6cc06620h","","x-ray","0.71073","MoKα","","0.0376","0.0303","","","0.0705","0.0735","","","","","","1.066","","","","has coordinates","234486","2020-10-21","18:00:00",""
"7125073","31.443","0.002","11.2133","0.0007","21.6617","0.0011","90","","123.21","0.004","90","","6390","0.7","100.15","","100.15","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C39 H90 P3 Sb11 -","- C39 H90 P3 Sb11 -","- C156 H360 P12 Sb44 -","4","1","","Jost, Maximilian; Finger, Lars H.; Sundermeyer, Jörg; von Hänisch, Carsten","Simple access to ionic liquids and organic salts containing the phosphaethynolate (PCO(-)) and Zintl (Sb11(3-)) anions.","Chemical communications (Cambridge, England)","2016","52","78","11646","11648","10.1039/c6cc06620h","","","0.71073","MoKα","","0.1089","0.0531","","","0.1205","0.1339","","","","","","0.719","","","","has coordinates,has disorder","234486","2020-10-21","18:00:00",""
"7125074","8.8081","0.0004","9.9881","0.0005","12.6194","0.0006","79.9048","0.0016","82.4837","0.0016","80.2931","0.0016","1071.49","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H19 Cl O4 -","- C26 H18.1 Cl O4 -","- C52 H36.2 Cl2 O8 -","2","1","","Gao, Wen-Chao; Hu, Fei; Tian, Jun; Li, Xing; Wei, Wen-Long; Chang, Hong-Hong","Hypoiodite-catalysed oxidative cyclisation of Michael adducts of chalcones with 1,3-dicarbonyl compounds: a facile and versatile approach to substituted furans and cyclopropanes.","Chemical communications (Cambridge, England)","2016","52","89","13097","13100","10.1039/c6cc06624k","","","0.71073","MoKα","","0.0757","0.0482","","","0.1131","0.1304","","","","","","1.021","","","","has coordinates","234488","2020-10-21","18:00:00",""
"7125075","8.5852","0.0006","15.905","0.0012","15.6721","0.0012","90","","95.176","0.002","90","","2131.3","0.3","299","2","299","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 O4 -","- C26 H22 O4 -","- C104 H88 O16 -","4","1","","Gao, Wen-Chao; Hu, Fei; Tian, Jun; Li, Xing; Wei, Wen-Long; Chang, Hong-Hong","Hypoiodite-catalysed oxidative cyclisation of Michael adducts of chalcones with 1,3-dicarbonyl compounds: a facile and versatile approach to substituted furans and cyclopropanes.","Chemical communications (Cambridge, England)","2016","52","89","13097","13100","10.1039/c6cc06624k","","","0.71073","MoKα","","0.0697","0.046","","","0.1044","0.1198","","","","","","1.027","","","","has coordinates","234488","2020-10-21","18:00:00",""
"7125076","9.423","0.005","12.742","0.007","12.89","0.007","62.717","0.009","70.16","0.009","76.407","0.01","1288","1.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Sparfloxacin-methyl paraben cocrystal","5-Amino-1-cyclopropyl-7-[(3R,5S)3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid-methyl 4-hydroxy benzoate","","- C27 H30 F2 N4 O6 -","- C27 H30 F2 N4 O6 -","- C54 H60 F4 N8 O12 -","2","1","","Gunnam, Anilkumar; Suresh, Kuthuru; Ganduri, Ramesh; Nangia, Ashwini","Crystal engineering of a zwitterionic drug to neutral cocrystals: a general solution for floxacins.","Chemical communications (Cambridge, England)","2016","52","85","12610","12613","10.1039/c6cc06627e","","","0.71073","MoKα","","0.1037","0.0606","","","0.1361","0.1541","","","","","","0.909","","","","has coordinates","234490","2020-10-21","18:00:00",""
"7125077","7.9588","0.0004","10.3333","0.0005","17.8484","0.0009","80.749","0.004","87.489","0.004","72.019","0.005","1377.99","0.13","153","2","153","2","","","","","","","","5","P -1","-P 1","2","Sparfloxacin-Propylparaben cocrystal","5-Amino-1-cyclopropyl-7-[(3R,5S)3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid-4-hydroxy-propylbenzoate","","- C29 H34 F2 N4 O6 -","- C29 H34 F2 N4 O6 -","- C58 H68 F4 N8 O12 -","2","1","","Gunnam, Anilkumar; Suresh, Kuthuru; Ganduri, Ramesh; Nangia, Ashwini","Crystal engineering of a zwitterionic drug to neutral cocrystals: a general solution for floxacins.","Chemical communications (Cambridge, England)","2016","52","85","12610","12613","10.1039/c6cc06627e","","","0.71073","MoKα","","0.1212","0.0753","","","0.1928","0.221","","","","","","1.087","","","","has coordinates","234490","2020-10-21","18:00:00",""
"7125078","9.5457","0.0005","12.8769","0.0006","13.338","0.0007","62.8916","0.0014","71.3599","0.0016","77.1301","0.0016","1377.05","0.12","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Sparfloxacin-ethyl paraben cocrystal","5-Amino-1-cyclopropyl-7-[(3R,5S)3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid-ethyl 4-hydroxy benzoate","","- C28 H32 F2 N4 O6 -","- C28 H32 F2 N4 O6 -","- C56 H64 F4 N8 O12 -","2","1","","Gunnam, Anilkumar; Suresh, Kuthuru; Ganduri, Ramesh; Nangia, Ashwini","Crystal engineering of a zwitterionic drug to neutral cocrystals: a general solution for floxacins.","Chemical communications (Cambridge, England)","2016","52","85","12610","12613","10.1039/c6cc06627e","","","0.71073","MoKα","","0.0855","0.0498","","","0.1449","0.1729","","","","","","1.106","","","","has coordinates","234490","2020-10-21","18:00:00",""
"7125079","9.5693","0.0007","9.7134","0.0007","17.7964","0.0012","74.767","0.003","76.025","0.003","69.597","0.003","1475.24","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Sparfloxacin-Isobutylparaben corystal","5-Amino-1-cyclopropyl-7-[(3R,5S)3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid-4-hydroxy-isobutylbenzoate","","- C30 H36 F2 N4 O6 -","- C30 H36 F2 N4 O6 -","- C60 H72 F4 N8 O12 -","2","1","","Gunnam, Anilkumar; Suresh, Kuthuru; Ganduri, Ramesh; Nangia, Ashwini","Crystal engineering of a zwitterionic drug to neutral cocrystals: a general solution for floxacins.","Chemical communications (Cambridge, England)","2016","52","85","12610","12613","10.1039/c6cc06627e","","","0.71073","MoKα","","0.1481","0.0638","","","0.1239","0.1517","","","","","","1.03","","","","has coordinates","234490","2020-10-21","18:00:00",""
"7125080","9.5286","0.0008","17.004","0.0014","17.9431","0.0015","90","","96.744","0.003","90","","2887.1","0.4","100","2","100.1","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Cl2 N6 Ni O8 -","- C27 H28 Cl2 N6 Ni O8 -","- C108 H112 Cl8 N24 Ni4 O32 -","4","1","","Kankanamalage, Pavithra H. A.; Mazumder, Shivnath; Tiwari, Vishwas; Kpogo, Kenneth K.; Bernhard Schlegel, H.; Verani, Cláudio N","Efficient electro/photocatalytic water reduction using a [Ni<sup>II</sup>(N<sub>2</sub>Py<sub>3</sub>)]<sup>2+</sup> complex.","Chemical communications (Cambridge, England)","2016","52","91","13357","13360","10.1039/c6cc06629a","","x-ray","0.71073","MoKα","","0.0622","0.0517","","","0.1222","0.1286","","","","","","1.085","","","","has coordinates","234492","2020-10-21","18:00:00",""
"7125081","7.8366","0.0004","8.8547","0.0004","14.3134","0.0006","84.725","0.002","88.103","0.002","87.621","0.002","987.73","0.08","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H28 O3 -","- C22 H28 O3 -","- C44 H56 O6 -","2","1","","Tharra, Prabhakararao; Baire, Beeraiah","The Z-enoate assisted, Meyer-Schuster rearrangement cascade: unconventional synthesis of α-arylenone esters.","Chemical communications (Cambridge, England)","2016","52","82","12147","12150","10.1039/c6cc06639a","","","0.71073","MoKα","","0.0581","0.0425","","","0.1036","0.1163","","","","","","1.05","","","","has coordinates","234494","2020-10-21","18:00:00",""
"7125082","44.3099","0.0012","44.3099","0.0012","21.2242","0.0009","90","","90","","120","","36088","2","100.05","0.1","100","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C144 H126 Br12 Mn18 N24 Na6 O66 -","- C144 H126 Br12 Mn18 N24 Na6 O66 -","- C864 H756 Br72 Mn108 N144 Na36 O396 -","6","0.166667","","Manoli, Maria; Inglis, Ross; Piligkos, Stergios; Yanhua, Lan; Wernsdorfer, Wolfgang; Brechin, Euan K.; Tasiopoulos, Anastasios J.","A hexameric [MnNa<sub>6</sub>] wheel based on [MnO]<sup>7+</sup> sub-units.","Chemical communications (Cambridge, England)","2016","52","87","12829","12832","10.1039/c6cc06644e","","","1.54184","CuKα","","0.0763","0.0688","","","0.2089","0.2175","","","","","","1.109","","","","has coordinates","234496","2020-10-21","18:00:00",""
"7125083","6.6588","0.0007","8.4075","0.0015","15.219","0.005","83.79","0.03","77.405","0.017","67.799","0.013","769.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 As F6 S12 -","- C20.008 H20.008 As F6 S12 -","- C20.008 H20.008 As F6 S12 -","1","0.5","","Pop, Flavia; Auban-Senzier, Pascale; Canadell, Enric; Avarvari, Narcis","Anion size control of the packing in the metallic versus semiconducting chiral radical cation salts (DM-EDT-TTF)<sub>2</sub>XF<sub>6</sub> (X = P, As, Sb).","Chemical communications (Cambridge, England)","2016","52","84","12438","12441","10.1039/c6cc06706a","","","0.71073","MoKα","","0.0837","0.0453","","","0.1006","0.1148","","","","","","1.027","","","","has coordinates,has disorder","234499","2020-10-21","18:00:00",""
"7125084","6.6849","0.0005","8.3964","0.0008","15.203","0.003","86.78","0.012","77.306","0.009","68.018","0.006","771.63","0.18","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C20 H20 As F6 S12 -","- C20 H20 As F6 S12 -","- C20 H20 As F6 S12 -","1","1","","Pop, Flavia; Auban-Senzier, Pascale; Canadell, Enric; Avarvari, Narcis","Anion size control of the packing in the metallic versus semiconducting chiral radical cation salts (DM-EDT-TTF)<sub>2</sub>XF<sub>6</sub> (X = P, As, Sb).","Chemical communications (Cambridge, England)","2016","52","84","12438","12441","10.1039/c6cc06706a","","","0.71073","MoKα","","0.0971","0.0413","","","0.069","0.0811","","","","","","1.006","","","","has coordinates","234499","2020-10-21","18:00:00",""
"7125085","6.6221","0.0004","8.485","0.0004","15.3114","0.0009","87.078","0.005","77.556","0.005","68.221","0.004","779.75","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 F6 S12 Sb -","- C20 H20 F6 S12 Sb -","- C20 H20 F6 S12 Sb -","1","0.5","","Pop, Flavia; Auban-Senzier, Pascale; Canadell, Enric; Avarvari, Narcis","Anion size control of the packing in the metallic versus semiconducting chiral radical cation salts (DM-EDT-TTF)<sub>2</sub>XF<sub>6</sub> (X = P, As, Sb).","Chemical communications (Cambridge, England)","2016","52","84","12438","12441","10.1039/c6cc06706a","","","0.71073","MoKα","","0.0879","0.0374","","","0.0771","0.0882","","","","","","1.013","","","","has coordinates,has disorder","234499","2020-10-21","18:00:00",""
"7125086","6.6529","0.0007","8.4663","0.0003","15.2766","0.0011","87.151","0.006","77.495","0.007","68.478","0.007","781.06","0.11","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C20 H20 F6 S12 Sb -","- C20 H20 F6 S12 Sb -","- C20 H20 F6 S12 Sb -","1","1","","Pop, Flavia; Auban-Senzier, Pascale; Canadell, Enric; Avarvari, Narcis","Anion size control of the packing in the metallic versus semiconducting chiral radical cation salts (DM-EDT-TTF)<sub>2</sub>XF<sub>6</sub> (X = P, As, Sb).","Chemical communications (Cambridge, England)","2016","52","84","12438","12441","10.1039/c6cc06706a","","","0.71073","MoKα","","0.0907","0.0531","","","0.1354","0.1523","","","","","","1.062","","","","has coordinates","234499","2020-10-21","18:00:00",""
"7125087","8.0663","0.0007","16.177","0.002","14.023","0.002","90","","100.231","0.007","90","","1800.7","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H20 As2 F12 S12 -","- C20 H20 As2 F12 S12 -","- C40 H40 As4 F24 S24 -","2","1","","Pop, Flavia; Auban-Senzier, Pascale; Canadell, Enric; Avarvari, Narcis","Anion size control of the packing in the metallic versus semiconducting chiral radical cation salts (DM-EDT-TTF)<sub>2</sub>XF<sub>6</sub> (X = P, As, Sb).","Chemical communications (Cambridge, England)","2016","52","84","12438","12441","10.1039/c6cc06706a","","","0.71073","MoKα","","0.0996","0.0443","","","0.069","0.0824","","","","","","1.016","","","","has coordinates","234499","2020-10-21","18:00:00",""
"7125088","8.0746","0.0005","16.1837","0.0007","14.0446","0.0006","90","","100.159","0.004","90","","1806.53","0.16","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H20 As2 F12 S12 -","- C20 H20 As2 F12 S12 -","- C40 H40 As4 F24 S24 -","2","1","","Pop, Flavia; Auban-Senzier, Pascale; Canadell, Enric; Avarvari, Narcis","Anion size control of the packing in the metallic versus semiconducting chiral radical cation salts (DM-EDT-TTF)<sub>2</sub>XF<sub>6</sub> (X = P, As, Sb).","Chemical communications (Cambridge, England)","2016","52","84","12438","12441","10.1039/c6cc06706a","","","0.71073","MoKα","","0.1282","0.05","","","0.0773","0.0952","","","","","","1.009","","","","has coordinates","234499","2020-10-21","18:00:00",""
"7125089","10.887","0.005","10.896","0.004","14.07","0.006","91.252","0.004","92.588","0.005","104.43","0.005","1613.8","1.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H16 N2 O8 Zn2 -","- C26 H16 N2 O8 Zn2 -","- C52 H32 N4 O16 Zn4 -","2","1","","Bhatt, Prashant M.; Batisai, Eustina; Smith, Vincent J.; Barbour, Leonard J.","Creation of new guest accessible space under gas pressure in a flexible MOF: multidimensional insight through combination of in situ techniques.","Chemical communications (Cambridge, England)","2016","52","76","11374","11377","10.1039/c6cc06709c","","","0.71073","MoKα","","0.1384","0.0862","","","0.2061","0.2228","","","","","","1.023","","","","has coordinates,has disorder","234501","2020-10-21","18:00:00",""
"7125090","7.9917","0.0013","9.4227","0.0016","10.5835","0.0017","65.314","0.002","86.464","0.002","76.513","0.002","703.6","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H8 N O4 Zn -","- C13 H8 N O4 Zn -","- C26 H16 N2 O8 Zn2 -","2","1","","Bhatt, Prashant M.; Batisai, Eustina; Smith, Vincent J.; Barbour, Leonard J.","Creation of new guest accessible space under gas pressure in a flexible MOF: multidimensional insight through combination of in situ techniques.","Chemical communications (Cambridge, England)","2016","52","76","11374","11377","10.1039/c6cc06709c","","","0.71073","MoKα","","0.073","0.0588","","","0.1757","0.2199","","","","","","1.251","","","","has coordinates,has disorder","234501","2020-10-21","18:00:00",""
"7125091","14.099","0.01","10.997","0.008","21.865","0.015","90","","93.971","0.009","90","","3382","4","253","2","253","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26.87 H16 N2 O9.73 Zn2 -","- C26.865 H16 N2 O9.73 Zn2 -","- C107.46 H64 N8 O38.92 Zn8 -","4","1","","Bhatt, Prashant M.; Batisai, Eustina; Smith, Vincent J.; Barbour, Leonard J.","Creation of new guest accessible space under gas pressure in a flexible MOF: multidimensional insight through combination of in situ techniques.","Chemical communications (Cambridge, England)","2016","52","76","11374","11377","10.1039/c6cc06709c","","","0.71073","MoKα","","0.1408","0.0877","","","0.2116","0.2319","","","","","","1.081","","","","has coordinates,has disorder","234501","2020-10-21","18:00:00",""
"7125092","7.871","0.003","9.34","0.003","10.629","0.003","65.253","0.004","86.362","0.004","77.446","0.004","692.3","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H8 N O4 Zn -","- C13 H8 N O4 Zn -","- C26 H16 N2 O8 Zn2 -","2","1","","Bhatt, Prashant M.; Batisai, Eustina; Smith, Vincent J.; Barbour, Leonard J.","Creation of new guest accessible space under gas pressure in a flexible MOF: multidimensional insight through combination of in situ techniques.","Chemical communications (Cambridge, England)","2016","52","76","11374","11377","10.1039/c6cc06709c","","","0.71073","MoKα","","0.0346","0.033","","","0.0878","0.0889","","","","","","1.078","","","","has coordinates,has disorder","234501","2020-10-21","18:00:00",""
"7125093","14.065","0.008","10.949","0.006","21.771","0.013","90","","94.319","0.009","90","","3343","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H16 N2 O8 Zn2 -","- C26 H16 N2 O8 Zn2 -","- C104 H64 N8 O32 Zn8 -","4","1","","Bhatt, Prashant M.; Batisai, Eustina; Smith, Vincent J.; Barbour, Leonard J.","Creation of new guest accessible space under gas pressure in a flexible MOF: multidimensional insight through combination of in situ techniques.","Chemical communications (Cambridge, England)","2016","52","76","11374","11377","10.1039/c6cc06709c","","","0.71073","MoKα","","0.0955","0.0633","","","0.1578","0.1718","","","","","","0.988","","","","has coordinates,has disorder","234501","2020-10-21","18:00:00",""
"7125094","46.542","0.002","46.542","0.002","46.542","0.002","90","","90","","90","","100817","8","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","HNUST5","","","- C30 Cu2 N2 O12 -","- C30 Cu2 N2 O12 -","- C1440 Cu96 N96 O576 -","48","0.25","","Zheng, Baishu; Wang, Hang; Wang, Zhaoxu; Ozaki, Noriaki; Hang, Cheng; Luo, Xin; Huang, Lu; Zeng, Wenjiang; Yang, Ming; Duan, Jingui","A highly porous rht-type acylamide-functionalized metal-organic framework exhibiting large CO<sub>2</sub> uptake capabilities.","Chemical communications (Cambridge, England)","2016","52","88","12988","12991","10.1039/c6cc06734d","powder diffraction","","1.54059","CuKα~1~","","0.10183","","","","","","0.11178","0.11219","3.4874","","","","","","","has coordinates","234504","2020-10-21","18:00:00",""
"7125095","6.1031","0.0006","11.4651","0.0012","26.396","0.003","90","","95.114","0.009","90","","1839.6","0.3","180.01","0.1","180.01","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 N O4 -","- C20 H26 N O4 -","- C80 H104 N4 O16 -","4","1","","Zhang, Hang; Wang, Bo; Yi, Heng; Sun, Tong; Zhang, Yan; Wang, Jianbo","Transition-metal-free three-component reaction of cyclopropenes, aldehydes and amines.","Chemical communications (Cambridge, England)","2016","52","90","13285","13287","10.1039/c6cc06743c","","","0.7107","MoKα","","0.1071","0.0707","","","0.1869","0.2242","","","","","","1.016","","","","has coordinates","234506","2020-10-21","18:00:00",""
"7125096","14.287","0.002","15.4","0.002","16.699","0.002","102.618","0.008","97.963","0.008","99.865","0.008","3472.7","0.8","100","1","100","1","","","","","","","","3","P -1","-P 1","2","","","","- C144 H232 Sn10 -","- C144 H232 Sn10 -","- C144 H232 Sn10 -","1","0.5","","Wiederkehr, J.; Wölper, C; Schulz, S.","Synthesis and solid state structure of a metalloid tin cluster [Sn<sub>10</sub>(trip<sub>8</sub>)].","Chemical communications (Cambridge, England)","2016","52","83","12282","12285","10.1039/c6cc06770k","","","0.71073","MoKα","","0.1357","0.0628","","","0.1378","0.1927","","","","","","1.111","","","","has coordinates","234508","2020-10-21","18:00:00",""
"7125097","9.0942","0.0005","20.5821","0.0011","21.2116","0.0012","90","","90","","90","","3970.3","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C44 H64 Mg N2 -","- C44 H64 Mg N2 -","- C176 H256 Mg4 N8 -","4","1","","Wiederkehr, J.; Wölper, C; Schulz, S.","Synthesis and solid state structure of a metalloid tin cluster [Sn<sub>10</sub>(trip<sub>8</sub>)].","Chemical communications (Cambridge, England)","2016","52","83","12282","12285","10.1039/c6cc06770k","","","0.71073","MoKα","","0.068","0.0459","","","0.1084","0.1226","","","","","","1.035","","","","has coordinates,has disorder","234510","2020-10-21","18:00:00",""
"7125098","11.2579","0.0002","16.4458","0.0003","18.2926","0.0003","90","","90","","90","","3386.79","0.1","104","2","104","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C38 H52 Mg N2 -","- C38 H52 Mg N2 -","- C152 H208 Mg4 N8 -","4","1","","Wiederkehr, J.; Wölper, C; Schulz, S.","Synthesis and solid state structure of a metalloid tin cluster [Sn<sub>10</sub>(trip<sub>8</sub>)].","Chemical communications (Cambridge, England)","2016","52","83","12282","12285","10.1039/c6cc06770k","","","0.71073","MoKα","","0.0468","0.037","","","0.0848","0.0898","","","","","","1.028","","","","has coordinates","234512","2020-10-21","18:00:00",""
"7125099","9.9792","0.0001","6.6848","0.0001","10.2099","0.0007","90","","96.735","0.007","90","","676.39","0.05","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H24 O3 -","- C15 H24 O3 -","- C30 H48 O6 -","2","1","","Li, Fu-Zhuo; Li, Shuang; Zhang, Peng-Peng; Huang, Zhi-Hui; Zhang, Wei-Bin; Gong, Jianxian; Yang, Zhen","A chiral pool approach for asymmetric syntheses of (-)-antrocin, (+)-asperolide C, and (-)-trans-ozic acid.","Chemical communications (Cambridge, England)","2016","52","84","12426","12429","10.1039/c6cc06794h","","","1.54187","CuKα","","0.0547","0.0457","","","0.1109","0.1346","","","","","","1.157","","","","has coordinates","234514","2020-10-21","18:00:00",""
"7125100","11.3567","0.0009","12.2346","0.001","18.4353","0.0015","90","","108.188","0.0013","90","","2433.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H64 B2 Mg O8 -","- C54 H64 B2 Mg O8 -","- C108 H128 B4 Mg2 O16 -","2","0.5","","Mukherjee, Debabrata; Shirase, Satoru; Spaniol, Thomas P.; Mashima, Kazushi; Okuda, Jun","Magnesium hydridotriphenylborate [Mg(thf)<sub>6</sub>][HBPh<sub>3</sub>]<sub>2</sub>: a versatile hydroboration catalyst.","Chemical communications (Cambridge, England)","2016","52","89","13155","13158","10.1039/c6cc06805g","","","0.71073","MoKα","","0.0476","0.0387","","","0.0954","0.1002","","","","","","1.054","","","","has coordinates","234517","2020-10-21","18:00:00",""
"7125101","11.3879","0.0003","10.6012","0.0003","12.1055","0.0003","90","","98.506","0.002","90","","1445.37","0.07","100","0.2","100","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H25 N O3 -","- C15 H25 N O3 -","- C60 H100 N4 O12 -","4","1","","Ho, Guo-Ming; Li, Yu-Jang","Stereoselective synthesis of 2,3,4-highly substituted oxetanes by intramolecular C-C bond forming Michael addition.","Chemical communications (Cambridge, England)","2016","52","81","12108","12111","10.1039/c6cc06857j","","","0.71073","MoKα","","0.0495","0.0347","","","0.0777","0.0877","","","","","","1.035","","","","has coordinates","234519","2020-10-21","18:00:00",""
"7125102","11.1811","0.0004","11.6175","0.0005","14.5096","0.0006","70.505","0.002","78.122","0.002","74.189","0.002","1695.7","0.12","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H39 N24 O13 -","- C40 H34 N2 O8 -","- C80 H68 N4 O16 -","2","1","","Zhang, Cheng; Chang, Sailan; Qiu, Lihua; Xu, Xinfang","Chemodivergent synthesis of multi-substituted/fused pyrroles via copper-catalyzed carbene cascade reaction of propargyl α-iminodiazoacetates.","Chemical communications (Cambridge, England)","2016","52","84","12470","12473","10.1039/c6cc06864b","","","0.71073","MoKα","","0.0783","0.0562","","","0.1766","0.1938","","","","","","1.399","","","","has coordinates","234521","2020-10-21","18:00:00",""
"7125103","10.7549","0.0006","7.0492","0.0004","19.1664","0.0012","90","","102.5","0.002","90","","1418.63","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 N O4 -","- C19 H13 N O4 -","- C76 H52 N4 O16 -","4","1","","Zhang, Cheng; Chang, Sailan; Qiu, Lihua; Xu, Xinfang","Chemodivergent synthesis of multi-substituted/fused pyrroles via copper-catalyzed carbene cascade reaction of propargyl α-iminodiazoacetates.","Chemical communications (Cambridge, England)","2016","52","84","12470","12473","10.1039/c6cc06864b","","","0.71073","MoKα","","0.0655","0.0492","","","0.1204","0.1298","","","","","","1.049","","","","has coordinates","234521","2020-10-21","18:00:00",""
"7125104","8.6755","0.0007","10.6916","0.001","11.439","0.0009","69.968","0.008","73.363","0.007","72.428","0.007","930.3","0.15","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H21 N O3 -","- C23 H21 N O3 -","- C46 H42 N2 O6 -","2","1","","Zhang, Cheng; Chang, Sailan; Qiu, Lihua; Xu, Xinfang","Chemodivergent synthesis of multi-substituted/fused pyrroles via copper-catalyzed carbene cascade reaction of propargyl α-iminodiazoacetates.","Chemical communications (Cambridge, England)","2016","52","84","12470","12473","10.1039/c6cc06864b","","","0.71073","MoKα","","0.0578","0.0444","","","0.1181","0.1281","","","","","","1.049","","","","has coordinates","234521","2020-10-21","18:00:00",""
"7125105","4.288","0.0005","27.2739","0.0016","14.6976","0.0009","90","","90.213","0.008","90","","1718.9","0.2","223","0.1","223","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Br N O3 -","- C20 H16 Br N O3 -","- C80 H64 Br4 N4 O12 -","4","1","","Zhang, Cheng; Chang, Sailan; Qiu, Lihua; Xu, Xinfang","Chemodivergent synthesis of multi-substituted/fused pyrroles via copper-catalyzed carbene cascade reaction of propargyl α-iminodiazoacetates.","Chemical communications (Cambridge, England)","2016","52","84","12470","12473","10.1039/c6cc06864b","","","0.71073","MoKα","","0.0738","0.0432","","","0.079","0.0883","","","","","","1.001","","","","has coordinates","234521","2020-10-21","18:00:00",""
"7125106","10.1595","0.0003","12.5137","0.0004","15.7867","0.0005","100.375","0.002","100.066","0.002","108.045","0.003","1819.16","0.11","122.8","0.6","122.8","0.6","","","","","","","","6","P -1","-P 1","2","","","","- C31 H55 Co Fe P5 Si -","- C31 H55 Co Fe P5 Si -","- C62 H110 Co2 Fe2 P10 Si2 -","2","1","","Mädl, Eric; Peresypkina, Eugenia; Timoshkin, Alexey Y.; Scheer, Manfred","Triple-decker sandwich complexes with a bent cyclo-P<sub>5</sub> middle-deck.","Chemical communications (Cambridge, England)","2016","52","83","12298","12301","10.1039/c6cc06883a","","","1.54178","CuKα","","0.0294","0.0257","","","0.0732","0.0803","","","","","","1.091","","","","has coordinates","234523","2020-10-21","18:00:00",""
"7125107","12.73","0.0001","15.579","0.0001","17.3044","0.0001","90","","108.258","0.001","90","","3259.05","0.04","123.1","0.6","123.1","0.6","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H50 Co Fe N P5 -","- C29 H50 Co Fe N P5 -","- C116 H200 Co4 Fe4 N4 P20 -","4","1","","Mädl, Eric; Peresypkina, Eugenia; Timoshkin, Alexey Y.; Scheer, Manfred","Triple-decker sandwich complexes with a bent cyclo-P<sub>5</sub> middle-deck.","Chemical communications (Cambridge, England)","2016","52","83","12298","12301","10.1039/c6cc06883a","","","1.54178","CuKα","","0.0332","0.0288","","","0.0675","0.0683","","","","","","0.925","","","","has coordinates","234523","2020-10-21","18:00:00",""
"7125108","12.7483","0.0001","15.4746","0.0001","17.3699","0.0002","90","","107.71","0.001","90","","3264.25","0.05","123.1","0.8","123.1","0.8","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H50 Fe N Ni P5 -","- C29 H50 Fe N Ni P5 -","- C116 H200 Fe4 N4 Ni4 P20 -","4","1","","Mädl, Eric; Peresypkina, Eugenia; Timoshkin, Alexey Y.; Scheer, Manfred","Triple-decker sandwich complexes with a bent cyclo-P<sub>5</sub> middle-deck.","Chemical communications (Cambridge, England)","2016","52","83","12298","12301","10.1039/c6cc06883a","","","1.54178","CuKα","","0.0304","0.0239","","","0.0552","0.0564","","","","","","0.91","","","","has coordinates","234523","2020-10-21","18:00:00",""
"7125109","17.2557","0.0003","12.4359","0.0002","16.6796","0.0003","90","","114.972","0.002","90","","3244.67","0.11","122.99","0.1","122.99","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H50 Fe2 N P5 -","- C29 H50 Fe2 N P5 -","- C116 H200 Fe8 N4 P20 -","4","1","","Mädl, Eric; Peresypkina, Eugenia; Timoshkin, Alexey Y.; Scheer, Manfred","Triple-decker sandwich complexes with a bent cyclo-P<sub>5</sub> middle-deck.","Chemical communications (Cambridge, England)","2016","52","83","12298","12301","10.1039/c6cc06883a","","","0.71073","MoKα","","0.0532","0.0301","","","0.0588","0.0612","","","","","","0.835","","","","has coordinates","234523","2020-10-21","18:00:00",""
"7125110","19.9256","0.0002","11.6275","0.0001","16.4157","0.0002","90","","106.491","0.001","90","","3646.82","0.07","123.01","0.1","123.01","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H55 Cr Fe P5 Si -","- C31 H55 Cr Fe P5 Si -","- C124 H220 Cr4 Fe4 P20 Si4 -","4","1","","Mädl, Eric; Peresypkina, Eugenia; Timoshkin, Alexey Y.; Scheer, Manfred","Triple-decker sandwich complexes with a bent cyclo-P<sub>5</sub> middle-deck.","Chemical communications (Cambridge, England)","2016","52","83","12298","12301","10.1039/c6cc06883a","","","1.54178","CuKα","","0.0308","0.0278","","","0.0775","0.0784","","","","","","1.092","","","","has coordinates","234523","2020-10-21","18:00:00",""
"7125111","14.9545","0.0001","16.8539","0.0001","15.7381","0.0001","90","","98.016","0.001","90","","3927.9","0.04","123","0.1","123","0.1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H55 Co F6 Fe P6 Si -","- C31 H55 Co F6 Fe P6 Si -","- C124 H220 Co4 F24 Fe4 P24 Si4 -","4","1","","Mädl, Eric; Peresypkina, Eugenia; Timoshkin, Alexey Y.; Scheer, Manfred","Triple-decker sandwich complexes with a bent cyclo-P<sub>5</sub> middle-deck.","Chemical communications (Cambridge, England)","2016","52","83","12298","12301","10.1039/c6cc06883a","","","1.54178","CuKα","","0.0268","0.0244","","","0.0653","0.0659","","","","","","1.083","","","","has coordinates","234523","2020-10-21","18:00:00",""
"7125112","12.89","0.003","9.6595","0.0019","16.653","0.003","90","","90","","90","","2073.5","0.7","123","2","123","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C50 H60 B2 N2 -","- C50 H60 B2 N2 -","- C100 H120 B4 N4 -","2","0.25","","Yuan, Ningning; Wang, Wenqing; Wu, Ziye; Chen, Sheng; Tan, Gengwen; Sui, Yunxia; Wang, Xinping; Jiang, Jun; Power, Philip P.","A boron-centered radical: a potassium-crown ether stabilized boryl radical anion.","Chemical communications (Cambridge, England)","2016","52","86","12714","12716","10.1039/c6cc06918e","","","0.71073","MoKα","","0.0544","0.0458","","","0.1134","0.1189","","","","","","1.066","","","","has coordinates","234525","2020-10-21","18:00:00",""
"7125113","8.243","0.0007","20.22","0.0018","12.5726","0.0012","90","","101.097","0.003","90","","2056.3","0.3","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C41 H62 B K N O7 -","- C41 H62 B K N O7 -","- C82 H124 B2 K2 N2 O14 -","2","1","","Yuan, Ningning; Wang, Wenqing; Wu, Ziye; Chen, Sheng; Tan, Gengwen; Sui, Yunxia; Wang, Xinping; Jiang, Jun; Power, Philip P.","A boron-centered radical: a potassium-crown ether stabilized boryl radical anion.","Chemical communications (Cambridge, England)","2016","52","86","12714","12716","10.1039/c6cc06918e","","","0.71073","MoKα","","0.0353","0.0337","","","0.0861","0.087","","","","","","1.088","","","","has coordinates,has disorder","234525","2020-10-21","18:00:00",""
"7125114","26.1665","0.0013","15.2608","0.0008","23.2073","0.001","90","","114.863","0.001","90","","8408.3","0.7","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C60 H93 Cd3 Ce I6 N6 O11 P2 -","- C60 H93 Cd3 Ce I6 N6 O11 P2 -","- C240 H372 Cd12 Ce4 I24 N24 O44 P8 -","4","1","","Li, Quan-Wen; Wan, Rui-Chen; Chen, Yan-Cong; Liu, Jun-Liang; Wang, Long-Fei; Jia, Jian-Hua; Chilton, Nicholas F.; Tong, Ming-Liang","Unprecedented hexagonal bipyramidal single-ion magnets based on metallacrowns.","Chemical communications (Cambridge, England)","2016","52","91","13365","13368","10.1039/c6cc06924j","","","0.71073","MoKα","","0.1048","0.0626","","","0.1298","0.1449","","","","","","1.053","","","","has coordinates,has disorder","234528","2020-10-21","18:00:00",""
"7125115","26.2751","0.0009","15.2788","0.0006","23.1448","0.0007","90","","114.769","0.001","90","","8436.7","0.5","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C60 H93 Cd3 I6 N6 Nd O11 P2 -","- C60 H93 Cd3 I6 N6 Nd O11 P2 -","- C240 H372 Cd12 I24 N24 Nd4 O44 P8 -","4","1","","Li, Quan-Wen; Wan, Rui-Chen; Chen, Yan-Cong; Liu, Jun-Liang; Wang, Long-Fei; Jia, Jian-Hua; Chilton, Nicholas F.; Tong, Ming-Liang","Unprecedented hexagonal bipyramidal single-ion magnets based on metallacrowns.","Chemical communications (Cambridge, England)","2016","52","91","13365","13368","10.1039/c6cc06924j","","","0.71073","MoKα","","0.0732","0.0415","","","0.0745","0.0834","","","","","","1.013","","","","has coordinates,has disorder","234528","2020-10-21","18:00:00",""
"7125116","6.924","0.005","8.665","0.006","8.772","0.007","108.778","0.018","94.634","0.017","90.55","0.016","496.3","0.6","150","2","149.98","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 F2 O S -","- C12 H8 F2 O S -","- C24 H16 F4 O2 S2 -","2","1","","Tsao, Fu An; Waked, Alexander E.; Cao, Levy; Hofmann, Jordan; Liu, Lei; Grimme, Stefan; Stephan, Douglas W.","S(vi) Lewis acids: fluorosulfoxonium cations.","Chemical communications (Cambridge, England)","2016","52","84","12418","12421","10.1039/c6cc06929k","","","0.71073","MoKα","","0.1709","0.1174","","","0.2783","0.3149","","","","","","1.1245","","","","has coordinates","234530","2020-10-21","18:00:00",""
"7125117","14.6347","0.0017","9.785","0.0012","23.547","0.003","90","","90","","90","","3371.9","0.7","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C37 H12 B F21 O S -","- C37 H12 B F21 O S -","- C148 H48 B4 F84 O4 S4 -","4","1","","Tsao, Fu An; Waked, Alexander E.; Cao, Levy; Hofmann, Jordan; Liu, Lei; Grimme, Stefan; Stephan, Douglas W.","S(vi) Lewis acids: fluorosulfoxonium cations.","Chemical communications (Cambridge, England)","2016","52","84","12418","12421","10.1039/c6cc06929k","","","0.71073","MoKα","","0.0619","0.0463","","","0.1064","0.1153","","","","","","1.01","","","","has coordinates","234530","2020-10-21","18:00:00",""
"7125118","15.099","0.0003","18.8792","0.0005","23.143","0.0007","90","","90","","90","","6597.1","0.3","150","2","149.99","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H10 B F21 O S -","- C36 H10 B F21 O S -","- C288 H80 B8 F168 O8 S8 -","8","1","","Tsao, Fu An; Waked, Alexander E.; Cao, Levy; Hofmann, Jordan; Liu, Lei; Grimme, Stefan; Stephan, Douglas W.","S(vi) Lewis acids: fluorosulfoxonium cations.","Chemical communications (Cambridge, England)","2016","52","84","12418","12421","10.1039/c6cc06929k","","","0.71073","MoKα","","0.0698","0.0406","","","0.0832","0.0966","","","","","","1.0348","","","","has coordinates,has disorder","234530","2020-10-21","18:00:00",""
"7125119","25.433","0.003","8.7969","0.001","18.856","0.002","90","","97.15","0.005","90","","4185.9","0.8","150","2","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H8 B0.5 F11 O S -","- C24 H8 B0.5 F11 O S -","- C192 H64 B4 F88 O8 S8 -","8","1","","Tsao, Fu An; Waked, Alexander E.; Cao, Levy; Hofmann, Jordan; Liu, Lei; Grimme, Stefan; Stephan, Douglas W.","S(vi) Lewis acids: fluorosulfoxonium cations.","Chemical communications (Cambridge, England)","2016","52","84","12418","12421","10.1039/c6cc06929k","","","0.71073","MoKα","","0.1211","0.0593","","","0.1207","0.1487","","","","","","1.0457","","","","has coordinates","234530","2020-10-21","18:00:00",""
"7125120","6.9113","0.0007","10.7857","0.0009","16.5078","0.0017","90","","99.049","0.007","90","","1215.2","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 B F5 O S -","- C12 H8 B F5 O S -","- C48 H32 B4 F20 O4 S4 -","4","1","","Tsao, Fu An; Waked, Alexander E.; Cao, Levy; Hofmann, Jordan; Liu, Lei; Grimme, Stefan; Stephan, Douglas W.","S(vi) Lewis acids: fluorosulfoxonium cations.","Chemical communications (Cambridge, England)","2016","52","84","12418","12421","10.1039/c6cc06929k","","","0.71073","MoKα","","0.1036","0.0502","","","0.091","0.1097","","","","","","1.011","","","","has coordinates","234530","2020-10-21","18:00:00",""
"7125121","10.307","0.003","18.544","0.005","27.144","0.007","90","","90","","90","","5188","2","100","2","100","2","","","","","","","","8","I 2 2 2","I 2 2","23","","","","- C30 H55 Au3 Co2 N6 O18 S6 Zn -","- C30 H55 Au3 Co2 N6 O18 S6 Zn -","- C120 H220 Au12 Co8 N24 O72 S24 Zn4 -","4","0.5","","Surinwong, Sireenart; Yoshinari, Nobuto; Kojima, Tatsuhiro; Konno, Takumi","A drastic change in the superhydrophilic crystal porosities of metallosupramolecular structures via a slight change in pH.","Chemical communications (Cambridge, England)","2016","52","87","12893","12896","10.1039/c6cc06943f","","","0.7002","synchrotron","","0.0451","0.0383","","","0.0793","0.0818","","","","","","1.012","","","","has coordinates,has disorder","234533","2020-10-21","18:00:00",""
"7125122","44.2485","0.0001","44.2485","0.0001","28.4446","0.0001","90","","90","","120","","48231.1","0.2","100","2","100","2","","","","","","","","9","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C94 H168 Au9 Co6 N18 Na2 O50 S18 Zn -","- C94 H168 Au9 Co6 N18 Na2 O50 S18 Zn -","- C564 H1008 Au54 Co36 N108 Na12 O300 S108 Zn6 -","6","0.5","","Surinwong, Sireenart; Yoshinari, Nobuto; Kojima, Tatsuhiro; Konno, Takumi","A drastic change in the superhydrophilic crystal porosities of metallosupramolecular structures via a slight change in pH.","Chemical communications (Cambridge, England)","2016","52","87","12893","12896","10.1039/c6cc06943f","","","0.7","synchrotron","","0.074","0.0627","","","0.1622","0.1702","","","","","","1.056","","","","has coordinates","234533","2020-10-21","18:00:00",""
"7125123","11.8867","0.0004","12.3732","0.0004","16.807","0.0006","92.305","0.001","91.809","0.001","98.884","0.001","2438.5","0.14","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H80 B20 Cl2 N4 O P2 -","- C29 H80 B20 Cl2 N4 O P2 -","- C58 H160 B40 Cl4 N8 O2 P4 -","2","1","","Wong, Yuen Onn; Smith, Mark D.; Peryshkov, Dmitry V.","Reversible water activation driven by contraction and expansion of a 12-vertex-closo-12-vertex-nido biscarborane cluster.","Chemical communications (Cambridge, England)","2016","52","86","12710","12713","10.1039/c6cc06955j","","x-ray","0.71073","MoKα","","0.0461","0.0351","","","0.08","0.0846","","","","","","1.036","","","","has coordinates,has disorder","234535","2020-10-21","18:00:00",""
"7125124","44.006","0.002","9.8902","0.0006","22.5051","0.0013","90","","90","","90","","9794.9","0.9","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C30 H81 B20 N5 O P2 -","- C30 H81 B20 N5 O P2 -","- C240 H648 B160 N40 O8 P16 -","8","2","","Wong, Yuen Onn; Smith, Mark D.; Peryshkov, Dmitry V.","Reversible water activation driven by contraction and expansion of a 12-vertex-closo-12-vertex-nido biscarborane cluster.","Chemical communications (Cambridge, England)","2016","52","86","12710","12713","10.1039/c6cc06955j","","x-ray","0.71073","MoKα","","0.0842","0.0506","","","0.0984","0.1096","","","","","","1.026","","","","has coordinates,has disorder","234535","2020-10-21","18:00:00",""
"7125125","13.542","0.003","13.931","0.003","14.562","0.003","90","","97.201","0.003","90","","2725.5","1","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C62 H80 O2 Sn2 -","- C62 H80 O2 Sn2 -","- C124 H160 O4 Sn4 -","2","0.5","","Erickson, Jeremy D.; Lai, Ting Yi; Liptrot, David J.; Olmstead, Marilyn M.; Power, Philip P.","Catalytic dehydrocoupling of amines and boranes by an incipient tin(ii) hydride.","Chemical communications (Cambridge, England)","2016","52","94","13656","13659","10.1039/c6cc06963k","","","0.71073","MoKα","","0.0203","0.0179","","","0.0473","0.0487","","","","","","1.042","","","","has coordinates","234537","2020-10-21","18:00:00",""
"7125126","25.5341","0.0012","22.081","0.0011","21.1566","0.0016","90","","122.336","0.0011","90","","10078.7","1","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C59 H69 N Sn2 -","- C59 H69 N Sn2 -","- C472 H552 N8 Sn16 -","8","1","","Erickson, Jeremy D.; Lai, Ting Yi; Liptrot, David J.; Olmstead, Marilyn M.; Power, Philip P.","Catalytic dehydrocoupling of amines and boranes by an incipient tin(ii) hydride.","Chemical communications (Cambridge, England)","2016","52","94","13656","13659","10.1039/c6cc06963k","","","0.71073","MoKα","","0.0525","0.0426","","","0.109","0.1123","","","","","","1.052","","","","has coordinates,has disorder","234537","2020-10-21","18:00:00",""
"7125127","10.6783","0.0016","18.823","0.003","17.516","0.003","90","","97.699","0.002","90","","3488.9","1","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 B P3 Pd -","- C40 H40 B P3 Pd -","- C160 H160 B4 P12 Pd4 -","4","1","","Schuhknecht, Danny; Ritter, Florian; Tauchert, Michael E.","Isolation and properties of a palladium PBP pincer complex featuring an ambiphilic boryl site.","Chemical communications (Cambridge, England)","2016","52","79","11823","11826","10.1039/c6cc07079e","","","0.71073","MoKα","","0.057","0.0407","","","0.0928","0.1003","","","","","","1.02","","","","has coordinates","234540","2020-10-21","18:00:00",""
"7125128","9.0882","0.0006","10.5044","0.0007","16.7224","0.0012","82.47","0.001","80.174","0.001","86.84","0.001","1558.56","0.18","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C32 H30 Cl2 I2 N P Pd -","- C32 H30 Cl2 I2 N P Pd -","- C64 H60 Cl4 I4 N2 P2 Pd2 -","2","1","","Schuhknecht, Danny; Ritter, Florian; Tauchert, Michael E.","Isolation and properties of a palladium PBP pincer complex featuring an ambiphilic boryl site.","Chemical communications (Cambridge, England)","2016","52","79","11823","11826","10.1039/c6cc07079e","","","0.71073","MoKα","","0.0374","0.0324","","","0.0799","0.0825","","","","","","1.024","","","","has coordinates","234540","2020-10-21","18:00:00",""
"7125129","8.8638","0.0012","22.432","0.003","19.469","0.003","90","","94.012","0.002","90","","3861.6","0.9","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H45 B I N P2 Pd -","- C46 H45 B I N P2 Pd -","- C184 H180 B4 I4 N4 P8 Pd4 -","4","1","","Schuhknecht, Danny; Ritter, Florian; Tauchert, Michael E.","Isolation and properties of a palladium PBP pincer complex featuring an ambiphilic boryl site.","Chemical communications (Cambridge, England)","2016","52","79","11823","11826","10.1039/c6cc07079e","","","0.71073","MoKα","","0.0775","0.0565","","","0.1649","0.1822","","","","","","1.091","","","","has coordinates,has disorder","234540","2020-10-21","18:00:00",""
"7125130","18.47","0.0018","31.893","0.003","10.3482","0.001","90","","90","","90","","6095.7","1","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C36 H28 B I P2 Pd -","- C36 H28 B I P2 Pd -","- C288 H224 B8 I8 P16 Pd8 -","8","0.5","","Schuhknecht, Danny; Ritter, Florian; Tauchert, Michael E.","Isolation and properties of a palladium PBP pincer complex featuring an ambiphilic boryl site.","Chemical communications (Cambridge, England)","2016","52","79","11823","11826","10.1039/c6cc07079e","","","0.71073","MoKα","","0.0334","0.0308","","","0.0635","0.0644","","","","","","0.981","","","","has coordinates","234540","2020-10-21","18:00:00",""
"7125131","15.188","0.003","20.733","0.004","18.38","0.004","90","","109.077","0.004","90","","5469.9","1.9","100.15","","100.15","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C66 H55 B I N O2 P2 Pd -","- C66 H55 B I N O2 P2 Pd -","- C264 H220 B4 I4 N4 O8 P8 Pd4 -","4","1","","Schuhknecht, Danny; Ritter, Florian; Tauchert, Michael E.","Isolation and properties of a palladium PBP pincer complex featuring an ambiphilic boryl site.","Chemical communications (Cambridge, England)","2016","52","79","11823","11826","10.1039/c6cc07079e","","","0.71073","MoKα","","0.072","0.0454","","","0.0969","0.1079","","","","","","1.013","","","","has coordinates","234540","2020-10-21","18:00:00",""
"7125132","19.042","0.006","9.093","0.003","35.451","0.011","90","","94.657","0.005","90","","6118","3","100","","100","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","RK-53","","- C24 H42 B O6 P Si2 W -","- C24 H42 B O6 P Si2 W -","- C192 H336 B8 O48 P8 Si16 W8 -","8","1","","Kyri, A. W.; Kunzmann, R.; Schnakenburg, G.; Qu, Z.-W.; Grimme, S.; Streubel, R.","Synthesis of a monomolecular anionic FLP complex.","Chemical communications (Cambridge, England)","2016","52","91","13361","13364","10.1039/c6cc07081g","","","0.71073","MoKα","","0.0569","0.0433","","","0.1006","0.1087","","","","","","1.023","","","","has coordinates","234543","2020-10-21","18:00:00",""
"7125133","9.7786","0.0005","9.9521","0.0004","21.9977","0.001","90","","90","","90","","2140.76","0.17","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H23 O6 P Si2 W -","- C14 H23 O6 P Si2 W -","- C56 H92 O24 P4 Si8 W4 -","4","1","","Kyri, A. W.; Kunzmann, R.; Schnakenburg, G.; Qu, Z.-W.; Grimme, S.; Streubel, R.","Synthesis of a monomolecular anionic FLP complex.","Chemical communications (Cambridge, England)","2016","52","91","13361","13364","10.1039/c6cc07081g","","","0.71073","MoKα","","0.0244","0.0221","","","0.0369","0.0376","","","","","","0.886","","","","has coordinates","234543","2020-10-21","18:00:00",""
"7125134","9.52","0.002","13.825","0.003","17.646","0.004","88.713","0.004","88.594","0.004","79.932","0.004","2285.6","0.9","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H24 B10 -","- C22 H24 B10 -","- C88 H96 B40 -","4","2","","Tu, Deshuang; Leong, Pakkin; Li, Zhihong; Hu, Rongrong; Shi, Chao; Zhang, Kenneth Yin; Yan, Hong; Zhao, Qiang","A carborane-triggered metastable charge transfer state leading to spontaneous recovery of mechanochromic luminescence.","Chemical communications (Cambridge, England)","2016","52","84","12494","12497","10.1039/c6cc07093k","","","0.71073","MoKα","","0.2062","0.0839","","","0.1393","0.1603","","","","","","1.141","","","","has coordinates","234545","2020-10-21","18:00:00",""
"7125135","7.684","0.003","23.434","0.007","12.637","0.004","90","","94.433","0.006","90","","2268.7","1.3","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 B10 -","- C23 H26 B10 -","- C92 H104 B40 -","4","1","","Tu, Deshuang; Leong, Pakkin; Li, Zhihong; Hu, Rongrong; Shi, Chao; Zhang, Kenneth Yin; Yan, Hong; Zhao, Qiang","A carborane-triggered metastable charge transfer state leading to spontaneous recovery of mechanochromic luminescence.","Chemical communications (Cambridge, England)","2016","52","84","12494","12497","10.1039/c6cc07093k","","","0.71073","MoKα","","0.0982","0.0496","","","0.1188","0.1442","","","","","","1.008","","","","has coordinates","234545","2020-10-21","18:00:00",""
"7125136","15.683","0.003","13.493","0.002","11.675","0.002","90","","108.429","0.003","90","","2343.9","0.7","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C H B -","- C1.33333 H1.50725 B0.57971 -","- C92 H104 B40 -","69","17.25","","Tu, Deshuang; Leong, Pakkin; Li, Zhihong; Hu, Rongrong; Shi, Chao; Zhang, Kenneth Yin; Yan, Hong; Zhao, Qiang","A carborane-triggered metastable charge transfer state leading to spontaneous recovery of mechanochromic luminescence.","Chemical communications (Cambridge, England)","2016","52","84","12494","12497","10.1039/c6cc07093k","","","0.71073","MoKα","","0.106","0.0742","","","0.1968","0.2357","","","","","","1.063","","","","has coordinates","234545","2020-10-21","18:00:00",""
"7125137","6.3385","0.0016","15.072","0.004","20.735","0.006","90","","90","","90","","1980.9","0.9","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H15 Cl O4 -","- C25 H15 Cl O4 -","- C100 H60 Cl4 O16 -","4","1","","Liu, Yang; Li, Jiangtao; Ye, Xinyi; Zhao, Xiaowei; Jiang, Zhiyong","Organocatalytic asymmetric formal arylation of benzofuran-2(3H)-ones with cooperative visible light photocatalysis.","Chemical communications (Cambridge, England)","2016","52","97","13955","13958","10.1039/c6cc07105h","","","0.71073","MoKα","","0.115","0.0582","","","0.1071","0.1321","","","","","","0.981","","","","has coordinates","234547","2020-10-21","18:00:00",""
"7125138","9.903","0.0006","6.3446","0.0004","16.4435","0.0009","90","","94.703","0.005","90","","1029.68","0.11","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H18 O5 -","- C26 H18 O5 -","- C52 H36 O10 -","2","1","","Liu, Yang; Li, Jiangtao; Ye, Xinyi; Zhao, Xiaowei; Jiang, Zhiyong","Organocatalytic asymmetric formal arylation of benzofuran-2(3H)-ones with cooperative visible light photocatalysis.","Chemical communications (Cambridge, England)","2016","52","97","13955","13958","10.1039/c6cc07105h","","x-ray","1.54184","CuKα","","0.0548","0.0471","","","0.1296","0.1377","","","","","","1.056","","","","has coordinates","234547","2020-10-21","18:00:00",""
"7125139","11.1942","0.0008","6.6554","0.0005","16.7572","0.0013","90","","108.366","0.008","90","","1184.85","0.16","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C31 H20 O4 -","- C31 H20 O4 -","- C62 H40 O8 -","2","1","","Liu, Yang; Li, Jiangtao; Ye, Xinyi; Zhao, Xiaowei; Jiang, Zhiyong","Organocatalytic asymmetric formal arylation of benzofuran-2(3H)-ones with cooperative visible light photocatalysis.","Chemical communications (Cambridge, England)","2016","52","97","13955","13958","10.1039/c6cc07105h","","x-ray","1.54184","CuKα","","0.0538","0.0404","","","0.0921","0.0996","","","","","","1.012","","","","has coordinates","234547","2020-10-21","18:00:00",""
"7125140","20.9974","0.0005","14.9781","0.0004","31.1032","0.0009","90","","94.152","0.003","90","","9756.3","0.5","110.05","0.1","110.05","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C84 H114 Cl3 Ir3 N12 Si3 -","- C84 H114 Cl3 Ir3 N12 Si3 -","- C336 H456 Cl12 Ir12 N48 Si12 -","4","1","","Olaru, Alexandra M.; Burt, Alister; Rayner, Peter J.; Hart, Sam J.; Whitwood, Adrian C.; Green, Gary G. R.; Duckett, Simon B.","Using signal amplification by reversible exchange (SABRE) to hyperpolarise <sup>119</sup>Sn and <sup>29</sup>Si NMR nuclei.","Chemical communications (Cambridge, England)","2016","52","100","14482","14485","10.1039/c6cc07109k","","x-ray","1.54184","CuKα","","0.0494","0.0412","","","0.0993","0.1028","","","","","","1.047","","","","has coordinates","234549","2020-10-21","18:00:00",""
"7125141","27.98535","0.00015","27.98535","0.00015","27.98535","0.00015","90","","90","","90","","21917.6","0.2","110.05","0.1","110.05","0.1","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C89.42 H141.68 Cl3 Ir3 N12 O5.42 Si3 -","- C89.416 H141.664 Cl3 Ir3 N12 O5.416 Si3 -","- C715.328 H1133.31 Cl24 Ir24 N96 O43.328 Si24 -","8","0.333333","","Olaru, Alexandra M.; Burt, Alister; Rayner, Peter J.; Hart, Sam J.; Whitwood, Adrian C.; Green, Gary G. R.; Duckett, Simon B.","Using signal amplification by reversible exchange (SABRE) to hyperpolarise <sup>119</sup>Sn and <sup>29</sup>Si NMR nuclei.","Chemical communications (Cambridge, England)","2016","52","100","14482","14485","10.1039/c6cc07109k","","x-ray","0.71073","MoKα","","0.0828","0.0439","","","0.0895","0.1136","","","","","","1.26","","","","has coordinates,has disorder","234549","2020-10-21","18:00:00",""
"7125142","11.8899","0.001","39.592","0.004","9.1681","0.0007","90","","94.087","0.007","90","","4304.9","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 O2 Si -","- C22 H30 O2 Si -","- C176 H240 O16 Si8 -","8","2","","Akram, Manjur O.; Bera, Saibal; Patil, Nitin T.","A facile strategy for accessing 3-alkynylchromones through gold-catalyzed alkynylation/cyclization of o-hydroxyarylenaminones.","Chemical communications (Cambridge, England)","2016","52","83","12306","12309","10.1039/c6cc07119h","","","0.71073","MoKα","","0.1597","0.1035","","","0.2964","0.3476","","","","","","1.076","","","","has coordinates","234552","2020-10-21","18:00:00",""
"7125143","23.4756","0.0005","12.4761","0.0003","7.29758","0.00016","90","","97.067","0.002","90","","2121.11","0.08","292.78","0.1","292.78","0.1","","","","","","","","6","C 1 2/m 1","-C 2y","12","MnBrCO3dppz","MnBrCO3dppz","","- C10.5 H6 Br0.5 Mn0.5 N2 O2 -","- C10.5 H5 Br0.5 Mn0.5 N2 O1.5 -","- C84 H40 Br4 Mn4 N16 O12 -","8","1","","Coogan, M. P.; Platts, J. A.","Blue rhenium tricarbonyl DPPZ complexes - low energy charge-transfer absorption at tissue-penetrating wavelengths.","Chemical communications (Cambridge, England)","2016","52","84","12498","12501","10.1039/c6cc07125b","","x-ray","1.54184","CuKα","","0.0304","0.0268","","","0.069","0.0717","","","","","","1.061","","","","has coordinates","234554","2020-10-21","18:00:00",""
"7125144","16.3764","0.0007","16.3764","","4.1533","0.0005","90","","90","","90","","1113.86","0.14","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.13329","","1.94","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125145","16.2024","0.0008","16.2024","","4.004","0.0009","90","","90","","90","","1051.1","0.2","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.13139","","2.16","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125146","16.0383","0.0014","16.0383","","3.8839","0.0017","90","","90","","90","","999","0.4","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.1197","","3.01","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125147","15.9987","0.0015","15.9987","","3.87","0.0021","90","","90","","90","","990.6","0.5","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.07813","","3.18","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125148","15.9908","0.0013","15.9908","","3.8382","0.0022","90","","90","","90","","981.4","0.6","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.15558","","2.82","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125149","15.9014","0.0014","15.9014","","3.784","0.0024","90","","90","","90","","956.8","0.6","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.26072","","2.91","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125150","15.8651","0.0016","15.8651","","3.765","0.0026","90","","90","","90","","947.7","0.7","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.21246","","3.2","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125151","15.7336","0.0018","15.7336","","3.7167","0.0027","90","","90","","90","","920.1","0.7","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.16206","","3.5","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125152","15.7128","0.0016","15.7128","","3.6914","0.0026","90","","90","","90","","911.4","0.6","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.10699","","3.18","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125153","15.6976","0.0015","15.6976","","3.6631","0.0023","90","","90","","90","","902.6","0.6","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","synchrotron","","","","","","","","0.23704","","3.07","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125154","15.6831","0.0015","15.6831","","3.6436","0.0024","90","","90","","90","","896.2","0.6","293","2","293","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","powder diffraction","x-ray","0.41358","Synchrotron","","","","","","","","0.171","","3.09","","","","","","","has coordinates","234556","2020-10-21","18:00:00",""
"7125155","16.4704","0.0006","16.4704","0.0006","4.2345","0.0002","90","","90","","90","","1148.71","0.08","296","2","296","2","","","","","","","","5","P -4 21 m","P -4 2ab","113","IBPSSEt","8-iodo-4-ethyl-4H-bis[1,2,3]diselenazolo[4,5-b:5',4'-e]pyridin-2-yl","","- C7 H5 I N3 Se4 -","- C7 H5 I N3 Se4 -","- C28 H20 I4 N12 Se16 -","4","0.5","","Lekin, Kristina; Ogata, Kazuma; Maclean, Adrian; Mailman, Aaron; Winter, Stephen M.; Assoud, Abdeljalil; Mito, Masaki; Tse, John S.; Desgreniers, Serge; Hirao, Naohisa; Dube, Paul A.; Oakley, Richard T.","Pushing T<sub>C</sub> to 27.5 K in a heavy atom radical ferromagnet.","Chemical communications (Cambridge, England)","2016","52","96","13877","13880","10.1039/c6cc07142b","","","0.71073","MoKα","","0.0974","0.0509","","","0.0711","0.082","","","","","","1.032","","","","has coordinates","234558","2020-10-21","18:00:00",""
"7125156","15.6261","0.0003","15.6261","0.0003","6.58142","0.00014","90","","90","","120","","1391.72","0.05","99.98","0.1","99.98","0.1","","","","","","","","5","P 31","P 31","144","","","","- C19 H18 Br N O4 -","- C19 H18 Br N O4 -","- C57 H54 Br3 N3 O12 -","3","1","","Donslund, Bjarke S.; Jessen, Nicolaj Inunnguaq; Jakobsen, Joakim Bøgelund; Monleón, Alicia; Nielsen, Rune Pagh; Jørgensen, Karl Anker","Enantioselective formation of cyclopropane spiroindenes from benzofulvenes by phase transfer catalysis.","Chemical communications (Cambridge, England)","2016","52","84","12474","12477","10.1039/c6cc07170h","","x-ray","0.71073","MoKα","","0.0374","0.0292","","","0.0491","0.0517","","","","","","1.05","","","","has coordinates","234560","2020-10-21","18:00:00",""
"7125157","21.3422","0.0002","9.8659","0.0001","19.6135","0.0002","90","","103.086","0.001","90","","4022.57","0.07","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H60 K2 N2 O3 -","- C44 H60 K2 N2 O3 -","- C176 H240 K8 N8 O12 -","4","1","","Fuentes, M Ángeles; Martínez-Martínez, Antonio J; Kennedy, Alan R.; Mulvey, Robert E.","Revealing the remarkable structural diversity of the alkali metal transfer agents of the trans-calix[2]benzene[2]pyrrolide ligand.","Chemical communications (Cambridge, England)","2016","52","82","12199","12201","10.1039/c6cc07240b","","","1.54184","CuKα","","0.0466","0.0429","","","0.1134","0.1171","","","","","","1.023","","","","has coordinates,has disorder","234563","2020-10-21","18:00:00",""
"7125158","10.6922","0.0001","15.3289","0.0002","12.9982","0.0002","90","","90.058","0.001","90","","2130.4","0.05","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H68 Li2 N2 O4 -","- C48 H68 Li2 N2 O4 -","- C96 H136 Li4 N4 O8 -","2","0.5","","Fuentes, M Ángeles; Martínez-Martínez, Antonio J; Kennedy, Alan R.; Mulvey, Robert E.","Revealing the remarkable structural diversity of the alkali metal transfer agents of the trans-calix[2]benzene[2]pyrrolide ligand.","Chemical communications (Cambridge, England)","2016","52","82","12199","12201","10.1039/c6cc07240b","","","1.54184","CuKα","","0.0549","0.0522","","","0.1426","0.1456","","","","","","1.029","","","","has coordinates","234563","2020-10-21","18:00:00",""
"7125159","10.30734","0.00017","27.6447","0.0004","14.8943","0.0003","90","","105.588","0.0017","90","","4087.94","0.13","170","2","170","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H60 N2 Na2 O3 -","- C44 H60 N2 Na2 O3 -","- C176 H240 N8 Na8 O12 -","4","1","","Fuentes, M Ángeles; Martínez-Martínez, Antonio J; Kennedy, Alan R.; Mulvey, Robert E.","Revealing the remarkable structural diversity of the alkali metal transfer agents of the trans-calix[2]benzene[2]pyrrolide ligand.","Chemical communications (Cambridge, England)","2016","52","82","12199","12201","10.1039/c6cc07240b","","","1.54184","CuKα","","0.0598","0.0506","","","0.136","0.1448","","","","","","1.045","","","","has coordinates,has disorder","234563","2020-10-21","18:00:00",""
"7125160","10.2275","0.0002","35.0736","0.0006","19.991","0.0003","90","","90.758","0.001","90","","7170.4","0.2","123","2","123","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C40 H52 N2 Na2 O2 -","- C40 H52 N2 Na2 O2 -","- C320 H416 N16 Na16 O16 -","8","2","","Fuentes, M Ángeles; Martínez-Martínez, Antonio J; Kennedy, Alan R.; Mulvey, Robert E.","Revealing the remarkable structural diversity of the alkali metal transfer agents of the trans-calix[2]benzene[2]pyrrolide ligand.","Chemical communications (Cambridge, England)","2016","52","82","12199","12201","10.1039/c6cc07240b","","","1.54184","CuKα","","0.0576","0.0546","","","0.1509","0.1556","","","","","","1.029","","","","has coordinates,has disorder","290444","2024-03-12","09:55:30",""
"7125161","19.8237","0.0003","19.6671","0.0003","32.4878","0.0003","90","","90","","90","","12666.2","0.3","123","2","123","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C128 H144 N8 Na8 -","- C128 H144 N8 Na8 -","- C512 H576 N32 Na32 -","4","0.5","","Fuentes, M Ángeles; Martínez-Martínez, Antonio J; Kennedy, Alan R.; Mulvey, Robert E.","Revealing the remarkable structural diversity of the alkali metal transfer agents of the trans-calix[2]benzene[2]pyrrolide ligand.","Chemical communications (Cambridge, England)","2016","52","82","12199","12201","10.1039/c6cc07240b","","","1.54184","CuKα","","0.0626","0.0526","","","0.14","0.1484","","","","","","1.033","","","","has coordinates,has disorder","234563","2020-10-21","18:00:00",""
"7125162","10.4694","0.0002","16.0165","0.0004","20.7659","0.0006","109.148","0.003","102.765","0.002","92.213","0.002","3184.74","0.15","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H88 K4 N4 O2 -","- C72 H88 K4 N4 O2 -","- C144 H176 K8 N8 O4 -","2","1","","Fuentes, M Ángeles; Martínez-Martínez, Antonio J; Kennedy, Alan R.; Mulvey, Robert E.","Revealing the remarkable structural diversity of the alkali metal transfer agents of the trans-calix[2]benzene[2]pyrrolide ligand.","Chemical communications (Cambridge, England)","2016","52","82","12199","12201","10.1039/c6cc07240b","","","1.54184","CuKα","","0.0548","0.0439","","","0.1133","0.1221","","","","","","1.016","","","","has coordinates,has disorder","234563","2020-10-21","18:00:00",""
"7125168","5.7785","0.0012","9.7172","0.0019","14.76","0.003","90","","90","","90","","828.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H8 N2 O -","- C9 H8 N2 O -","- C36 H32 N8 O4 -","4","1","","Tang, Baolei; Zhang, Houyu; Ye, Kaiqi; Zhang, Hongyu; Wang, Yue","Highly efficient blue solid emitters and tautomerization-induced ON/OFF fluorescence switching based on structurally simple 3(5)-phenol-1H-pyrazoles.","Chemical communications (Cambridge, England)","2016","52","89","13128","13131","10.1039/c6cc07300j","","","0.71073","MoKα","","0.0467","0.0348","","","0.0886","0.0943","","","","","","1.024","","","","has coordinates","234570","2020-10-21","18:00:00",""
"7125169","3.7769","0.0005","10.7326","0.0013","19.387","0.003","90","","90","","90","","785.87","0.19","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H7 F N2 O -","- C9 H7 F N2 O -","- C36 H28 F4 N8 O4 -","4","1","","Tang, Baolei; Zhang, Houyu; Ye, Kaiqi; Zhang, Hongyu; Wang, Yue","Highly efficient blue solid emitters and tautomerization-induced ON/OFF fluorescence switching based on structurally simple 3(5)-phenol-1H-pyrazoles.","Chemical communications (Cambridge, England)","2016","52","89","13128","13131","10.1039/c6cc07300j","","","0.71073","MoKα","","0.0724","0.0535","","","0.1112","0.1219","","","","","","1.08","","","","has coordinates","234570","2020-10-21","18:00:00",""
"7125170","5.6704","0.0011","10.076","0.002","16.296","0.003","90","","90","","90","","931.1","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H10 N2 O2 -","- C10 H10 N2 O2 -","- C40 H40 N8 O8 -","4","1","","Tang, Baolei; Zhang, Houyu; Ye, Kaiqi; Zhang, Hongyu; Wang, Yue","Highly efficient blue solid emitters and tautomerization-induced ON/OFF fluorescence switching based on structurally simple 3(5)-phenol-1H-pyrazoles.","Chemical communications (Cambridge, England)","2016","52","89","13128","13131","10.1039/c6cc07300j","","","0.71073","MoKα","","0.0432","0.0349","","","0.0917","0.0959","","","","","","0.917","","","","has coordinates","234570","2020-10-21","18:00:00",""
"7125171","7.769","0.0016","11.243","0.002","10.244","0.002","90","","100.15","0.03","90","","880.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N2 O -","- C10 H10 N2 O -","- C40 H40 N8 O4 -","4","1","","Tang, Baolei; Zhang, Houyu; Ye, Kaiqi; Zhang, Hongyu; Wang, Yue","Highly efficient blue solid emitters and tautomerization-induced ON/OFF fluorescence switching based on structurally simple 3(5)-phenol-1H-pyrazoles.","Chemical communications (Cambridge, England)","2016","52","89","13128","13131","10.1039/c6cc07300j","","","0.71073","MoKα","","0.0652","0.051","","","0.1441","0.1489","","","","","","1.082","","","","has coordinates","234570","2020-10-21","18:00:00",""
"7125172","6.4559","0.0004","12.3783","0.0006","22.5131","0.0013","90","","90","","90","","1799.09","0.18","173","","173","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H24 O P2 S2 -","- C14 H24 O P2 S2 -","- C56 H96 O4 P8 S8 -","4","1","","Arisawa, Mieko; Yamada, Tomoki; Tanii, Saori; Kawada, Yuta; Hashimoto, Hisako; Yamaguchi, Masahiko","Rhodium-catalyzed P-P bond exchange reaction of diphosphine disulfides.","Chemical communications (Cambridge, England)","2016","52","93","13580","13583","10.1039/c6cc07302f","","","0.71075","MoKα","","0.1078","0.0606","","","0.1067","0.1536","","","","","","1.061","","","","has coordinates","234572","2020-10-21","18:00:00",""
"7125173","9.3474","0.0007","7.1672","0.0004","13.3103","0.0008","90","","101.49","0.002","90","","873.85","0.1","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 P2 S2 -","- C16 H20 P2 S2 -","- C32 H40 P4 S4 -","2","0.5","","Arisawa, Mieko; Yamada, Tomoki; Tanii, Saori; Kawada, Yuta; Hashimoto, Hisako; Yamaguchi, Masahiko","Rhodium-catalyzed P-P bond exchange reaction of diphosphine disulfides.","Chemical communications (Cambridge, England)","2016","52","93","13580","13583","10.1039/c6cc07302f","","","0.71075","MoKα","","0.0498","0.0391","","","0.0964","0.1213","","","","","","1.268","","","","has coordinates","234572","2020-10-21","18:00:00",""
"7125174","9.1542","0.0014","16.965","0.0015","10.682","0.002","90","","90","","90","","1658.9","0.4","173","","173","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H18 P2 S2 -","- C15 H18 P2 S2 -","- C60 H72 P8 S8 -","4","0.5","","Arisawa, Mieko; Yamada, Tomoki; Tanii, Saori; Kawada, Yuta; Hashimoto, Hisako; Yamaguchi, Masahiko","Rhodium-catalyzed P-P bond exchange reaction of diphosphine disulfides.","Chemical communications (Cambridge, England)","2016","52","93","13580","13583","10.1039/c6cc07302f","","","0.71075","MoKα","","0.2095","0.1403","","","0.3766","0.4216","","","","","","1.31","","","","has coordinates,has disorder","234572","2020-10-21","18:00:00",""
"7125175","12.7728","0.0005","8.2427","0.0003","14.1842","0.0006","90","","103.024","0.004","90","","1454.93","0.1","150.01","0.1","150.01","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H24 O2 -","- C17 H24 O2 -","- C68 H96 O8 -","4","1","","Plesniak, Mateusz P.; Just-Baringo, Xavier; Ortu, Fabrizio; Mills, David P.; Procter, David J.","SmCp<sup>R</sup><sub>2</sub>-mediated cross-coupling of allyl and propargyl ethers with ketoesters and a telescoped approach to complex cycloheptanols.","Chemical communications (Cambridge, England)","2016","52","92","13503","13506","10.1039/c6cc07318b","","x-ray","0.71073","MoKα","","0.0661","0.0473","","","0.1088","0.122","","","","","","1.038","","","","has coordinates","234575","2020-10-21","18:00:00",""
"7125176","8.9679","0.0013","11.9038","0.0016","14.801","0.002","91.758","0.011","94.311","0.012","110.931","0.013","1468.8","0.4","150.01","0.11","150.01","0.11","","","","","","","","3","P -1","-P 1","2","","","","- C17 H22 O2 -","- C17 H22 O2 -","- C68 H88 O8 -","4","2","","Plesniak, Mateusz P.; Just-Baringo, Xavier; Ortu, Fabrizio; Mills, David P.; Procter, David J.","SmCp<sup>R</sup><sub>2</sub>-mediated cross-coupling of allyl and propargyl ethers with ketoesters and a telescoped approach to complex cycloheptanols.","Chemical communications (Cambridge, England)","2016","52","92","13503","13506","10.1039/c6cc07318b","","x-ray","0.71073","MoKα","","0.1904","0.0816","","","0.1566","0.2048","","","","","","1.027","","","","has coordinates,has disorder","234575","2020-10-21","18:00:00",""
"7125177","11.6326","0.0006","13.777","0.0007","21.1559","0.0014","90","","90","","90","","3390.5","0.3","150.02","0.1","150.02","0.1","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C27 H51 O Si4 Sm -","- C27 H51 O Si4 Sm -","- C108 H204 O4 Si16 Sm4 -","4","0.5","","Plesniak, Mateusz P.; Just-Baringo, Xavier; Ortu, Fabrizio; Mills, David P.; Procter, David J.","SmCp<sup>R</sup><sub>2</sub>-mediated cross-coupling of allyl and propargyl ethers with ketoesters and a telescoped approach to complex cycloheptanols.","Chemical communications (Cambridge, England)","2016","52","92","13503","13506","10.1039/c6cc07318b","","x-ray","0.71073","MoKα","","0.0673","0.053","","","0.0976","0.105","","","","","","1.059","","","","has coordinates,has disorder","234575","2020-10-21","18:00:00",""
"7125178","11.287","0.0003","22.3415","0.0007","16.921","0.0005","90","","97.974","0.003","90","","4225.7","0.2","150.01","0.13","150.01","0.13","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H66 O Si6 Sm -","- C32 H66 O Si6 Sm -","- C128 H264 O4 Si24 Sm4 -","4","1","","Plesniak, Mateusz P.; Just-Baringo, Xavier; Ortu, Fabrizio; Mills, David P.; Procter, David J.","SmCp<sup>R</sup><sub>2</sub>-mediated cross-coupling of allyl and propargyl ethers with ketoesters and a telescoped approach to complex cycloheptanols.","Chemical communications (Cambridge, England)","2016","52","92","13503","13506","10.1039/c6cc07318b","","","0.71073","MoKα","","0.0633","0.0438","","","0.0846","0.0918","","","","","","1.043","","","","has coordinates","234575","2020-10-21","18:00:00",""
"7125179","13.1871","0.0002","13.1871","0.0002","11.4268","0.0004","90","","90","","90","","1987.12","0.08","150.03","0.1","150.03","0.1","","","","","","","","5","I -4","I -4","82","","","","- C44 H50 O2 Si2 Sm -","- C44 H50 O2 Si2 Sm -","- C88 H100 O4 Si4 Sm2 -","2","0.25","","Plesniak, Mateusz P.; Just-Baringo, Xavier; Ortu, Fabrizio; Mills, David P.; Procter, David J.","SmCp<sup>R</sup><sub>2</sub>-mediated cross-coupling of allyl and propargyl ethers with ketoesters and a telescoped approach to complex cycloheptanols.","Chemical communications (Cambridge, England)","2016","52","92","13503","13506","10.1039/c6cc07318b","","x-ray","0.71073","MoKα","","0.0729","0.0729","","","0.1842","0.1842","","","","","","1.101","","","","has coordinates,has disorder","234575","2020-10-21","18:00:00",""
"7125180","17.123","0.0006","9.6421","0.0003","27.6291","0.0011","90","","99.283","0.004","90","","4501.9","0.3","120","3","120","3","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C54 H54 O2 Si2 Sm -","- C54 H54 O2 Si2 Sm -","- C216 H216 O8 Si8 Sm4 -","4","1","","Plesniak, Mateusz P.; Just-Baringo, Xavier; Ortu, Fabrizio; Mills, David P.; Procter, David J.","SmCp<sup>R</sup><sub>2</sub>-mediated cross-coupling of allyl and propargyl ethers with ketoesters and a telescoped approach to complex cycloheptanols.","Chemical communications (Cambridge, England)","2016","52","92","13503","13506","10.1039/c6cc07318b","","x-ray","0.71073","MoKα","","0.0726","0.0624","","","0.1514","0.1586","","","","","","1.081","","","","has coordinates","234575","2020-10-21","18:00:00",""
"7125181","12.0223","0.0003","15.7744","0.0004","15.908","0.0004","61.685","0.002","76.21","0.002","82.022","0.002","2578.18","0.12","200","1","200","1","","","","","","","","4","P 1","P 1","1","","","","- C48 H75 N3 O9 -","- C48 H75 N3 O9 -","- C96 H150 N6 O18 -","2","2","","Caumes, Xavier; Baldi, Arianna; Gontard, Geoffrey; Brocorens, Patrick; Lazzaroni, Roberto; Vanthuyne, Nicolas; Troufflard, Claire; Raynal, Matthieu; Bouteiller, Laurent","Tuning the structure of 1,3,5-benzene tricarboxamide self-assemblies through stereochemistry.","Chemical communications (Cambridge, England)","2016","52","91","13369","13372","10.1039/c6cc07325e","","","1.54178","CuKα","","0.0478","0.0411","","","0.1074","0.1127","","","","","","1.024","","","","has coordinates","234578","2020-10-21","18:00:00",""
"7125182","11.5502","0.0004","15.7414","0.0005","15.8302","0.0005","61.491","0.002","83.352","0.002","79.502","0.002","2485.47","0.15","200","1","200","1","","","","","","","","4","P 1","P 1","1","","","","- C45.5 H70.75 N3.25 O9.5 -","- C45.5 H70.75 N3.25 O9.5 -","- C91 H141.5 N6.5 O19 -","2","2","","Caumes, Xavier; Baldi, Arianna; Gontard, Geoffrey; Brocorens, Patrick; Lazzaroni, Roberto; Vanthuyne, Nicolas; Troufflard, Claire; Raynal, Matthieu; Bouteiller, Laurent","Tuning the structure of 1,3,5-benzene tricarboxamide self-assemblies through stereochemistry.","Chemical communications (Cambridge, England)","2016","52","91","13369","13372","10.1039/c6cc07325e","","","1.54178","CuKα","","0.0446","0.0436","","","0.1219","0.1234","","","","","","1.047","","","","has coordinates,has disorder","234578","2020-10-21","18:00:00",""
"7125183","17.6253","0.0007","13.6069","0.0005","24.0534","0.0007","90","","101.343","0.002","90","","5655.9","0.3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H44 Mo4 N22 Ni S2 -","- C62 H44 Mo4 N22 Ni S2 -","- C248 H176 Mo16 N88 Ni4 S8 -","4","0.5","","Hung, Wei-Chieh; Sigrist, Marc; Hua, Shao-An; Wu, Lai-Chin; Liu, Tsai-Jung; Jin, Bih-Yaw; Lee, Gene-Hsiang; Peng, Shie-Ming","A heteropentanuclear metal string complex [Mo<sub>2</sub>NiMo<sub>2</sub>(tpda)<sub>4</sub>(NCS)<sub>2</sub>] with two linearly aligned quadruply bonded Mo<sub>2</sub> units connected by a Ni ion and a meso configuration of the complex.","Chemical communications (Cambridge, England)","2016","52","83","12380","12382","10.1039/c6cc07364f","","","0.71073","MoKα","","0.0887","0.0484","","","0.1184","0.1346","","","","","","1.013","","","","has coordinates","234580","2020-10-21","18:00:00",""
"7125184","12.769","0.002","13.1625","0.0014","20.932","0.003","76.406","0.01","80.735","0.012","63.678","0.009","3058.5","0.8","150","2","150","","","","","","","","","5","P -1","-P 1","2","","","","- C59 H88 N5 O Sm -","- C59 H88 N5 O Sm -","- C118 H176 N10 O2 Sm2 -","2","1","","Schoo, Christoph; Bestgen, Sebastian; Schmidt, Monika; Konchenko, Sergey N.; Scheer, Manfred; Roesky, Peter W.","Sterically induced reductive linkage of iron polypnictides with bulky lanthanide complexes by ring-opening of THF.","Chemical communications (Cambridge, England)","2016","52","90","13217","13220","10.1039/c6cc07367k","","","0.71073","MoKα","","0.0652","0.0397","","","0.0689","0.0734","","","","","","0.832","","","","has coordinates","234583","2020-10-21","18:00:00",""
"7125185","13.1985","0.001","20.5277","0.0009","24.6698","0.0012","108.733","0.004","93.697","0.005","93.654","0.005","6291.4","0.7","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C125 H187 As5 Fe N8 O2 Sm2 -","- C125 H187 As5 Fe N8 O2 Sm2 -","- C250 H374 As10 Fe2 N16 O4 Sm4 -","2","1","","Schoo, Christoph; Bestgen, Sebastian; Schmidt, Monika; Konchenko, Sergey N.; Scheer, Manfred; Roesky, Peter W.","Sterically induced reductive linkage of iron polypnictides with bulky lanthanide complexes by ring-opening of THF.","Chemical communications (Cambridge, England)","2016","52","90","13217","13220","10.1039/c6cc07367k","","","0.71073","MoKα","","0.0835","0.0381","","","0.0621","0.0709","","","","","","0.86","","","","has coordinates","234583","2020-10-21","18:00:00",""
"7125186","13.12","0.003","20.386","0.004","24.637","0.005","109.26","0.03","93.54","0.03","93.97","0.03","6181","3","110","2","110","","","","","","","","","7","P -1","-P 1","2","","","","- C125 H187 Fe N8 O2 P5 Sm2 -","- C125 H187 Fe N8 O2 P5 Sm2 -","- C250 H374 Fe2 N16 O4 P10 Sm4 -","2","1","","Schoo, Christoph; Bestgen, Sebastian; Schmidt, Monika; Konchenko, Sergey N.; Scheer, Manfred; Roesky, Peter W.","Sterically induced reductive linkage of iron polypnictides with bulky lanthanide complexes by ring-opening of THF.","Chemical communications (Cambridge, England)","2016","52","90","13217","13220","10.1039/c6cc07367k","","","0.71073","MoKα","","0.0555","0.0344","","","0.0662","0.0702","","","","","","0.85","","","","has coordinates","234583","2020-10-21","18:00:00",""
"7125187","28.8213","0.0016","3.9568","0.0002","22.0852","0.0014","90","","101.2","0.003","90","","2470.6","0.2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 Br4 N2 -","- C30 H16 Br4 N2 -","- C120 H64 Br16 N8 -","4","0.5","","Colin-Molina, Abraham; Pérez-Estrada, Salvador; Roa, Arian E.; Villagrana-Garcia, Alvin; Hernández-Ortega, Simón; Rodríguez, Mario; Brown, Stuart E.; Rodríguez-Molina, Braulio","Isotropic rotation in amphidynamic crystals of stacked carbazole-based rotors featuring halogen-bonded stators.","Chemical communications (Cambridge, England)","2016","52","87","12833","12836","10.1039/c6cc07379d","","","0.71073","MoKα","","0.0792","0.0415","","","0.0774","0.0887","","","","","","0.992","","","","has coordinates","234585","2020-10-21","18:00:00",""
"7125188","28.561","0.003","3.8983","0.0004","22.009","0.002","90","","100.956","0.002","90","","2405.8","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 Br4 N2 -","- C30 H16 Br4 N2 -","- C120 H64 Br16 N8 -","4","0.5","","Colin-Molina, Abraham; Pérez-Estrada, Salvador; Roa, Arian E.; Villagrana-Garcia, Alvin; Hernández-Ortega, Simón; Rodríguez, Mario; Brown, Stuart E.; Rodríguez-Molina, Braulio","Isotropic rotation in amphidynamic crystals of stacked carbazole-based rotors featuring halogen-bonded stators.","Chemical communications (Cambridge, England)","2016","52","87","12833","12836","10.1039/c6cc07379d","","","0.71073","MoKα","","0.0489","0.0334","","","0.0596","0.0641","","","","","","0.976","","","","has coordinates","234585","2020-10-21","18:00:00",""
"7125189","28.6436","0.0014","3.9085","0.0002","22.0408","0.001","90","","101.063","0.0014","90","","2421.7","0.2","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 Br4 N2 -","- C30 H16 Br4 N2 -","- C120 H64 Br16 N8 -","4","0.5","","Colin-Molina, Abraham; Pérez-Estrada, Salvador; Roa, Arian E.; Villagrana-Garcia, Alvin; Hernández-Ortega, Simón; Rodríguez, Mario; Brown, Stuart E.; Rodríguez-Molina, Braulio","Isotropic rotation in amphidynamic crystals of stacked carbazole-based rotors featuring halogen-bonded stators.","Chemical communications (Cambridge, England)","2016","52","87","12833","12836","10.1039/c6cc07379d","","","0.71073","MoKα","","0.0835","0.058","","","0.0926","0.1018","","","","","","1.252","","","","has coordinates","234585","2020-10-21","18:00:00",""
"7125190","28.6762","0.001","3.9157","0.0001","22.0307","0.0007","90","","101.079","0.0011","90","","2427.67","0.13","209","2","209","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 Br4 N2 -","- C30 H16 Br4 N2 -","- C120 H64 Br16 N8 -","4","0.5","","Colin-Molina, Abraham; Pérez-Estrada, Salvador; Roa, Arian E.; Villagrana-Garcia, Alvin; Hernández-Ortega, Simón; Rodríguez, Mario; Brown, Stuart E.; Rodríguez-Molina, Braulio","Isotropic rotation in amphidynamic crystals of stacked carbazole-based rotors featuring halogen-bonded stators.","Chemical communications (Cambridge, England)","2016","52","87","12833","12836","10.1039/c6cc07379d","","","0.71073","MoKα","","0.0638","0.0438","","","0.0851","0.0971","","","","","","1.137","","","","has coordinates","234585","2020-10-21","18:00:00",""
"7125191","28.708","0.0013","3.9259","0.0002","22.0256","0.001","90","","101.117","0.0015","90","","2435.8","0.2","240","2","240","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 Br4 N2 -","- C30 H16 Br4 N2 -","- C120 H64 Br16 N8 -","4","0.5","","Colin-Molina, Abraham; Pérez-Estrada, Salvador; Roa, Arian E.; Villagrana-Garcia, Alvin; Hernández-Ortega, Simón; Rodríguez, Mario; Brown, Stuart E.; Rodríguez-Molina, Braulio","Isotropic rotation in amphidynamic crystals of stacked carbazole-based rotors featuring halogen-bonded stators.","Chemical communications (Cambridge, England)","2016","52","87","12833","12836","10.1039/c6cc07379d","","","0.71073","MoKα","","0.0717","0.0491","","","0.0953","0.1074","","","","","","1.134","","","","has coordinates","234585","2020-10-21","18:00:00",""
"7125192","28.7391","0.0014","3.9377","0.0002","22.0251","0.001","90","","101.118","0.0015","90","","2445.7","0.2","269","2","269","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 Br4 N2 -","- C30 H16 Br4 N2 -","- C120 H64 Br16 N8 -","4","0.5","","Colin-Molina, Abraham; Pérez-Estrada, Salvador; Roa, Arian E.; Villagrana-Garcia, Alvin; Hernández-Ortega, Simón; Rodríguez, Mario; Brown, Stuart E.; Rodríguez-Molina, Braulio","Isotropic rotation in amphidynamic crystals of stacked carbazole-based rotors featuring halogen-bonded stators.","Chemical communications (Cambridge, England)","2016","52","87","12833","12836","10.1039/c6cc07379d","","","0.71073","MoKα","","0.093","0.0579","","","0.1097","0.1269","","","","","","1.098","","","","has coordinates","234585","2020-10-21","18:00:00",""
"7125193","21.381","0.008","12.571","0.004","16.69","0.006","90","","117.251","0.008","90","","3988","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H18 F3 N3 -","- C25 H18 F3 N3 -","- C200 H144 F24 N24 -","8","1","","Yu, Liu-Zhu; Wei, Yin; Shi, Min","Copper-catalyzed cascade cyclization of 1,5-enynes via consecutive trifluoromethylazidation/diazidation and click reaction: self-assembly of triazole fused isoindolines.","Chemical communications (Cambridge, England)","2016","52","89","13163","13166","10.1039/c6cc07394h","","","0.71073","MoKα","","0.0823","0.0516","","","0.125","0.1386","","","","","","1.046","","","","has coordinates","234587","2020-10-21","18:00:00",""
"7125194","8.1858","0.001","10.1508","0.0013","22.15","0.003","89.88","0.003","83.44","0.003","78.898","0.003","1793.9","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H32 N12 -","- C44 H32 N12 -","- C88 H64 N24 -","2","1","","Yu, Liu-Zhu; Wei, Yin; Shi, Min","Copper-catalyzed cascade cyclization of 1,5-enynes via consecutive trifluoromethylazidation/diazidation and click reaction: self-assembly of triazole fused isoindolines.","Chemical communications (Cambridge, England)","2016","52","89","13163","13166","10.1039/c6cc07394h","","","0.71073","MoKα","","0.1086","0.0622","","","0.1446","0.172","","","","","","0.983","","","","has coordinates","234587","2020-10-21","18:00:00",""
"7125195","12.4144","0.0003","17.9604","0.0004","33.3206","0.0006","97.426","0.002","96.076","0.002","105.19","0.002","7033.5","0.3","100","1","100","1","","","","","","","","5","P -1","-P 1","2","[PdCl2{Bn-tzl-HPB(tBu)5}2]","Dichlorobis(3-benzyl-5-[4-{2,3,4,5,6-penta(4-tert-butylphenyl)phenyl}phenyl]-1,2,3-triazole)palladium(II) hepta(dichloromethane) solvate","","- C149 H168 Cl16 N6 Pd -","- C149 H168 Cl16 N6 Pd -","- C298 H336 Cl32 N12 Pd2 -","2","1","","Wright, James R.; Crowley, James D.; Lucas, Nigel T.","Carbon-rich ""Click"" 1,2,3-triazoles: hexaphenylbenzene and hexa-peri-hexabenzocoronene-based ligands for Suzuki-Miyaura catalysts.","Chemical communications (Cambridge, England)","2016","52","88","12976","12979","10.1039/c6cc07413h","","","1.54184","CuKα","","0.1214","0.1102","","","0.2992","0.31","","","","","","1.049","","","","has coordinates","234589","2020-10-21","18:00:00",""
"7125196","22.053","0.0006","39.391","0.003","14.3467","0.0006","90","","99.711","0.003","90","","12284.3","1.1","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[PdCl2{Bn-tzl-HBC(tBu)5}2]","Dichlorobis(1-benzyl-4-[5,8,11,14,17-penta(tert-butyl)-2-hexa-peri-hexabenzocoronenyl]-1,2,3-triazole)palladium(II)","","- C142 H130 Cl2 N6 Pd -","- C142 H130 Cl2 N6 Pd -","- C568 H520 Cl8 N24 Pd4 -","4","1","","Wright, James R.; Crowley, James D.; Lucas, Nigel T.","Carbon-rich ""Click"" 1,2,3-triazoles: hexaphenylbenzene and hexa-peri-hexabenzocoronene-based ligands for Suzuki-Miyaura catalysts.","Chemical communications (Cambridge, England)","2016","52","88","12976","12979","10.1039/c6cc07413h","","","1.54184","CuKα","","0.1571","0.0795","","","0.168","0.2007","","","","","","0.89","","","","has coordinates","234589","2020-10-21","18:00:00",""
"7125197","14.6518","0.0002","16.6609","0.0002","33.4649","0.0004","97.604","0.001","92.496","0.001","92.487","0.001","8079.7","0.18","100","1","100","1","","","","","","","","5","P -1","-P 1","2","[PdBr2(iPr2-bimy){Bn-tzl-HBC(tBu5)}]","Dibromo(1,3-diisopropylbenzimidazol-2-ylidene){1-benzyl-4-(5,8,11,14,17-penta-tert-butylhexa-peri-hexabenzocoronenyl)-1H-1,2,3-triazole}palladium(II)","","- C168 H166 Br4 N10 Pd2 -","- C168 H166 Br4 N10 Pd2 -","- C336 H332 Br8 N20 Pd4 -","2","1","","Wright, James R.; Crowley, James D.; Lucas, Nigel T.","Carbon-rich ""Click"" 1,2,3-triazoles: hexaphenylbenzene and hexa-peri-hexabenzocoronene-based ligands for Suzuki-Miyaura catalysts.","Chemical communications (Cambridge, England)","2016","52","88","12976","12979","10.1039/c6cc07413h","","","1.54184","CuKα","","0.0565","0.0478","","","0.1217","0.1268","","","","","","1.039","","","","has coordinates,has disorder","234589","2020-10-21","18:00:00",""
"7125198","12.0143","0.0003","8.3594","0.0002","19.0526","0.0005","90","","90.316","0.002","90","","1913.47","0.08","104","4","104","4","","","","","","","synthesis","3","P 1 21/c 1","-P 2ybc","14","8ah","rac-(4S,5aS,10bS)-5-benzyl-4-(tert-butyl)-1,2,4,5,5a,6-hexahydropyrrolo[3',2':3,4]pyrrolo[2,3-b]indole","","- C23 H27 N3 -","- C23 H27 N3 -","- C92 H108 N12 -","4","1","","Saya, Jordy M.; Oppelaar, Barry; Cioc, Răzvan C; van der Heijden, Gydo; Vande Velde, Christophe M. L.; Orru, Romano V. A.; Ruijter, Eelco","Synthesis of polycyclic spiroindolines by highly diastereoselective interrupted Ugi cascade reactions of 3-(2-isocyanoethyl)indoles.","Chemical communications (Cambridge, England)","2016","52","84","12482","12485","10.1039/c6cc07459f","","x-ray","1.54184","CuKα","","0.0637","0.0553","","","0.148","0.166","","","","","","1.035","","","","has coordinates","234591","2020-10-21","18:00:00",""
"7125199","7.0179","0.0003","13.5605","0.0006","14.8661","0.0007","90","","96.427","0.002","90","","1405.86","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Li([12]crown-4)OTf]","","- C9 H16 F3 Li O7 S -","- C9 H16 F3 Li O7 S -","- C36 H64 F12 Li4 O28 S4 -","4","1","","Reuter, Kirsten; Thiele, Günther; Hafner, Thomas; Uhlig, Frank; von Hänisch, Carsten","Synthesis and coordination ability of a partially silicon based crown ether.","Chemical communications (Cambridge, England)","2016","52","90","13265","13268","10.1039/c6cc07520g","","","0.71073","MoKα","","0.0296","0.0259","","","0.0646","0.0663","","","","","","1.087","","","","has coordinates,has disorder","234595","2020-10-21","18:00:00",""
"7125200","14.6745","0.0007","24.0048","0.0011","32.5952","0.0014","90","","90","","90","","11481.9","0.9","100","2","100","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C14 H34 Cl2 F3 Li O7 S Si4 -","- C14 H34 Cl2 F3 Li O7 S Si4 -","- C224 H544 Cl32 F48 Li16 O112 S16 Si64 -","16","2","","Reuter, Kirsten; Thiele, Günther; Hafner, Thomas; Uhlig, Frank; von Hänisch, Carsten","Synthesis and coordination ability of a partially silicon based crown ether.","Chemical communications (Cambridge, England)","2016","52","90","13265","13268","10.1039/c6cc07520g","","","0.71073","MoKα","","0.0763","0.0534","","","0.1174","0.1273","","","","","","1.04","","","","has coordinates","234595","2020-10-21","18:00:00",""
"7125201","6.26161","0.00011","25.924","0.0005","8.62429","0.00016","90","","102.226","0.0007","90","","1368.19","0.04","213","","213","","","","","","","","","6","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-(4-chlorophenyl)ethan-1-amine/N,N-diethylformamide","","- C25 H32 Cl N5 O4 S -","- C25 H32 Cl N5 O4 S -","- C50 H64 Cl2 N10 O8 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.0844","0.0739","","","0.1847","0.2054","","","","","","1.07","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125202","5.8245","0.0003","7.5038","0.0004","13.8162","0.0004","94.785","0.003","94.97","0.003","95.755","0.004","595.96","0.05","213","","213","","","","","","","","","5","P -1","-P 1","2","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid","","- C12 H11 N3 O3 S -","- C12 H11 N3 O3 S -","- C24 H22 N6 O6 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.0615","0.056","","","0.1506","0.1549","","","","","","1.072","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125203","5.94757","0.00014","9.5911","0.0002","11.4509","0.0003","83.8975","0.0016","82.015","0.0015","71.9997","0.0015","613.81","0.03","213","","213","","","","","","","","","6","P 1","P 1","1","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-(4-chlorophenyl)ethan-1-amine/N,N-dimethylformamide","","- C23 H28 Cl N5 O4 S -","- C23 H28 Cl N5 O4 S -","- C23 H28 Cl N5 O4 S -","1","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.0964","0.0851","","","0.2281","0.2643","","","","","","1.076","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125204","6.11235","0.00013","28.1898","0.0006","7.71338","0.00017","90","","92.9285","0.0013","90","","1327.33","0.05","213","","213","","","","","","","","","6","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-(4-chlorophenyl)ethan-1-amine/N,N-dimethylacetamide","","- C24 H30 Cl N5 O4 S -","- C24 H30 Cl N5 O4 S -","- C48 H60 Cl2 N10 O8 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.1583","0.1118","","","0.2752","0.3381","","","","","","1.078","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125205","5.99452","0.00011","23.7139","0.0004","9.33438","0.00017","90","","108.528","0.0011","90","","1258.14","0.04","213","","213","","","","","","","","","6","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-(4-chlorophenyl)ethan-1-amine/dimethyl sulfoxide","","- C22 H27 Cl N4 O4 S2 -","- C22 H27 Cl N4 O4 S2 -","- C44 H54 Cl2 N8 O8 S4 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.1164","0.0789","","","0.1667","0.2167","","","","","","1.086","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125206","6.191","0.00011","26.0113","0.0005","8.06978","0.00015","90","","102.689","0.001","90","","1267.79","0.04","213","","213","","","","","","","","","5","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-phenylethan-1-amine/N,N-dimethylacetamide","","- C24 H31 N5 O4 S -","- C24 H31 N5 O4 S -","- C48 H62 N10 O8 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.1153","0.0764","","","0.1583","0.2091","","","","","","1.1","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125207","6.06973","0.00012","23.5497","0.0005","9.2011","0.0002","90","","108.609","0.0012","90","","1246.45","0.05","213","","213","","","","","","","","","5","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-phenylethan-1-amine/dioxane","","- C24 H30 N4 O5 S -","- C24 H30 N4 O5 S -","- C48 H60 N8 O10 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.1195","0.0814","","","0.1545","0.1953","","","","","","0.887","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125208","6.00155","0.00011","26.1427","0.0005","8.40735","0.00015","90","","105.247","0.0009","90","","1272.66","0.04","213","","213","","","","","","","","","6","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-(4-chlorophenyl)ethan-1-amine/dioxane","","- C24 H29 Cl N4 O5 S -","- C24 H29 Cl N4 O5 S -","- C48 H58 Cl2 N8 O10 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.0552","0.0499","","","0.1047","0.1086","","","","","","0.996","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125209","6.21672","0.00011","26.581","0.0005","7.98985","0.00014","90","","99.504","0.0007","90","","1302.17","0.04","213","","213","","","","","","","","","5","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-phenylethan-1-amine/N,N-diethylformamide","","- C25 H33 N5 O4 S -","- C25 H33 N5 O4 S -","- C50 H66 N10 O8 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.062","0.0513","","","0.1175","0.1329","","","","","","1.069","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125210","7.3493","0.0002","6.04446","0.00019","23.3114","0.0006","90","","94.695","0.0017","90","","1032.08","0.05","213","","213","","","","","","","","","6","P 1 21 1","P 2yb","4","","(E)-4-((4-aminophenyl)diazenyl)benzenesulfonic acid/(R)-1-(4-chlorophenyl)ethan-1-amine","","- C20 H21 Cl N4 O3 S -","- C20 H21 Cl N4 O3 S -","- C40 H42 Cl2 N8 O6 S2 -","2","1","","Miyano, Tetsuya; Sakai, Tatsuya; Hisaki, Ichiro; Ichida, Hideki; Kanematsu, Yasuo; Tohnai, Norimitsu","Hierarchical construction of SHG-active polar crystals by using multi-component crystals.","Chemical communications (Cambridge, England)","2016","52","94","13710","13713","10.1039/c6cc07544d","","","1.54187","CuKα","","0.1052","0.0724","","","0.1559","0.2025","","","","","","1.066","","","","has coordinates","234599","2020-10-21","18:00:00",""
"7125211","10.95","0.005","6.53","0.005","13.61","0.005","90","","92.58","0.005","90","","972.2","0.9","100","2","100","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C16 H26 Cu N4 O9 Zn -","- C16 H26 Cu N4 O9 Zn -","- C32 H52 Cu2 N8 O18 Zn2 -","2","0.5","","Albalad, Jorge; Aríñez-Soriano, Javier; Vidal-Gancedo, José; Lloveras, Vega; Juanhuix, Jordi; Imaz, Inhar; Aliaga-Alcalde, Núria; Maspoch, Daniel","Hetero-bimetallic paddlewheel clusters in coordination polymers formed by a water-induced single-crystal-to-single-crystal transformation.","Chemical communications (Cambridge, England)","2016","52","91","13397","13400","10.1039/c6cc07653j","","","0.8266","synchrotronradiation","","0.0404","0.0362","","","0.0986","0.0997","","","","","","1.057","","","","has coordinates","234602","2020-10-21","18:00:00",""
"7125212","11.56","0.005","16.83","0.005","12.92","0.005","90","","110.97","0.03","90","","2347.2","1.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 Cu3 N8 O26 Zn -","- C32 H48 Cu3 N8 O26 Zn -","- C64 H96 Cu6 N16 O52 Zn2 -","2","0.5","","Albalad, Jorge; Aríñez-Soriano, Javier; Vidal-Gancedo, José; Lloveras, Vega; Juanhuix, Jordi; Imaz, Inhar; Aliaga-Alcalde, Núria; Maspoch, Daniel","Hetero-bimetallic paddlewheel clusters in coordination polymers formed by a water-induced single-crystal-to-single-crystal transformation.","Chemical communications (Cambridge, England)","2016","52","91","13397","13400","10.1039/c6cc07653j","","","0.71081","synchrotronradiation","","0.0625","0.0556","","","0.1587","0.1648","","","","","","1.047","","","","has coordinates,has disorder","234602","2020-10-21","18:00:00",""
"7125213","5.8274","0.0002","9.9168","0.0003","23.1227","0.0008","90","","90","","90","","1336.24","0.08","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","VCINA","","","- C12 H14 N2 O7 -","- C12 H14 N2 O7 -","- C48 H56 N8 O28 -","4","1","","Wang, Jian-Rong; Bao, Junjie; Fan, Xiaowu; Dai, Wenjuan; Mei, Xuefeng","pH-Switchable vitamin B<sub>9</sub> gels for stoichiometry-controlled spherical co-crystallization.","Chemical communications (Cambridge, England)","2016","52","92","13452","13455","10.1039/c6cc07701c","","","0.71073","MoKα","","0.0504","0.0337","","","0.0654","0.071","","","","","","1.021","","","","has coordinates","234605","2020-10-21","18:00:00",""
"7125214","8.934","0.0009","5.1587","0.0005","43.225","0.004","90","","93","0.007","90","","1989.4","0.3","100","2","100","2","","","","","","","","4","P 1 2 1","P 2y","3","VCINA2","","","- C18 H20 N4 O8 -","- C18 H20 N4 O8 -","- C72 H80 N16 O32 -","4","2","","Wang, Jian-Rong; Bao, Junjie; Fan, Xiaowu; Dai, Wenjuan; Mei, Xuefeng","pH-Switchable vitamin B<sub>9</sub> gels for stoichiometry-controlled spherical co-crystallization.","Chemical communications (Cambridge, England)","2016","52","92","13452","13455","10.1039/c6cc07701c","","","0.71073","MoKα","","0.082","0.0492","","","0.0815","0.0922","","","","","","1.022","","","","has coordinates","234605","2020-10-21","18:00:00",""
"7125215","5.0886","0.0002","7.2518","0.0003","17.1681","0.0007","93.324","0.003","93.952","0.003","97.338","0.003","625.42","0.04","100","2","100","2","","","","","","","","4","P 1","P 1","1","VCNA","","","- C24 H28 N4 O14 -","- C24 H28 N4 O14 -","- C24 H28 N4 O14 -","1","1","","Wang, Jian-Rong; Bao, Junjie; Fan, Xiaowu; Dai, Wenjuan; Mei, Xuefeng","pH-Switchable vitamin B<sub>9</sub> gels for stoichiometry-controlled spherical co-crystallization.","Chemical communications (Cambridge, England)","2016","52","92","13452","13455","10.1039/c6cc07701c","","","0.71073","MoKα","","0.0812","0.0727","","","0.1927","0.2003","","","","","","1.039","","","","has coordinates","234605","2020-10-21","18:00:00",""
"7125216","5.074","0.002","29.696","0.014","8.498","0.004","90","","103.16","0.03","90","","1246.8","1","296","2","296.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H26 N6 O9 -","- C24 H26 N6 O9 -","- C48 H52 N12 O18 -","2","1","","Wang, Jian-Rong; Bao, Junjie; Fan, Xiaowu; Dai, Wenjuan; Mei, Xuefeng","pH-Switchable vitamin B<sub>9</sub> gels for stoichiometry-controlled spherical co-crystallization.","Chemical communications (Cambridge, England)","2016","52","92","13452","13455","10.1039/c6cc07701c","","","0.71073","MoKα","","0.189","0.0825","","","0.2024","0.2638","","","","","","0.992","","","","has coordinates","234605","2020-10-21","18:00:00",""
"7125217","5.0892","0.0003","7.5329","0.0005","19.7851","0.0012","84.757","0.004","85.752","0.004","81.727","0.004","746.03","0.08","293","2","293","","","","","","","","","4","P 1","P 1","1","","","","- C13 H18 N2 O8 -","- C13 H18 N2 O8 -","- C26 H36 N4 O16 -","2","2","","Wang, Jian-Rong; Bao, Junjie; Fan, Xiaowu; Dai, Wenjuan; Mei, Xuefeng","pH-Switchable vitamin B<sub>9</sub> gels for stoichiometry-controlled spherical co-crystallization.","Chemical communications (Cambridge, England)","2016","52","92","13452","13455","10.1039/c6cc07701c","","","0.71073","MoKα","","0.1119","0.108","","","0.3047","0.3099","","","","","","1.078","","","","has coordinates","234605","2020-10-21","18:00:00",""
"7125218","7.2149","0.0004","12.4451","0.0007","15.6775","0.0008","90","","90","","90","","1407.69","0.13","170","","170","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H7 N2 O3 -","- C7 H7 N2 O3 -","- C56 H56 N16 O24 -","8","1","","Wang, Jian-Rong; Bao, Junjie; Fan, Xiaowu; Dai, Wenjuan; Mei, Xuefeng","pH-Switchable vitamin B<sub>9</sub> gels for stoichiometry-controlled spherical co-crystallization.","Chemical communications (Cambridge, England)","2016","52","92","13452","13455","10.1039/c6cc07701c","","","0.71073","MoKα","","0.0683","0.0402","","","0.0983","0.1143","","","","","","1.018","","","","has coordinates","234605","2020-10-21","18:00:00",""
"7125219","5.577","0.0013","11.436","0.003","11.447","0.003","90","","90","","90","","730.1","0.3","100","2","100","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C4 H13 B F3 N -","- C4 H13 B F3 N -","- C16 H52 B4 F12 N4 -","4","0.5","","Duda, Katharina; Himmelspach, Alexander; Landmann, Johannes; Kraus, Florian; Finze, Maik","Synthesis of the fluorohydridoborate anions [BHF<sub>3</sub>]<sup>-</sup> and [1-HF<sub>2</sub>B-9,12-X<sub>2</sub>-closo-1,2-C<sub>2</sub>B<sub>10</sub>H<sub>9</sub>]<sup>-</sup> (X = H, I): deboronation of 1,2- and 1,7-dicarba-closo-dodecaboranes with anhydrous [Me<sub>4</sub>N]F.","Chemical communications (Cambridge, England)","2016","52","90","13241","13244","10.1039/c6cc07711k","","","0.71073","MoKα","","0.0428","0.0365","","","0.0917","0.0954","","","","","","1.074","","","","has coordinates","234607","2020-10-21","18:00:00",""
"7125220","10.452","0.003","13.828","0.003","10.773","0.002","90","","90.102","0.007","90","","1557","0.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H24 B11 F2 N -","- C6 H24 B11 F2 N -","- C24 H96 B44 F8 N4 -","4","2","","Duda, Katharina; Himmelspach, Alexander; Landmann, Johannes; Kraus, Florian; Finze, Maik","Synthesis of the fluorohydridoborate anions [BHF<sub>3</sub>]<sup>-</sup> and [1-HF<sub>2</sub>B-9,12-X<sub>2</sub>-closo-1,2-C<sub>2</sub>B<sub>10</sub>H<sub>9</sub>]<sup>-</sup> (X = H, I): deboronation of 1,2- and 1,7-dicarba-closo-dodecaboranes with anhydrous [Me<sub>4</sub>N]F.","Chemical communications (Cambridge, England)","2016","52","90","13241","13244","10.1039/c6cc07711k","","","0.71073","MoKα","","0.0698","0.0688","","","0.1949","0.1965","","","","","","1.097","","","","has coordinates,has disorder","234607","2020-10-21","18:00:00",""
"7125221","12.4538","0.0007","13.5015","0.0008","13.544","0.0008","60.759","0.001","72.3","0.002","86.331","0.002","1883.28","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H22 B11 F2 I2 N -","- C6 H22 B11 F2 I2 N -","- C24 H88 B44 F8 I8 N4 -","4","2","","Duda, Katharina; Himmelspach, Alexander; Landmann, Johannes; Kraus, Florian; Finze, Maik","Synthesis of the fluorohydridoborate anions [BHF<sub>3</sub>]<sup>-</sup> and [1-HF<sub>2</sub>B-9,12-X<sub>2</sub>-closo-1,2-C<sub>2</sub>B<sub>10</sub>H<sub>9</sub>]<sup>-</sup> (X = H, I): deboronation of 1,2- and 1,7-dicarba-closo-dodecaboranes with anhydrous [Me<sub>4</sub>N]F.","Chemical communications (Cambridge, England)","2016","52","90","13241","13244","10.1039/c6cc07711k","","","0.71073","MoKα","","0.0307","0.0246","","","0.0528","0.0555","","","","","","1.058","","","","has coordinates,has disorder","234607","2020-10-21","18:00:00",""
"7125222","8.3041","0.0012","10.2744","0.0015","22.465","0.003","90","","90","","90","","1916.7","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 N O3 S -","- C20 H23 N O3 S -","- C80 H92 N4 O12 S4 -","4","1","","Huang, Wei; Liu, Hui; Lu, Chong-Dao; Xu, Yan-Jun","Diastereoselective synthesis of 2-methoxyimidoyloxiranes via dimethyl phosphite-mediated coupling of α-keto N-sulfinyl imidates with aldehydes.","Chemical communications (Cambridge, England)","2016","52","93","13592","13595","10.1039/c6cc07723d","","","0.71073","MoKα","","0.049","0.0372","","","0.0914","0.0993","","","","","","1.03","","","","has coordinates","234609","2020-10-21","18:00:00",""
"7125223","31.22","0.004","10.5893","0.0012","13.5925","0.0015","90","","89.984","0.006","90","","4493.7","0.9","296","2","296","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C28 H26 O4 -","- C28 H26 O4 -","- C112 H104 O16 -","4","1","","Lu, Danyang; Wan, Yimei; Kong, Lichun; Zhu, Gangguo","Copper-catalyzed cascade annulation between α-bromocarbonyls and biaryl or (Z)-arylvinylacetylenes enabling a direct synthesis of dibenzocycloheptanes and related compounds.","Chemical communications (Cambridge, England)","2016","52","97","13971","13974","10.1039/c6cc07727g","","","0.71073","MoKα","","0.1945","0.1764","","","0.4273","0.4324","","","","","","2.859","","","","has coordinates","234611","2020-10-21","18:00:00",""
"7125224","8.8392","0.0005","12.746","0.0007","9.5979","0.0005","90","","99.664","0.004","90","","1066","0.1","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H26 O4 -","- C25 H26 O4 -","- C50 H52 O8 -","2","1","","Lu, Danyang; Wan, Yimei; Kong, Lichun; Zhu, Gangguo","Copper-catalyzed cascade annulation between α-bromocarbonyls and biaryl or (Z)-arylvinylacetylenes enabling a direct synthesis of dibenzocycloheptanes and related compounds.","Chemical communications (Cambridge, England)","2016","52","97","13971","13974","10.1039/c6cc07727g","","","0.71073","MoKα","","0.1355","0.0637","","","0.1444","0.1847","","","","","","0.896","","","","has coordinates","234611","2020-10-21","18:00:00",""
"7125225","12.7888","0.0004","15.597","0.0005","11.0139","0.0004","90","","110.204","0.002","90","","2061.73","0.12","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O5 -","- C24 H24 O5 -","- C96 H96 O20 -","4","1","","Lu, Danyang; Wan, Yimei; Kong, Lichun; Zhu, Gangguo","Copper-catalyzed cascade annulation between α-bromocarbonyls and biaryl or (Z)-arylvinylacetylenes enabling a direct synthesis of dibenzocycloheptanes and related compounds.","Chemical communications (Cambridge, England)","2016","52","97","13971","13974","10.1039/c6cc07727g","","","0.71073","MoKα","","0.1245","0.0729","","","0.1911","0.2224","","","","","","1.359","","","","has coordinates","234611","2020-10-21","18:00:00",""
"7125226","36.4636","0.0015","9.9056","0.0004","9.921","0.0004","90","","90","","90","","3583.4","0.3","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C16 H52 B20 Co N2 S4 -","- C16 H52 B20 Co N2 S4 -","- C64 H208 B80 Co4 N8 S16 -","4","1","","Tu, Deshuang; Shao, Dong; Yan, Hong; Lu, Changsheng","A carborane-incorporated mononuclear Co(ii) complex showing zero-field slow magnetic relaxation.","Chemical communications (Cambridge, England)","2016","52","99","14326","14329","10.1039/c6cc07728e","","","0.71073","MoKα","","0.0688","0.0658","","","0.1607","0.1621","","","","","","1.135","","","","has coordinates","234613","2020-10-21","18:00:00",""
"7125227","10.291","0.003","21.844","0.007","12.742","0.005","90","","106.679","0.018","90","","2743.8","1.6","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H46 Cl2 N4 Sn -","- C26 H46 Cl2 N4 Sn -","- C104 H184 Cl8 N16 Sn4 -","4","1","","Bertermann, Rüdiger; Braunschweig, Holger; Celik, Mehmet Ali; Dellermann, Theresa; Kelch, Hauke","Cyclisation of biscarbenoids - a novel mode of cyclobutadiene stabilisation.","Chemical communications (Cambridge, England)","2016","52","90","13249","13252","10.1039/c6cc07741b","","","0.71073","MoKα","","0.0137","0.0135","","","0.0344","0.0346","","","","","","1.045","","","","has coordinates","234614","2020-10-21","18:00:00",""
"7125228","10.8018","0.0006","17.3515","0.0009","26.7953","0.0016","90","","97.145","0.003","90","","4983.2","0.5","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C92 H56 N8 Zn2 -","- C92 H56 N8 Zn2 -","- C184 H112 N16 Zn4 -","2","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.1039","0.0586","","","0.1573","0.1836","","","","","","1.034","","","","has coordinates","234617","2020-10-21","18:00:00",""
"7125229","10.7748","0.0004","11.5828","0.0004","35.9716","0.0011","90","","93.971","0.002","90","","4478.6","0.3","173","2","173","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C53 H38 N4 Ni -","- C53 H38 N4 Ni -","- C212 H152 N16 Ni4 -","4","1","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.1054","0.0633","","","0.1724","0.1998","","","","","","1.047","","","","has coordinates","234617","2020-10-21","18:00:00",""
"7125230","18.03","0.0008","11.0785","0.0005","16.251","0.0007","90","","90","","90","","3246.1","0.2","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C46 H28 N4 Ni -","- C46 H28 N4 Ni -","- C184 H112 N16 Ni4 -","4","1","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.0689","0.0491","","","0.1174","0.1244","","","","","","1.001","","","","has coordinates","234617","2020-10-21","18:00:00",""
"7125231","26.2435","0.0013","13.5308","0.0005","9.407","0.0004","90","","99.357","0.004","90","","3295.9","0.3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C46 H30 N4 -","- C46 H30 N4 -","- C184 H120 N16 -","4","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.1058","0.0645","","","0.1632","0.1881","","","","","","1.028","","","","has coordinates","234617","2020-10-21","18:00:00",""
"7125232","9.4384","0.0003","34.9486","0.0012","20.3325","0.0007","90","","101.347","0.002","90","","6575.8","0.4","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C136 H110 Ag4 F12 N16 O15 S4 Zn4 -","- C136 H100 Ag4 F12 N16 O15 S4 Zn4 -","- C272 H200 Ag8 F24 N32 O30 S8 Zn8 -","2","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.0928","0.0562","","","0.1128","0.1266","","","","","","1.1","","","","has coordinates,has disorder","234617","2020-10-21","18:00:00",""
"7125233","11.3487","0.0003","18.6122","0.0005","33.9443","0.001","90","","95.1","0.002","90","","7141.5","0.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C63 H40 Ag3 F9 N8 O9 S3 Zn2 -","- C63 H40 Ag3 F9 N8 O9 S3 Zn2 -","- C252 H160 Ag12 F36 N32 O36 S12 Zn8 -","4","1","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.066","0.0447","","","0.1238","0.1363","","","","","","1.03","","","","has coordinates","234617","2020-10-21","18:00:00",""
"7125234","15.4217","0.0005","16.4469","0.0005","22.1055","0.0007","69.989","0.002","69.909","0.002","73.752","0.002","4863.4","0.3","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C216 H172 Ag4 F12 N16 O17 S4 Zn4 -","- C216 H162 Ag4 F12 N16 O17 S4 Zn4 -","- C216 H162 Ag4 F12 N16 O17 S4 Zn4 -","1","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais","Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.","Chemical communications (Cambridge, England)","2016","52","88","13000","13003","10.1039/c6cc07754d","","","0.71073","MoKα","","0.0882","0.0536","","","0.1388","0.1587","","","","","","1.068","","","","has coordinates,has disorder","234617","2020-10-21","18:00:00",""
"7125235","8.5064","0.0009","17.8133","0.0019","9.4824","0.001","90","","99.126","0.003","90","","1418.7","0.3","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C68 H64 N8 O12 -","4","1","","Zhou, Tao; Li, Bin; Wang, Baiquan","Rhodium-catalyzed C-H activation of 3-(indolin-1-yl)-3-oxopropanenitriles with diazo compounds and tandem cyclization leading to hydrogenated azepino[3,2,1-hi]indoles.","Chemical communications (Cambridge, England)","2016","52","98","14117","14120","10.1039/c6cc07758g","","","0.71075","MoKα","","0.0473","0.0437","","","0.1179","0.121","","","","","","1.048","","","","has coordinates","234619","2020-10-21","18:00:00",""
"7125236","9.2814","0.0019","10.273","0.0019","11.8447","0.0019","79.305","0.011","79.574","0.012","83.084","0.012","1087","0.4","113","","113","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H20 N2 O4 -","- C21 H20 N2 O4 -","- C42 H40 N4 O8 -","2","1","","Zhou, Tao; Li, Bin; Wang, Baiquan","Rhodium-catalyzed C-H activation of 3-(indolin-1-yl)-3-oxopropanenitriles with diazo compounds and tandem cyclization leading to hydrogenated azepino[3,2,1-hi]indoles.","Chemical communications (Cambridge, England)","2016","52","98","14117","14120","10.1039/c6cc07758g","","","0.71073","MoKα","","0.0617","0.0512","","","0.1281","0.1339","","","","","","1.053","","","","has coordinates","234619","2020-10-21","18:00:00",""
"7125237","7.6541","0.0006","9.3183","0.0004","12.9177","0.0009","106.268","0.005","100.626","0.006","91.743","0.005","865.98","0.1","172.9","0.2","172.9","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H16 O4 S4 -","- C16 H16 O4 S4 -","- C32 H32 O8 S8 -","2","1","","Adows, Hadeel; Zhao, Yuming","Redox interactions of Au(iii) with carboxylated dithiafulvenes and tetrathiafulvalene analogues in polar organic media.","Chemical communications (Cambridge, England)","2016","52","89","13101","13104","10.1039/c6cc07769b","","x-ray","1.54184","CuKα","","0.0399","0.0367","","","0.0995","0.1042","","","","","","1.054","","","","has coordinates","234621","2020-10-21","18:00:00",""
"7125238","17.3602","0.0009","9.8696","0.0005","20.8727","0.001","90","","96.315","0.004","90","","3554.6","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H30 O8 S8 -","- C32 H30 O8 S8 -","- C128 H120 O32 S32 -","4","0.5","","Adows, Hadeel; Zhao, Yuming","Redox interactions of Au(iii) with carboxylated dithiafulvenes and tetrathiafulvalene analogues in polar organic media.","Chemical communications (Cambridge, England)","2016","52","89","13101","13104","10.1039/c6cc07769b","","x-ray","0.71073","MoKα","","0.0774","0.0565","","","0.1364","0.1501","","","","","","1.035","","","","has coordinates","234621","2020-10-21","18:00:00",""
"7125239","9.062","0.001","10.7865","0.0012","22.897","0.003","84.698","0.002","80.375","0.002","70.592","0.002","2079.6","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H102 Au2 Cl8 O8 S8 -","- C67.992 H101.978 Au2 Cl8 O8 S8 -","- C67.992 H101.978 Au2 Cl8 O8 S8 -","1","0.5","","Adows, Hadeel; Zhao, Yuming","Redox interactions of Au(iii) with carboxylated dithiafulvenes and tetrathiafulvalene analogues in polar organic media.","Chemical communications (Cambridge, England)","2016","52","89","13101","13104","10.1039/c6cc07769b","","","0.71073","MoKα","","0.0509","0.0358","","","0.0777","0.082","","","","","","1.039","","","","has coordinates,has disorder","234621","2020-10-21","18:00:00",""
"7125240","36.068","0.008","14.096","0.003","16.023","0.004","90","","109.397","0.007","90","","7684","3","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","CP1","","- C60 H60 Cl2 Cu N12 O14 -","- C60 H60 Cl2 Cu N12 O14 -","- C240 H240 Cl8 Cu4 N48 O56 -","4","0.5","","Sarkar, Koushik; Paul, Mithun; Dastidar, Parthasarathi","Multifunctional single-layered vesicles derived from Cu(ii)-metal-organic-polyhedra.","Chemical communications (Cambridge, England)","2016","52","89","13124","13127","10.1039/c6cc07804d","","","0.71073","MoKα","","0.1321","0.0873","","","0.2617","0.2843","","","","","","1.018","","","","has coordinates,has disorder","234623","2020-10-21","18:00:00",""
"7125241","35.729","0.003","13.9528","0.0011","15.8889","0.0013","90","","109.211","0.002","90","","7479.8","1.1","100","","100","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","CP2","","- C60 H60 B2 Cu F8 N12 O6 -","- C60 H60 B2 Cu F8 N12 O6 -","- C240 H240 B8 Cu4 F32 N48 O24 -","4","0.5","","Sarkar, Koushik; Paul, Mithun; Dastidar, Parthasarathi","Multifunctional single-layered vesicles derived from Cu(ii)-metal-organic-polyhedra.","Chemical communications (Cambridge, England)","2016","52","89","13124","13127","10.1039/c6cc07804d","","","0.71073","MoKα","","0.1322","0.0819","","","0.2313","0.2587","","","","","","1.041","","","","has coordinates,has disorder","234623","2020-10-21","18:00:00",""
"7125242","35.509","0.01","14.304","0.004","15.395","0.004","90","","108.369","0.019","90","","7421","4","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","CP3","","- C60 H60 Cu N14 O12 -","- C60 H60 Cu N14 O12 -","- C240 H240 Cu4 N56 O48 -","4","0.5","","Sarkar, Koushik; Paul, Mithun; Dastidar, Parthasarathi","Multifunctional single-layered vesicles derived from Cu(ii)-metal-organic-polyhedra.","Chemical communications (Cambridge, England)","2016","52","89","13124","13127","10.1039/c6cc07804d","","","0.71073","MoKα","","0.1559","0.0844","","","0.2365","0.2962","","","","","","0.985","","","","has coordinates,has disorder","234623","2020-10-21","18:00:00",""
"7125243","24.331","0.003","24.388","0.003","24.415","0.003","118.745","0.002","91.861","0.002","118.748","0.002","10460","2","120","","120","","","","","","","","","6","P -1","-P 1","2","","MOP1","","- C264 H300 Cl6 Cu6 N54 O48 -","- C264 H288 Cl6 Cu6 N54 O48 -","- C264 H288 Cl6 Cu6 N54 O48 -","1","0.5","","Sarkar, Koushik; Paul, Mithun; Dastidar, Parthasarathi","Multifunctional single-layered vesicles derived from Cu(ii)-metal-organic-polyhedra.","Chemical communications (Cambridge, England)","2016","52","89","13124","13127","10.1039/c6cc07804d","","","0.71073","MoKα","","0.135","0.0823","","","0.2204","0.2475","","","","","","0.977","","","","has coordinates","234623","2020-10-21","18:00:00",""
"7125244","34.915","0.003","33.412","0.003","34.291","0.003","90","","90.352","0.004","90","","40002","6","120","","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","MOP2","","- C264 H290 Br12 Cu6 N48 O24 -","- C264 H286 Br12 Cu6 N48 O24 -","- C1056 H1144 Br48 Cu24 N192 O96 -","4","0.5","","Sarkar, Koushik; Paul, Mithun; Dastidar, Parthasarathi","Multifunctional single-layered vesicles derived from Cu(ii)-metal-organic-polyhedra.","Chemical communications (Cambridge, England)","2016","52","89","13124","13127","10.1039/c6cc07804d","","","0.71073","MoKα","","0.0991","0.0842","","","0.2205","0.235","","","","","","1.032","","","","has coordinates","234623","2020-10-21","18:00:00",""
"7125245","7.9327","0.00019","9.5312","0.0002","19.6547","0.0005","90","","100.885","0.002","90","","1459.32","0.06","99.9","0.1","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 F N O2 S -","- C14 H20 F N O2 S -","- C56 H80 F4 N4 O8 S4 -","4","1","","Okoromoba, Otome E.; Li, Zhou; Robertson, Nicole; Mashuta, Mark S.; Couto, Uenifer R.; Tormena, Cláudio F; Xu, Bo; Hammond, Gerald B.","Achieving regio- and stereo-control in the fluorination of aziridines under acidic conditions.","Chemical communications (Cambridge, England)","2016","52","91","13353","13356","10.1039/c6cc07855a","","","0.71073","MoKα","","0.0432","0.0367","","","0.0902","0.0943","","","","","","1.052","","","","has coordinates","234625","2020-10-21","18:00:00",""
"7125246","8.2947","0.0003","9.5293","0.0002","18.8749","0.0004","90","","90","","90","","1491.92","0.07","99.9","0.1","99.9","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H18 F N O2 S -","- C16 H18 F N O2 S -","- C64 H72 F4 N4 O8 S4 -","4","1","","Okoromoba, Otome E.; Li, Zhou; Robertson, Nicole; Mashuta, Mark S.; Couto, Uenifer R.; Tormena, Cláudio F; Xu, Bo; Hammond, Gerald B.","Achieving regio- and stereo-control in the fluorination of aziridines under acidic conditions.","Chemical communications (Cambridge, England)","2016","52","91","13353","13356","10.1039/c6cc07855a","","","0.71073","MoKα","","0.0379","0.0341","","","0.0733","0.0752","","","","","","1.032","","","","has coordinates","234625","2020-10-21","18:00:00",""
"7125247","7.3082","0.0002","12.667","0.0004","7.9739","0.0003","90","","102.802","0.003","90","","719.82","0.04","100.5","0.6","100.5","0.6","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H17 N O2 S -","- C16 H17 N O2 S -","- C32 H34 N2 O4 S2 -","2","1","","Okoromoba, Otome E.; Li, Zhou; Robertson, Nicole; Mashuta, Mark S.; Couto, Uenifer R.; Tormena, Cláudio F; Xu, Bo; Hammond, Gerald B.","Achieving regio- and stereo-control in the fluorination of aziridines under acidic conditions.","Chemical communications (Cambridge, England)","2016","52","91","13353","13356","10.1039/c6cc07855a","","","0.71073","MoKα","","0.026","0.0254","","","0.0581","0.0585","","","","","","1.019","","","","has coordinates","234625","2020-10-21","18:00:00",""
"7125248","6.3281","0.0004","12.8693","0.0009","17.8671","0.001","105.544","0.006","93.657","0.005","100.435","0.005","1368.94","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H36 F2 N2 O6 S2 -","- C26 H36 F2 N2 O6 S2 -","- C52 H72 F4 N4 O12 S4 -","2","1","","Okoromoba, Otome E.; Li, Zhou; Robertson, Nicole; Mashuta, Mark S.; Couto, Uenifer R.; Tormena, Cláudio F; Xu, Bo; Hammond, Gerald B.","Achieving regio- and stereo-control in the fluorination of aziridines under acidic conditions.","Chemical communications (Cambridge, England)","2016","52","91","13353","13356","10.1039/c6cc07855a","","","0.71073","MoKα","","0.0601","0.0396","","","0.0729","0.0811","","","","","","1.03","","","","has coordinates","234625","2020-10-21","18:00:00",""
"7125249","7.1952","0.0005","19.7441","0.0016","20.4254","0.0014","90","","90","","90","","2901.7","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","ZJU-198","","- C12 H7 N O4 Zn -","- C12 H7 N O4 Zn -","- C96 H56 N8 O32 Zn8 -","8","1","","Zhang, Ling; Jiang, Ke; Jiang, Mengdie; Yue, Dan; Wan, Yating; Xing, Huabin; Yang, Yu; Cui, Yuanjing; Chen, Banglin; Qian, Guodong","A highly stable amino-coordinated MOF for unprecedented block off N<sub>2</sub> adsorption and extraordinary CO<sub>2</sub>/N<sub>2</sub> separation.","Chemical communications (Cambridge, England)","2016","52","93","13568","13571","10.1039/c6cc07858c","","","0.71073","MoKα","","0.1194","0.0893","","","0.2027","0.2188","","","","","","1.037","","","","has coordinates","234626","2020-10-21","18:00:00",""
"7125250","10.08","0.0003","11.8813","0.0004","16.5509","0.0006","88.653","0.002","86.499","0.002","89.381","0.002","1977.86","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H24 N2 O Si -","- C21 H24 N2 O Si -","- C84 H96 N8 O4 Si4 -","4","2","","Pan, Jin-Long; Li, Quan-Zhe; Zhang, Ting-Yu; Hou, Si-Hua; Kang, Jun-Cheng; Zhang, Shu-Yu","Palladium-catalyzed direct intermolecular silylation of remote unactivated C(sp<sup>3</sup>)-H bonds.","Chemical communications (Cambridge, England)","2016","52","89","13151","13154","10.1039/c6cc07885k","","","1.54178","CuKα","","0.0715","0.0536","","","0.1413","0.1518","","","","","","1.033","","","","has coordinates","234628","2020-10-21","18:00:00",""
"7125251","17.5738","0.0008","10.3894","0.0004","12.0069","0.0005","90","","100.934","0.002","90","","2152.44","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 N2 O Si2 -","- C20 H30 N2 O Si2 -","- C80 H120 N8 O4 Si8 -","4","1","","Pan, Jin-Long; Li, Quan-Zhe; Zhang, Ting-Yu; Hou, Si-Hua; Kang, Jun-Cheng; Zhang, Shu-Yu","Palladium-catalyzed direct intermolecular silylation of remote unactivated C(sp<sup>3</sup>)-H bonds.","Chemical communications (Cambridge, England)","2016","52","89","13151","13154","10.1039/c6cc07885k","","","1.54178","CuKα","","0.0495","0.0427","","","0.1225","0.1337","","","","","","1.006","","","","has coordinates","234628","2020-10-21","18:00:00",""
"7125252","40.8407","0.0009","11.72","0.0003","10.659","0.0002","90","","102.731","0.001","90","","4976.53","0.19","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C26 H29 N3 O3 Si -","- C26 H29 N3 O3 Si -","- C208 H232 N24 O24 Si8 -","8","2","","Pan, Jin-Long; Li, Quan-Zhe; Zhang, Ting-Yu; Hou, Si-Hua; Kang, Jun-Cheng; Zhang, Shu-Yu","Palladium-catalyzed direct intermolecular silylation of remote unactivated C(sp<sup>3</sup>)-H bonds.","Chemical communications (Cambridge, England)","2016","52","89","13151","13154","10.1039/c6cc07885k","","","1.54178","CuKα","","0.0521","0.0448","","","0.1094","0.113","","","","","","1.05","","","","has coordinates","234628","2020-10-21","18:00:00",""
"7125253","8.7297","0.0006","28.9112","0.0015","15.5735","0.0012","90","","103.822","0.004","90","","3816.7","0.4","113","","113","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C39 H21 Au Cl7 F2 N O4 P -","- C39 H21 Au Cl7 F2 N O4 P -","- C156 H84 Au4 Cl28 F8 N4 O16 P4 -","4","1","","Hattori, Yohei; Kusamoto, Tetsuro; Sato, Tohru; Nishihara, Hiroshi","Synergistic luminescence enhancement of a pyridyl-substituted triarylmethyl radical based on fluorine substitution and coordination to gold.","Chemical communications (Cambridge, England)","2016","52","91","13393","13396","10.1039/c6cc07898b","","","0.7107","MoKα","","","0.0532","","","","0.1221","","","","","","1.08","","","","has coordinates","234630","2020-10-21","18:00:00",""
"7125254","22.1254","0.0011","16.4448","0.0009","28.2843","0.0015","90","","90","","90","","10291.2","0.9","100","2","100","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","bis(2-phenyl-1H-benzo[d]imidazole-κ^2^N,C)-{methyl 1-butyl-2-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxylate-κ^2^N,N'}iridium(III) hexafluorophosphate tris(dichloromethane) solvate","","- C47 H43 Cl6 F6 Ir N7 O2 P -","- C47 H43 Cl6 F6 Ir N7 O2 P -","- C376 H344 Cl48 F48 Ir8 N56 O16 P8 -","8","1","","Yellol, Jyoti; Pérez, Sergio A; Yellol, Gorakh; Zajac, Juraj; Donaire, Antonio; Vigueras, Gloria; Novohradsky, Vojtech; Janiak, Christoph; Brabec, Viktor; Ruiz, José","Highly potent extranuclear-targeted luminescent iridium(iii) antitumor agents containing benzimidazole-based ligands with a handle for functionalization.","Chemical communications (Cambridge, England)","2016","52","98","14165","14168","10.1039/c6cc07909a","","","0.71073","MoKα","","0.07","0.0621","","","0.1235","0.1272","","","","","","1.145","","","","has coordinates","234632","2020-10-21","18:00:00",""
"7125255","24.4157","0.001","16.5559","0.0007","23.3462","0.0009","90","","113.79","0.0014","90","","8635.2","0.6","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","bis(1-phenyl-1H-pyrazole-κ^2^N,C)-{methyl 1-butyl-2-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxylate-κ^2^N,N'}iridium(III) hexafluorophosphate dichloromethane solvate","","- C35.5 H30.5 Cl F6 Ir N7 O2 P -","- C35.5 H30.5 Cl F6 Ir N7 O2 P -","- C284 H244 Cl8 F48 Ir8 N56 O16 P8 -","8","1","","Yellol, Jyoti; Pérez, Sergio A; Yellol, Gorakh; Zajac, Juraj; Donaire, Antonio; Vigueras, Gloria; Novohradsky, Vojtech; Janiak, Christoph; Brabec, Viktor; Ruiz, José","Highly potent extranuclear-targeted luminescent iridium(iii) antitumor agents containing benzimidazole-based ligands with a handle for functionalization.","Chemical communications (Cambridge, England)","2016","52","98","14165","14168","10.1039/c6cc07909a","","","0.71073","MoKα","","0.0361","0.0335","","","0.0802","0.0817","","","","","","1.075","","","","has coordinates,has disorder","234632","2020-10-21","18:00:00",""
"7125256","6.3004","0.0005","8.2192","0.0008","25.844","0.002","90","","94.486","0.008","90","","1334.2","0.2","293","2","293.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 O2 -","- C15 H18 O2 -","- C60 H72 O8 -","4","1","","Ma, Dengke; Fu, Chunling; Ma, Shengming","Diastereoselective construction of cyclopent-2-enone-4-ols from aldehydes and 1,2-allenones catalyzed by N-heterocyclic carbene.","Chemical communications (Cambridge, England)","2016","52","100","14426","14429","10.1039/c6cc07974a","","","0.71073","MoKα","","0.0996","0.0511","","","0.1076","0.1295","","","","","","0.998","","","","has coordinates","234634","2020-10-21","18:00:00",""
"7125257","9.0944","0.0007","11.4218","0.0009","15.9032","0.0012","95.9441","0.0008","103.474","0.0008","102.049","0.0008","1550.8","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 O2 P2 Pd S -","- C36 H28 O2 P2 Pd S -","- C72 H56 O4 P4 Pd2 S2 -","2","1","","Ma, Qiang-Qiang; Liu, Ting; Li, Shujun; Zhang, Jie; Chen, Xuenian; Guan, Hairong","Highly efficient reduction of carbon dioxide with a borane catalyzed by bis(phosphinite) pincer ligated palladium thiolate complexes.","Chemical communications (Cambridge, England)","2016","52","99","14262","14265","10.1039/c6cc07987c","","","0.71073","MoKα","","0.0401","0.0325","","","0.0805","0.0879","","","","","","1.055","","","","has coordinates","234638","2020-10-21","18:00:00",""
"7125258","8.7065","0.0015","11.0937","0.0019","15.13","0.003","73.3056","0.0017","80.9582","0.0019","74.899","0.0018","1346.1","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H36 O2 P2 Pd S -","- C24 H36 O2 P2 Pd S -","- C48 H72 O4 P4 Pd2 S2 -","2","1","","Ma, Qiang-Qiang; Liu, Ting; Li, Shujun; Zhang, Jie; Chen, Xuenian; Guan, Hairong","Highly efficient reduction of carbon dioxide with a borane catalyzed by bis(phosphinite) pincer ligated palladium thiolate complexes.","Chemical communications (Cambridge, England)","2016","52","99","14262","14265","10.1039/c6cc07987c","","","0.71073","MoKα","","0.0286","0.0235","","","0.0657","0.0757","","","","","","1.015","","","","has coordinates","234638","2020-10-21","18:00:00",""
"7125259","8.6167","0.0009","11.5992","0.0012","16.4263","0.0017","77.1791","0.0012","79.8629","0.0014","73.9166","0.0013","1526.6","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H44 O2 P2 Pd S -","- C28 H44 O2 P2 Pd S -","- C56 H88 O4 P4 Pd2 S2 -","2","1","","Ma, Qiang-Qiang; Liu, Ting; Li, Shujun; Zhang, Jie; Chen, Xuenian; Guan, Hairong","Highly efficient reduction of carbon dioxide with a borane catalyzed by bis(phosphinite) pincer ligated palladium thiolate complexes.","Chemical communications (Cambridge, England)","2016","52","99","14262","14265","10.1039/c6cc07987c","","","0.71073","MoKα","","0.0776","0.0481","","","0.095","0.1175","","","","","","1.088","","","","has coordinates","234638","2020-10-21","18:00:00",""
"7125260","14.9101","0.0005","17.9438","0.0005","22.3792","0.0007","69.512","0.002","75.796","0.002","81.501","0.002","5424.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Mn10","","","- C216 H310 Mn10 N12 O40 -","- C216 H300 Mn10 N12 O40 -","- C216 H300 Mn10 N12 O40 -","1","0.5","","Coletta, Marco; McLellan, Ross; Waddington, Amy; Sanz, Sergio; Gagnon, Kevin J.; Teat, Simon J.; Brechin, Euan K.; Dalgarno, Scott J.","Core expansion of bis-calix[4]arene-supported clusters.","Chemical communications (Cambridge, England)","2016","52","99","14246","14249","10.1039/c6cc08059f","","","0.7749","Synchrotron","","0.1116","0.0762","","","0.2023","0.2297","","","","","","1.045","","","","has coordinates,has disorder","234640","2020-10-21","18:00:00",""
"7125261","22.096","0.0007","19.157","0.0006","27.0764","0.0009","90","","105.149","0.002","90","","11063","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Mn8Gd2","","","- C206 H280 Gd2 Mn8 N10 O44 -","- C206 H278 Gd2 Mn8 N10 O44 -","- C412 H556 Gd4 Mn16 N20 O88 -","2","0.5","","Coletta, Marco; McLellan, Ross; Waddington, Amy; Sanz, Sergio; Gagnon, Kevin J.; Teat, Simon J.; Brechin, Euan K.; Dalgarno, Scott J.","Core expansion of bis-calix[4]arene-supported clusters.","Chemical communications (Cambridge, England)","2016","52","99","14246","14249","10.1039/c6cc08059f","","","0.7749","Synchrotron","","0.1061","0.0834","","","0.2489","0.274","","","","","","1.077","","","","has coordinates,has disorder","234640","2020-10-21","18:00:00",""
"7125262","8.9003","0.0013","9.3364","0.0014","11.3581","0.0015","83.515","0.006","76.869","0.005","82.053","0.006","907.1","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","DASA_3a","","- C20 H24 N2 O5 -","- C20 H24 N2 O5 -","- C40 H48 N4 O10 -","2","1","","Mallo, Neil; Brown, Patrick T.; Iranmanesh, Hasti; MacDonald, Thomas S. C.; Teusner, Matthew J.; Harper, Jason B.; Ball, Graham E.; Beves, Jonathon E.","Photochromic switching behaviour of donor-acceptor Stenhouse adducts in organic solvents.","Chemical communications (Cambridge, England)","2016","52","93","13576","13579","10.1039/c6cc08079k","","","0.71073","MoKα","","0.1297","0.0539","","","0.1105","0.145","","","","","","0.97","","","","has coordinates","234643","2020-10-21","18:00:00",""
"7125263","7.787","0.009","9.08","0.012","12.994","0.016","106.14","0.07","91.08","0.07","94.96","0.07","878.4","1.9","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H21 N O6 -","- C19 H21 N O6 -","- C38 H42 N2 O12 -","2","1","","Mallo, Neil; Brown, Patrick T.; Iranmanesh, Hasti; MacDonald, Thomas S. C.; Teusner, Matthew J.; Harper, Jason B.; Ball, Graham E.; Beves, Jonathon E.","Photochromic switching behaviour of donor-acceptor Stenhouse adducts in organic solvents.","Chemical communications (Cambridge, England)","2016","52","93","13576","13579","10.1039/c6cc08079k","","","0.71073","MoKα","","0.1091","0.0598","","","0.1305","0.1527","","","","","","0.981","","","","has coordinates","234643","2020-10-21","18:00:00",""
"7125264","10.2","0.003","12.903","0.003","14.787","0.003","90","","90","","90","","1946.1","0.8","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C19 H21 N O6 -","- C19 H21 N O6 -","- C76 H84 N4 O24 -","4","1","","Mallo, Neil; Brown, Patrick T.; Iranmanesh, Hasti; MacDonald, Thomas S. C.; Teusner, Matthew J.; Harper, Jason B.; Ball, Graham E.; Beves, Jonathon E.","Photochromic switching behaviour of donor-acceptor Stenhouse adducts in organic solvents.","Chemical communications (Cambridge, England)","2016","52","93","13576","13579","10.1039/c6cc08079k","","","0.71073","MoKα","","0.2424","0.0843","","","0.1451","0.2131","","","","","","0.921","","","","has coordinates","234643","2020-10-21","18:00:00",""
"7125265","7.3465","0.0006","12.3261","0.001","18.1727","0.0012","90","","95.772","0.002","90","","1637.3","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N O5 -","- C18 H19 N O5 -","- C72 H76 N4 O20 -","4","1","","Mallo, Neil; Brown, Patrick T.; Iranmanesh, Hasti; MacDonald, Thomas S. C.; Teusner, Matthew J.; Harper, Jason B.; Ball, Graham E.; Beves, Jonathon E.","Photochromic switching behaviour of donor-acceptor Stenhouse adducts in organic solvents.","Chemical communications (Cambridge, England)","2016","52","93","13576","13579","10.1039/c6cc08079k","","","0.71073","MoKα","","0.0428","0.0374","","","0.0946","0.0983","","","","","","1.054","","","","has coordinates","234643","2020-10-21","18:00:00",""
"7125266","18.99","0.004","5.418","0.0011","17.32","0.004","90","","113.9","0.03","90","","1629.2","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 F N O5 -","- C18 H18 F N O5 -","- C72 H72 F4 N4 O20 -","4","1","","Mallo, Neil; Brown, Patrick T.; Iranmanesh, Hasti; MacDonald, Thomas S. C.; Teusner, Matthew J.; Harper, Jason B.; Ball, Graham E.; Beves, Jonathon E.","Photochromic switching behaviour of donor-acceptor Stenhouse adducts in organic solvents.","Chemical communications (Cambridge, England)","2016","52","93","13576","13579","10.1039/c6cc08079k","","","0.71073","Synchrotron","","0.0491","0.0432","","","0.1098","0.114","","","","","","1.061","","","","has coordinates","234643","2020-10-21","18:00:00",""
"7125267","15.6911","0.0013","7.8759","0.0007","19.8219","0.0014","90","","106.907","0.002","90","","2343.7","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H30 N2 O3 S -","- C25 H30 N2 O3 S -","- C100 H120 N8 O12 S4 -","4","1","","Kumar, Ravi; Thorat, Shridhar H.; Reddy, Maddi Sridhar","Cu-Catalyzed iminative hydroolefination of unactivated alkynes en route to 4-imino-tetrahydropyridines and 4-aminopyridines.","Chemical communications (Cambridge, England)","2016","52","92","13475","13478","10.1039/c6cc08081b","","","0.71073","MoKα","","0.0767","0.0484","","","0.1176","0.1417","","","","","","1.098","","","","has coordinates","234645","2020-10-21","18:00:00",""
"7125268","14.6718","0.0005","22.9104","0.0008","23.5888","0.0009","90","","104.564","0.004","90","","7674.3","0.5","145","2","145","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C72 H110 Cl4 N7 O10 -","- C72 H109 Cl4 N7 O10 -","- C288 H436 Cl16 N28 O40 -","4","1","","Lavendomme, Roy; Marcélis, Lionel; Wouters, Johan; Luhmer, Michel; Jabin, Ivan","A nano-sized container for specific encapsulation of isolated water molecules.","Chemical communications (Cambridge, England)","2016","52","98","14109","14112","10.1039/c6cc08096k","","","0.71073","MoKα","","0.1167","0.0929","","","0.2554","0.2772","","","","","","1.025","","","","has coordinates","234647","2020-10-21","18:00:00",""
"7125269","14.318","0.002","11.54","0.0017","14.975","0.002","90","","93.52","0.002","90","","2469.6","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H36 N3 U -","- C27 H36 N3 U -","- C108 H144 N12 U4 -","4","1","","Behrle, Andrew C.; Myers, Alexander J.; Rungthanaphatsophon, Pokpong; Lukens, Wayne W.; Barnes, Charles L.; Walensky, Justin R.","Uranium(iii) and thorium(iv) alkyl complexes as potential starting materials.","Chemical communications (Cambridge, England)","2016","52","100","14373","14375","10.1039/c6cc08105c","","","0.71073","MoKα","","0.031","0.0233","","","0.0496","0.0524","","","","","","1.033","","","","has coordinates","234650","2020-10-21","18:00:00",""
"7125270","9.59","0.002","11.143","0.002","11.619","0.002","88.275","0.002","77.613","0.002","87.316","0.002","1211.1","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H35 Cl0 N3 Th -","- C27 H35 N3 Th -","- C54 H70 N6 Th2 -","2","1","","Behrle, Andrew C.; Myers, Alexander J.; Rungthanaphatsophon, Pokpong; Lukens, Wayne W.; Barnes, Charles L.; Walensky, Justin R.","Uranium(iii) and thorium(iv) alkyl complexes as potential starting materials.","Chemical communications (Cambridge, England)","2016","52","100","14373","14375","10.1039/c6cc08105c","","","0.71073","MoKα","","0.0289","0.0262","","","0.0648","0.0661","","","","","","1.055","","","","has coordinates","234650","2020-10-21","18:00:00",""
"7125271","14.983","0.006","25.115","0.011","27.353","0.012","90","","92.488","0.006","90","","10283","8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C111 H116 O S8 Th -","- C111 H116 O S8 Th -","- C444 H464 O4 S32 Th4 -","4","1","","Behrle, Andrew C.; Myers, Alexander J.; Rungthanaphatsophon, Pokpong; Lukens, Wayne W.; Barnes, Charles L.; Walensky, Justin R.","Uranium(iii) and thorium(iv) alkyl complexes as potential starting materials.","Chemical communications (Cambridge, England)","2016","52","100","14373","14375","10.1039/c6cc08105c","","","0.71073","MoKα","","0.1083","0.068","","","0.1292","0.1443","","","","","","1.074","","","","has coordinates","234650","2020-10-21","18:00:00",""
"7125272","15.004","0.0012","25.0884","0.0019","27.253","0.002","90","","92.527","0.001","90","","10248.8","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C118 H124 O S8 U -","- C118 H124 O S8 U -","- C472 H496 O4 S32 U4 -","4","1","","Behrle, Andrew C.; Myers, Alexander J.; Rungthanaphatsophon, Pokpong; Lukens, Wayne W.; Barnes, Charles L.; Walensky, Justin R.","Uranium(iii) and thorium(iv) alkyl complexes as potential starting materials.","Chemical communications (Cambridge, England)","2016","52","100","14373","14375","10.1039/c6cc08105c","","","0.71073","MoKα","","0.0953","0.0611","","","0.1276","0.1437","","","","","","1.051","","","","has coordinates","234650","2020-10-21","18:00:00",""
"7125273","30.3787","0.0016","19.6365","0.001","32.742","0.003","90","","109.719","0.0013","90","","18386","2","220","2","220","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","TBA-C4-[3]Rotaxane","","- C180 H200 Cl18 N17 O12 P -","- C180 H200 Cl18 N17 O12 P -","- C720 H800 Cl72 N68 O48 P4 -","4","0.5","","Qiao, Bo; Liu, Yun; Lee, Semin; Pink, Maren; Flood, Amar H.","A high-yield synthesis and acid-base response of phosphate-templated [3]rotaxanes.","Chemical communications (Cambridge, England)","2016","52","94","13675","13678","10.1039/c6cc08113d","","","0.71073","MoKα","","0.1781","0.1234","","","0.3704","0.4377","","","","","","1.225","","","","has coordinates,has disorder","234653","2020-10-21","18:00:00",""
"7125274","36.9585","0.0019","36.9585","0.0019","36.9585","0.0019","90","","90","","90","","50483","4","230","2","230","2","","","","","","","","3","P 43 3 2","P 4acd 2ab 3","212","","PC3-pseudorotaxane-SQUEEZE","","- C130 H130 N10 -","- C130 H130 N10 -","- C1560 H1560 N120 -","12","0.5","","Qiao, Bo; Liu, Yun; Lee, Semin; Pink, Maren; Flood, Amar H.","A high-yield synthesis and acid-base response of phosphate-templated [3]rotaxanes.","Chemical communications (Cambridge, England)","2016","52","94","13675","13678","10.1039/c6cc08113d","","","0.71073","MoKα","","0.1646","0.1118","","","0.2719","0.295","","","","","","1.587","","","","has coordinates,has disorder","234653","2020-10-21","18:00:00",""
"7125275","8.9587","0.0007","8.4815","0.0005","27.445","0.002","90","","92.802","0.004","90","","2082.9","0.3","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 O3 -","- C26 H24 O3 -","- C104 H96 O12 -","4","1","","Tharra, Prabhakararao; Baire, Beeraiah","Regioselective, cascade [3+2] annulation of β-naphthols (resorcinols) with Z-enoate propargylic alcohols: a novel entry for the synthesis of complex naphtho(benzo)furans.","Chemical communications (Cambridge, England)","2016","52","99","14290","14293","10.1039/c6cc08126f","","","0.71073","MoKα","","0.0637","0.0471","","","0.1169","0.1311","","","","","","1.045","","","","has coordinates,has disorder","234656","2020-10-21","18:00:00",""
"7125276","16.9652","0.0011","13.3015","0.0008","18.3142","0.0011","90","","108.16","0.001","90","","3927","0.4","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-(dicyclohexylamino)-6a-(4-(methylthio)phenyl)-6a,7-dihydro-5H-dibenzo[c,g]chromen-7-yl)(4-(methylthio)phenyl)methanone","","- C47 H54 N O2 S2 -","- C47 H54 N O2 S2 -","- C188 H216 N4 O8 S8 -","4","1","","Ruch, Aaron A.; Kong, Fanji; Nesterov, Vladimir N.; Slaughter, LeGrande M","Tetracyclic dihydronaphthalene derivatives via gold-catalyzed aminative homodimerization of ortho-alkynylbenzaldehydes.","Chemical communications (Cambridge, England)","2016","52","98","14133","14136","10.1039/c6cc08132k","","x-ray","0.71073","MoKα","","0.0528","0.044","","","0.1155","0.1246","","","","","","1.004","","","","has coordinates,has disorder","234659","2020-10-21","18:00:00",""
"7125277","13.279","0.0006","14.462","0.0007","15.6401","0.0012","100.277","0.001","96.426","0.001","115.812","0.001","2598.8","0.3","200","2","200","2","","","","","","","","7","P -1","-P 1","2","chloride-bridge cyclohexyl-Johnphos-gold(I) dimer, SbF6- salt","mu-chlorobis[(2-biphenyldicyclohexylphosphine)gold(I)] hexafluoroantimonate","","- C50 H66 Au2 Cl3 F6 P2 Sb -","- C50 H66 Au2 Cl3 F6 P2 Sb -","- C100 H132 Au4 Cl6 F12 P4 Sb2 -","2","1","","Ruch, Aaron A.; Kong, Fanji; Nesterov, Vladimir N.; Slaughter, LeGrande M","Tetracyclic dihydronaphthalene derivatives via gold-catalyzed aminative homodimerization of ortho-alkynylbenzaldehydes.","Chemical communications (Cambridge, England)","2016","52","98","14133","14136","10.1039/c6cc08132k","","x-ray","0.71073","MoKα","","0.0327","0.0291","","","0.0798","0.0829","","","","","","1.034","","","","has coordinates","234659","2020-10-21","18:00:00",""
"7125278","11.0496","0.0007","12.2287","0.0008","14.2619","0.001","64.774","0.001","82.424","0.001","88.269","0.001","1727.4","0.2","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","5-(dicyclohexylamino)-2,9-difluoro-6a-phenyl-6a,7-dihydro- 5H-dibenzo[c,g]chromen-7-yl)(phenyl)methanone","","- C42.5 H42 Cl F2 N O2 -","- C42.5 H42 Cl F2 N O2 -","- C85 H84 Cl2 F4 N2 O4 -","2","1","","Ruch, Aaron A.; Kong, Fanji; Nesterov, Vladimir N.; Slaughter, LeGrande M","Tetracyclic dihydronaphthalene derivatives via gold-catalyzed aminative homodimerization of ortho-alkynylbenzaldehydes.","Chemical communications (Cambridge, England)","2016","52","98","14133","14136","10.1039/c6cc08132k","","x-ray","0.71073","MoKα","","0.0926","0.0723","","","0.1933","0.2113","","","","","","1.04","","","","has coordinates","234659","2020-10-21","18:00:00",""
"7125279","10.8442","0.0008","13.8546","0.0011","18.575","0.0014","90","","92.116","0.001","90","","2788.8","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(Diisopropylamino)-6a-phenyl-6a,7-dihydro-5H-dibenzo[c,g]chromen-7-yl)(phenyl)methanone","","- C36 H35 N O2 -","- C36 H35 N O2 -","- C144 H140 N4 O8 -","4","1","","Ruch, Aaron A.; Kong, Fanji; Nesterov, Vladimir N.; Slaughter, LeGrande M","Tetracyclic dihydronaphthalene derivatives via gold-catalyzed aminative homodimerization of ortho-alkynylbenzaldehydes.","Chemical communications (Cambridge, England)","2016","52","98","14133","14136","10.1039/c6cc08132k","","x-ray","0.71073","MoKα","","0.0497","0.0403","","","0.0971","0.1039","","","","","","1.027","","","","has coordinates","234659","2020-10-21","18:00:00",""
"7125280","12.6921","0.001","17.3656","0.0014","14.0302","0.0012","90","","99.986","0.001","90","","3045.5","0.4","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-(diisopropylamino)-6a-(4-methoxyphenyl)-6a,7-dihydro-5H-dibenzo[c,g]chromen-7-yl)(4-methoxyphenyl)methanone","","- C38 H39 N O4 -","- C38 H39 N O4 -","- C152 H156 N4 O16 -","4","1","","Ruch, Aaron A.; Kong, Fanji; Nesterov, Vladimir N.; Slaughter, LeGrande M","Tetracyclic dihydronaphthalene derivatives via gold-catalyzed aminative homodimerization of ortho-alkynylbenzaldehydes.","Chemical communications (Cambridge, England)","2016","52","98","14133","14136","10.1039/c6cc08132k","","x-ray","0.71073","MoKα","","0.0614","0.049","","","0.1215","0.1326","","","","","","1.05","","","","has coordinates,has disorder","234659","2020-10-21","18:00:00",""
"7125281","10.7269","0.0006","11.206","0.0008","14.4819","0.0009","86.134","0.005","88.938","0.005","81.551","0.006","1717.93","0.19","100.01","0.1","100.01","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C39 H53 Ge N2 O -","- C39 H53 Ge N2 O -","- C78 H106 Ge2 N4 O2 -","2","1","","Wu, Yile; Shan, Changkai; Sun, Ying; Chen, Peng; Ying, Jianxi; Zhu, Jun; Liu, Liu Leo; Zhao, Yufen","Main group metal-ligand cooperation of N-heterocyclic germylene: an efficient catalyst for hydroboration of carbonyl compounds.","Chemical communications (Cambridge, England)","2016","52","95","13799","13802","10.1039/c6cc08147a","","x-ray","1.54184","CuKα","","0.0734","0.0618","","","0.1661","0.197","","","","","","1.08","","","","has coordinates","234662","2020-10-21","18:00:00",""
"7125282","5.6126","0.0011","8.3452","0.0017","12.339","0.003","88.55","0.03","78.74","0.03","87.54","0.03","566.2","0.2","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H24 O4 -","- C28 H24 O4 -","- C28 H24 O4 -","1","0.5","","Zhou, Yuefeng; Ma, Jun; Chen, Kai; Jiang, Huanfeng; Zhu, Shifa","Selectivity-switchable oxidation of tetraarylethylenes to fused polycyclic compounds.","Chemical communications (Cambridge, England)","2016","52","91","13345","13348","10.1039/c6cc08155j","","","0.71073","MoKα","","0.054","0.045","","","0.1259","0.1323","","","","","","1.0654","","","","has coordinates","234664","2020-10-21","18:00:00",""
"7125283","10.4453","0.0016","10.599","0.0016","10.8669","0.0018","86.506","0.004","84.424","0.003","71.57","0.003","1135.4","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H24 O6 -","- C28 H24 O6 -","- C56 H48 O12 -","2","1","","Zhou, Yuefeng; Ma, Jun; Chen, Kai; Jiang, Huanfeng; Zhu, Shifa","Selectivity-switchable oxidation of tetraarylethylenes to fused polycyclic compounds.","Chemical communications (Cambridge, England)","2016","52","91","13345","13348","10.1039/c6cc08155j","","","0.71073","MoKα","","0.0825","0.0567","","","0.1442","0.163","","","","","","1.019","","","","has coordinates","234664","2020-10-21","18:00:00",""
"7125284","10.2062","0.0014","19.416","0.003","10.5696","0.0014","90","","109.487","0.003","90","","1974.5","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 O3 -","- C26 H20 O3 -","- C104 H80 O12 -","4","1","","Zhou, Yuefeng; Ma, Jun; Chen, Kai; Jiang, Huanfeng; Zhu, Shifa","Selectivity-switchable oxidation of tetraarylethylenes to fused polycyclic compounds.","Chemical communications (Cambridge, England)","2016","52","91","13345","13348","10.1039/c6cc08155j","","","0.71073","MoKα","","0.0708","0.0551","","","0.1314","0.141","","","","","","1.056","","","","has coordinates","234664","2020-10-21","18:00:00",""
"7125285","15.5616","0.0004","24.9422","0.0005","15.8574","0.0005","90","","104.681","0.003","90","","5954","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-3Te","2-3Te","","- C30 H30 O6 Te3 -","- C30 H30 O6 Te3 -","- C240 H240 O48 Te24 -","8","2","","Wang, Shitao; Li, Xuexiang; Hou, Xueqing; Sun, Yantao; Shao, Xiangfeng","Tritellurasumanene: ultrasound assisted one-pot synthesis and extended valence adducts with bromine.","Chemical communications (Cambridge, England)","2016","52","100","14486","14489","10.1039/c6cc08170c","","","0.71073","MoKα","","0.1187","0.0705","","","0.1499","0.1794","","","","","","1.022","","","","has coordinates","234668","2020-10-21","18:00:00",""
"7125286","8.3225","0.0003","15.076","0.0006","23.2305","0.0009","90","","95.2","0.04","90","","2902.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-2Te","2-2Te","","- C30 H32 O6 Te2 -","- C30 H32 O6 Te2 -","- C120 H128 O24 Te8 -","4","1","","Wang, Shitao; Li, Xuexiang; Hou, Xueqing; Sun, Yantao; Shao, Xiangfeng","Tritellurasumanene: ultrasound assisted one-pot synthesis and extended valence adducts with bromine.","Chemical communications (Cambridge, England)","2016","52","100","14486","14489","10.1039/c6cc08170c","","","1.5418","CuKα","","0.0699","0.0664","","","0.1805","0.1857","","","","","","1.086","","","","has coordinates","234668","2020-10-21","18:00:00",""
"7125287","10.889","0.002","10.89","0.002","18.299","0.004","86.12","0.03","86.29","0.03","71.19","0.03","2047.2","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","2-3TeBr6","","","- C30 H36 Br6 O9 Te3 -","- C30 H36 Br6 O9 Te3 -","- C60 H72 Br12 O18 Te6 -","2","1","","Wang, Shitao; Li, Xuexiang; Hou, Xueqing; Sun, Yantao; Shao, Xiangfeng","Tritellurasumanene: ultrasound assisted one-pot synthesis and extended valence adducts with bromine.","Chemical communications (Cambridge, England)","2016","52","100","14486","14489","10.1039/c6cc08170c","","","0.71073","MoKα","","0.1091","0.0936","","","0.1958","0.2274","","","","","","1.052","","","","has coordinates,has disorder","234668","2020-10-21","18:00:00",""
"7125288","8.2014","0.0004","10.9469","0.0006","12.241","0.0004","99.951","0.003","94.49","0.003","103.679","0.002","1043.58","0.09","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C23 H27 N3 O2 -","- C23 H27 N3 O2 -","- C46 H54 N6 O4 -","2","1","","El Mamouni, El Hachemia; Cattoen, Martin; Cordier, Marie; Cossy, Janine; Arseniyadis, Stellios; Ilitki, Hocine; El Kaïm, Laurent","Selective Tsuji-Trost type C-allylation of hydrazones: a straightforward entry into 4,5-dihydropyrazoles.","Chemical communications (Cambridge, England)","2016","52","100","14490","14493","10.1039/c6cc08171a","","","0.71069","MoKα","","0.0948","0.0597","","","0.1259","0.1458","","","","","","1.097","","","","has coordinates","234671","2020-10-21","18:00:00",""
"7125289","9.3834","0.0001","11.8498","0.0003","22.2318","0.0005","87.603","0.001","82.452","0.001","71.9","0.001","2329.3","0.08","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C26 H31 N3 O2 -","- C26 H31 N3 O2 -","- C104 H124 N12 O8 -","4","2","","El Mamouni, El Hachemia; Cattoen, Martin; Cordier, Marie; Cossy, Janine; Arseniyadis, Stellios; Ilitki, Hocine; El Kaïm, Laurent","Selective Tsuji-Trost type C-allylation of hydrazones: a straightforward entry into 4,5-dihydropyrazoles.","Chemical communications (Cambridge, England)","2016","52","100","14490","14493","10.1039/c6cc08171a","","","0.71069","MoKα","","0.0697","0.0524","","","0.1288","0.1425","","","","","","1.028","","","","has coordinates","234671","2020-10-21","18:00:00",""
"7125290","29.5009","0.0005","7.6614","0.0002","21.6674","0.0005","90","","92.924","0.001","90","","4890.85","0.19","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H27 N4 O5 P -","- C25 H27 N4 O5 P -","- C200 H216 N32 O40 P8 -","8","1","","El Mamouni, El Hachemia; Cattoen, Martin; Cordier, Marie; Cossy, Janine; Arseniyadis, Stellios; Ilitki, Hocine; El Kaïm, Laurent","Selective Tsuji-Trost type C-allylation of hydrazones: a straightforward entry into 4,5-dihydropyrazoles.","Chemical communications (Cambridge, England)","2016","52","100","14490","14493","10.1039/c6cc08171a","","","0.71069","MoKα","","0.097","0.0737","","","0.1934","0.2136","","","","","","1.062","","","","has coordinates,has disorder","234671","2020-10-21","18:00:00",""
"7125291","17.5411","0.0005","17.5411","0.0005","34.6975","0.0015","90","","90","","90","","10676.1","0.6","240","0.1","240","0.1","","","","","","","","7","I 4/m m m","-I 4 2","139","","","","- C24 H24 Cu4 I4 N4 O16 Zr3 -","- C24 H24 Cu4 I4 N4 O16 Zr3 -","- C96 H96 Cu16 I16 N16 O64 Zr12 -","4","0.125","","Tan, Yan-Xi; Yang, Xue; Li, Bei-Bei; Yuan, Daqiang","Rational design of a flu-type heterometallic cluster-based Zr-MOF.","Chemical communications (Cambridge, England)","2016","52","94","13671","13674","10.1039/c6cc08191f","","","1.54184","CuKα","","0.0391","0.0343","","","0.0967","0.1011","","","","","","1.061","","","","has coordinates","234673","2020-10-21","18:00:00",""
"7125292","7.88851","0.00018","8.9545","0.0002","14.9033","0.0003","92.1745","0.0019","99.8465","0.0019","107.839","0.002","982.77","0.04","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H18 Br N O5 S -","- C20 H18 Br N O5 S -","- C40 H36 Br2 N2 O10 S2 -","2","1","","Modak, Atanu; Mondal, Anirban; Watile, Rahul; Mukherjee, Semanti; Maiti, Debabrata","Remote meta C-H bond functionalization of 2-phenethylsulphonic acid and 3-phenylpropanoic acid derivatives.","Chemical communications (Cambridge, England)","2016","52","96","13916","13919","10.1039/c6cc08302a","","x-ray","0.71073","MoKα","","0.0301","0.0266","","","0.0661","0.0675","","","","","","1.07","","","","has coordinates","234675","2020-10-21","18:00:00",""
"7125293","8.3702","0.001","12.3731","0.0011","13.2427","0.0008","108.688","0.007","105.715","0.008","98.948","0.009","1205.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H26 N2 O6 S -","- C25 H26 N2 O6 S -","- C50 H52 N4 O12 S2 -","2","1","","Modak, Atanu; Mondal, Anirban; Watile, Rahul; Mukherjee, Semanti; Maiti, Debabrata","Remote meta C-H bond functionalization of 2-phenethylsulphonic acid and 3-phenylpropanoic acid derivatives.","Chemical communications (Cambridge, England)","2016","52","96","13916","13919","10.1039/c6cc08302a","","x-ray","0.71073","MoKα","","0.0919","0.0644","","","0.1559","0.1798","","","","","","1.024","","","","has coordinates","234675","2020-10-21","18:00:00",""
"7125294","8.6647","0.0006","15.3884","0.0011","17.0772","0.0012","90","","90","","90","","2277","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","4h","4h","","- C21 H23 Br F3 N O6 -","- C21 H23 Br F3 N O6 -","- C84 H92 Br4 F12 N4 O24 -","4","1","","Zhi, Ying; Zhao, Kun; Liu, Qiang; Wang, Ai; Enders, Dieter","Asymmetric synthesis of functionalized trifluoromethyl-substituted pyrrolidines via an organocatalytic domino Michael/Mannich [3+2] cycloaddition.","Chemical communications (Cambridge, England)","2016","52","97","14011","14014","10.1039/c6cc08352h","","","0.71073","MoKα","","0.0515","0.0367","","","0.0797","0.0837","","","","","","1.032","","","","has coordinates","234677","2020-10-21","18:00:00",""
"7125295","27.556","0.0019","7.4414","0.0005","19.1328","0.0015","90","","109.435","0.003","90","","3699.7","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H19 N O -","- C26 H19 N O -","- C208 H152 N8 O8 -","8","2","","Bagle, Pradip N.; Mane, Manoj V.; Vanka, K.; Shinde, Dinesh R.; Shaikh, Samir R.; Gonnade, Rajesh G.; Patil, Nitin T.","Au(i)/Ag(i) co-operative catalysis: interception of Ag-bound carbocations with α-gold(i) enals in the imino-alkyne cyclizations with N-allenamides.","Chemical communications (Cambridge, England)","2016","52","100","14462","14465","10.1039/c6cc08385d","","","0.71073","MoKα","","0.0625","0.0571","","","0.1469","0.154","","","","","","1.104","","","","has coordinates","234679","2020-10-21","18:00:00",""
"7125296","12.108","0.003","12.5","0.002","18.24","0.004","76.07","0.011","74.442","0.011","82.349","0.011","2574.3","1","150","2","149.99","","","","","","","","","9","P -1","-P 1","2","","","","- C56 H46 Br Cl2 F4 O3 P3 Pd S -","- C56 H46 Br Cl2 F4 O3 P3 Pd S -","- C112 H92 Br2 Cl4 F8 O6 P6 Pd2 S2 -","2","1","","Firth, Kelly F.; Möbus, Juri; Stephan, Douglas W.","A pendant phosphorus Lewis acid: route to a palladium-benzoyl derived phosphorane.","Chemical communications (Cambridge, England)","2016","52","97","13967","13970","10.1039/c6cc08561j","","","0.71073","MoKα","","0.079","0.0582","","","0.1503","0.1647","","","","","","1.055","","","","has coordinates","234681","2020-10-21","18:00:00",""
"7125297","12.225","0.0005","12.671","0.0005","19.4112","0.0008","98.543","0.002","90.489","0.002","118.142","0.002","2611.3","0.19","150","2","150.02","","","","","","","","","6","P -1","-P 1","2","","","","- C63 H53 Br F2 P3 Pd -","- C63 H53 Br F2 P3 Pd -","- C126 H106 Br2 F4 P6 Pd2 -","2","1","","Firth, Kelly F.; Möbus, Juri; Stephan, Douglas W.","A pendant phosphorus Lewis acid: route to a palladium-benzoyl derived phosphorane.","Chemical communications (Cambridge, England)","2016","52","97","13967","13970","10.1039/c6cc08561j","","","0.71073","MoKα","","0.0366","0.0277","","","0.0678","0.0717","","","","","","1.0313","","","","has coordinates","234681","2020-10-21","18:00:00",""
"7125298","14.2329","0.0009","20.4798","0.0013","19.1729","0.0011","90","","96.688","0.003","90","","5550.6","0.6","150","2","149.99","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C57.5 H47 Br Cl3 F4 O4 P3 Pd S -","- C57.5 H47 Br Cl3 F4 O4 P3 Pd S -","- C230 H188 Br4 Cl12 F16 O16 P12 Pd4 S4 -","4","1","","Firth, Kelly F.; Möbus, Juri; Stephan, Douglas W.","A pendant phosphorus Lewis acid: route to a palladium-benzoyl derived phosphorane.","Chemical communications (Cambridge, England)","2016","52","97","13967","13970","10.1039/c6cc08561j","","","0.71073","MoKα","","0.0632","0.039","","","0.0813","0.0898","","","","","","1.028","","","","has coordinates,has disorder","234681","2020-10-21","18:00:00",""
"7125299","10.3977","0.0003","14.1488","0.0004","22.4532","0.0007","90.093","0.001","90.531","0.0011","90.097","0.001","3303.05","0.17","100","","100","","","","","","","","","6","P -1","-P 1","2","NiCycP","[Ni([(1,4,8,11-tetraazacyclotetradecan-1-yl)methylene]phosphonic acid)]n","","- C22 H54 N8 Ni2 O10.01 P2 -","- C22 H54 N8 Ni2 O10 P2 -","- C88 H216 N32 Ni8 O40 P8 -","4","2","","Neri, Gaia; Forster, Mark; Walsh, James J.; Robertson, C. M.; Whittles, T. J.; Farràs, Pau; Cowan, Alexander J.","Photochemical CO<sub>2</sub> reduction in water using a co-immobilised nickel catalyst and a visible light sensitiser.","Chemical communications (Cambridge, England)","2016","52","99","14200","14203","10.1039/c6cc08590c","","","0.71073","MoKα","","0.0762","0.064","","","0.1399","0.1443","","","","","","1.116","","","","has coordinates","234685","2020-10-21","18:00:00",""
"7125300","13.936","0.007","7.077","0.003","22.807","0.01","90","","90","","90","","2249.3","1.8","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H10 N2 -","- C15 H10 N2 -","- C120 H80 N16 -","8","1","","Liao, Zhen-Yuan; Liao, Pen-Yuan; Chien, Tun-Cheng","CuI-Catalyzed intramolecular aminocyanation of terminal alkynes in N-(2-ethynylphenyl)-N-sulfonylcyanamides via Cu-vinylidene intermediates.","Chemical communications (Cambridge, England)","2016","52","100","14404","14407","10.1039/c6cc08601b","","","0.71073","MoKα","","0.1301","0.0582","","","0.1137","0.1461","","","","","","0.976","","","","has coordinates","234689","2020-10-21","18:00:00",""
"7125301","9.3811","0.0004","20.8484","0.001","8.6963","0.0004","90","","99.098","0.002","90","","1679.43","0.13","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 N2 O2 S -","- C19 H16 N2 O2 S -","- C76 H64 N8 O8 S4 -","4","1","","Liao, Zhen-Yuan; Liao, Pen-Yuan; Chien, Tun-Cheng","CuI-Catalyzed intramolecular aminocyanation of terminal alkynes in N-(2-ethynylphenyl)-N-sulfonylcyanamides via Cu-vinylidene intermediates.","Chemical communications (Cambridge, England)","2016","52","100","14404","14407","10.1039/c6cc08601b","","","0.71073","MoKα","","0.0786","0.0536","","","0.1392","0.1575","","","","","","1.026","","","","has coordinates","234689","2020-10-21","18:00:00",""
"7125302","9.0829","0.0015","10.2351","0.0014","15.664","0.002","90","","97.384","0.01","90","","1444.1","0.4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 N2 O2 S -","- C16 H12 N2 O2 S -","- C64 H48 N8 O8 S4 -","4","1","","Liao, Zhen-Yuan; Liao, Pen-Yuan; Chien, Tun-Cheng","CuI-Catalyzed intramolecular aminocyanation of terminal alkynes in N-(2-ethynylphenyl)-N-sulfonylcyanamides via Cu-vinylidene intermediates.","Chemical communications (Cambridge, England)","2016","52","100","14404","14407","10.1039/c6cc08601b","","","0.71073","MoKα","","0.1015","0.0529","","","0.1059","0.1274","","","","","","1.017","","","","has coordinates","234689","2020-10-21","18:00:00",""
"7125303","11.111","0.0006","17.6697","0.0012","22.6965","0.0014","90","","90","","90","","4456","0.5","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C45 H21 Dy F18 N2 O6 -","- C45 H21 Dy F18 N2 O6 -","- C180 H84 Dy4 F72 N8 O24 -","4","1","","Ou-Yang, J-K; Saleh, N.; Fernandez Garcia, G.; Norel, L.; Pointillart, F.; Guizouarn, T.; Cador, O.; Totti, F.; Ouahab, L.; Crassous, J.; Le Guennic, B.","Improved slow magnetic relaxation in optically pure helicene-based Dy<sup>III</sup> single molecule magnets.","Chemical communications (Cambridge, England)","2016","52","100","14474","14477","10.1039/c6cc08638a","","","0.71073","MoKα","","0.0471","0.0377","","","0.0803","0.0982","","","","","","1.109","","","","has coordinates","234691","2020-10-21","18:00:00",""
"7125304","11.1191","0.0009","17.6604","0.0018","22.693","0.002","90","","90","","90","","4456.2","0.7","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C45 H21 Dy F18 N2 O6 -","- C45 H21 Dy F18 N2 O6 -","- C180 H84 Dy4 F72 N8 O24 -","4","1","","Ou-Yang, J-K; Saleh, N.; Fernandez Garcia, G.; Norel, L.; Pointillart, F.; Guizouarn, T.; Cador, O.; Totti, F.; Ouahab, L.; Crassous, J.; Le Guennic, B.","Improved slow magnetic relaxation in optically pure helicene-based Dy<sup>III</sup> single molecule magnets.","Chemical communications (Cambridge, England)","2016","52","100","14474","14477","10.1039/c6cc08638a","","","0.71073","MoKα","","0.1638","0.0814","","","0.1666","0.2315","","","","","","0.992","","","","has coordinates","234691","2020-10-21","18:00:00",""
"7125305","13.216","0.0005","13.9132","0.0006","14.5959","0.0006","67.984","0.002","72.454","0.002","84.724","0.002","2371.71","0.17","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H28 Dy F18 N2 O6 -","- C48 H28 Dy F18 N2 O6 -","- C96 H56 Dy2 F36 N4 O12 -","2","1","","Ou-Yang, J-K; Saleh, N.; Fernandez Garcia, G.; Norel, L.; Pointillart, F.; Guizouarn, T.; Cador, O.; Totti, F.; Ouahab, L.; Crassous, J.; Le Guennic, B.","Improved slow magnetic relaxation in optically pure helicene-based Dy<sup>III</sup> single molecule magnets.","Chemical communications (Cambridge, England)","2016","52","100","14474","14477","10.1039/c6cc08638a","","","0.71073","MoKα","","0.043","0.0369","","","0.1012","0.1116","","","","","","1.102","","","","has coordinates,has disorder","234691","2020-10-21","18:00:00",""
"7125306","13.0425","0.0003","10.2377","0.0003","16.1011","0.0004","90","","109.601","0.001","90","","2025.32","0.09","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H19 N O -","- C28 H19 N O -","- C112 H76 N4 O4 -","4","2","","Hornillos, Valentín; Ros, Abel; Ramírez-López, Pedro; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M","Synthesis of axially chiral heterobiaryl alkynes via dynamic kinetic asymmetric alkynylation.","Chemical communications (Cambridge, England)","2016","52","98","14121","14124","10.1039/c6cc08997f","","","1.54178","CuKα","","0.0322","0.032","","","0.1021","0.1025","","","","","","0.98","","","","has coordinates","234694","2020-10-21","18:00:00",""
"7125307","7.6244","0.0004","7.9489","0.0004","18.4283","0.0009","90","","93.193","0.002","90","","1115.12","0.1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H21 N O -","- C32 H21 N O -","- C64 H42 N2 O2 -","2","1","","Hornillos, Valentín; Ros, Abel; Ramírez-López, Pedro; Iglesias-Sigüenza, Javier; Fernández, Rosario; Lassaletta, José M","Synthesis of axially chiral heterobiaryl alkynes via dynamic kinetic asymmetric alkynylation.","Chemical communications (Cambridge, England)","2016","52","98","14121","14124","10.1039/c6cc08997f","","","1.54175","CuKα","","0.0383","0.0378","","","0.108","0.1088","","","","","","1.058","","","","has coordinates","234694","2020-10-21","18:00:00",""
"7125308","6.2373","0.0003","36.3214","0.0019","8.6667","0.0003","90","","94.598","0.004","90","","1957.1","0.16","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H25 N O5 -","- C22 H25 N O5 -","- C88 H100 N4 O20 -","4","1","","Fuentes de Arriba, Angel L.; Urbitsch, Felix; Dixon, Darren J.","Umpolung synthesis of branched α-functionalized amines from imines via photocatalytic three-component reductive coupling reactions.","Chemical communications (Cambridge, England)","2016","52","100","14434","14437","10.1039/c6cc09172e","","","1.54184","CuKα","","0.0626","0.0542","","0.1311","0.1262","0.1311","","","","","","0.935","","","","has coordinates","234696","2020-10-21","18:00:00",""